data_2lr6_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 2lr6 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.449 ' CD2' HD12 ' B' ' 149' ' ' LEU . 41.3 p90 . . . . . 0 N--CA 1.477 0.916 0 N-CA-C 113.518 0.933 . . . . 75.43 113.518 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.502 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 54.0 t30 -59.53 -51.94 67.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.924 0.392 . . . . 73.24 111.334 -175.485 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.507 HG22 ' HB3' ' B' ' 179' ' ' LEU . 3.4 mp -61.1 -39.51 82.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.822 -0.627 . . . . 74.31 111.25 -175.036 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.3 mt -62.19 -35.44 78.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.808 0.337 . . . . 74.14 110.964 179.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 47.8 ttt180 -69.46 -44.01 72.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.219 -0.446 . . . . 65.34 110.454 177.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 36.9 mt-10 -66.02 -26.19 67.42 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.136 -0.484 . . . . 65.22 111.263 -178.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -100.01 1.06 42.14 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.275 -0.421 . . . . 74.55 111.079 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 62.29 45.61 6.61 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 113.044 0.757 . . . . 72.13 113.044 173.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.439 ' HB3' ' HB2' ' B' ' 151' ' ' PHE . 13.5 m-85 -78.16 -8.01 57.77 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.287 -0.635 . . . . 75.04 109.287 169.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 54.24 79.4 0.34 Allowed Pre-proline 0 C--O 1.233 0.211 0 CA-C-N 114.706 -1.134 . . . . 73.32 111.286 -173.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.44 ' HB3' HD11 ' B' ' 149' ' ' LEU . 7.7 Cg_exo -72.45 165.72 31.86 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.48 2.12 . . . . 74.44 110.771 175.082 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.918 ' HD2' ' HB2' ' B' ' 150' ' ' ALA . 0.1 OUTLIER . . . . . 0 C--N 1.32 -0.716 0 C-N-CA 120.313 -0.555 . . . . 75.43 110.315 -179.511 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.569 ' HA ' ' HA ' ' A' ' 61' ' ' SER . 0.3 OUTLIER . . . . . 0 CA--C 1.507 -0.693 0 N-CA-C 108.884 -0.784 . . . . 74.54 108.884 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.545 ' HB3' ' CD1' ' A' ' 51' ' ' PHE . 8.5 mp -74.2 88.9 1.99 Allowed 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 109.705 -0.479 . . . . 74.1 109.705 172.327 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.955 ' HB1' ' HD2' ' B' ' 142' ' ' LYS . . . -90.62 86.66 6.45 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.709 -0.678 . . . . 71.14 109.337 173.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.545 ' CD1' ' HB3' ' A' ' 49' ' ' LEU . 44.9 p90 -124.03 167.23 14.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.343 -0.844 . . . . 71.32 110.741 -173.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.7 tppt? -90.85 112.36 24.16 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.934 -0.575 . . . . 73.34 110.448 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.521 ' HB2' ' CE2' ' A' ' 51' ' ' PHE . 46.1 t -124.76 113.71 18.31 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.032 -0.531 . . . . 73.21 110.162 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 t70 64.7 24.49 12.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.736 -0.666 . . . . 74.2 111.487 173.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 105.94 -19.3 38.45 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.239 -0.982 . . . . 72.13 113.381 177.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.423 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 10.3 pt-20 -115.68 147.48 40.8 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 117.262 0.531 . . . . 72.32 111.127 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 43.6 mm -81.31 120.48 33.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.057 -0.52 . . . . 74.51 110.033 176.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.738 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 28.9 mmmt -101.78 148.9 24.74 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.992 -0.549 . . . . 75.03 109.537 179.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -121.29 109.23 14.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.97 0.414 . . . . 74.54 110.927 173.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.41 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 69.0 m-85 -117.16 101.53 8.54 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.122 0.487 . . . . 72.54 111.027 177.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.569 ' HA ' ' HA ' ' A' ' 48' ' ' LYS . 3.2 p -85.58 -12.99 50.2 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.448 -0.797 . . . . 75.1 110.241 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.662 ' OD2' ' HB3' ' A' ' 64' ' ' GLN . 33.6 t70 -127.68 113.38 15.96 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.349 -0.841 . . . . 72.33 109.396 177.312 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.91 -23.01 62.19 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.088 -0.505 . . . . 74.32 111.113 -175.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.662 ' HB3' ' OD2' ' A' ' 62' ' ' ASP . 0.7 OUTLIER -58.27 -50.25 74.25 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.814 -0.81 . . . . 74.44 108.814 172.172 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.1 m -64.74 -27.8 69.15 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.335 -0.848 . . . . 75.31 110.855 177.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 64.1 tp -69.05 -32.47 71.99 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.78 0.324 . . . . 74.32 110.63 177.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 62.9 ttt180 -61.55 -34.61 75.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.938 0.399 . . . . 75.42 110.177 175.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.58 ' HE2' ' OE1' ' A' ' 64' ' ' GLN . 62.8 mttm -68.63 -26.09 65.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.204 0.526 . . . . 74.12 110.607 178.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.446 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 78.1 t80 -85.83 -52.9 5.45 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.691 -0.686 . . . . 71.14 111.257 -177.233 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.418 ' HA ' ' HB2' ' A' ' 73' ' ' LYS . . . -68.04 -14.56 63.06 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.282 0.475 . . . . 70.41 112.282 -175.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.0 p -78.55 -32.04 47.67 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.758 0.313 . . . . 62.34 110.723 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.446 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 10.5 pt20 -91.65 -21.62 20.7 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.092 0.473 . . . . 65.32 109.945 177.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.418 ' HB2' ' HA ' ' A' ' 70' ' ' ALA . 29.6 mmmt -79.97 106.3 11.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.784 -0.644 . . . . 75.21 110.375 175.189 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.8 t -58.22 -37.74 75.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.964 0.411 . . . . 74.23 110.351 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.4 m -58.8 -52.41 65.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.105 -0.498 . . . . 73.32 111.141 178.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 84.1 mtp -80.5 -17.07 52.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.197 -0.456 . . . . 74.01 111.11 -175.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.628 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 25.1 ttmm -62.66 -24.6 67.7 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-N 116.279 -0.419 . . . . 75.15 110.152 175.188 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -92.48 -9.23 42.2 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.301 0.572 . . . . 73.5 110.132 -177.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.588 ' HB3' HG21 ' B' ' 133' ' ' ILE . 78.5 mt -95.62 -50.87 4.77 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.857 -1.065 . . . . 72.51 109.978 178.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.9 mt -90.71 -5.52 55.63 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.967 -0.56 . . . . 74.53 111.94 -172.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.628 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 64.5 pttt -58.34 -19.01 31.73 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.228 0.455 . . . . 75.21 112.228 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -76.89 -29.54 55.81 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.784 0.326 . . . . 73.3 110.865 -178.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . 0.453 HG23 ' HG ' ' A' ' 84' ' ' LEU . 27.6 m -108.35 -27.21 3.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.403 -0.362 . . . . 62.31 111.716 -178.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.453 ' HG ' HG23 ' A' ' 83' ' ' VAL . 93.9 mt . . . . . 0 C--N 1.326 -0.413 0 CA-C-N 116.658 -0.246 . . . . 74.51 110.418 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 20.2 p90 . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 114.024 1.12 . . . . 74.34 114.024 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 132' ' ' ASN . . . . . 0.455 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 53.3 t30 -59.86 -55.23 36.78 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.713 0.292 . . . . 73.21 111.096 -176.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 133' ' ' ILE . . . . . 0.588 HG21 ' HB3' ' A' ' 79' ' ' LEU . 39.3 mm -58.84 -38.38 72.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.484 0.659 . . . . 73.52 110.771 -179.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.49 HD22 HD22 ' A' ' 49' ' ' LEU . 10.2 mp -66.3 -34.36 77.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.304 -0.862 . . . . 74.21 111.094 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -67.47 -40.38 85.31 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.036 -0.529 . . . . 72.12 110.152 178.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 136' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' B' ' 132' ' ' ASN . 27.2 mt-10 -69.16 -42.74 75.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.883 -0.599 . . . . 74.12 111.086 -178.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -87.1 1.18 53.79 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.324 -0.398 . . . . 72.13 111.396 -178.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 37.5 t70 53.78 66.99 1.08 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.681 0.753 . . . . 63.4 111.581 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -90.38 -1.35 57.9 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.281 -0.872 . . . . 73.5 109.838 171.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 57.34 67.33 2.52 Favored Pre-proline 0 C--O 1.234 0.283 0 CA-C-N 114.855 -1.066 . . . . 72.54 110.902 -176.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . 0.427 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 68.4 Cg_endo -74.94 161.14 39.42 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.244 1.963 . . . . 74.43 111.299 179.181 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 142' ' ' LYS . . . . . 0.955 ' HD2' ' HB1' ' A' ' 50' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.602 0 C-N-CA 120.447 -0.501 . . . . 74.33 110.256 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' B' ' 160' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.509 -0.613 0 N-CA-C 109.33 -0.618 . . . . 72.3 109.33 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.617 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 1.8 mm? -67.49 92.73 0.31 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.463 -0.79 . . . . 75.43 110.99 -178.264 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.918 ' HB2' ' HD2' ' A' ' 42' ' ' LYS . . . -88.89 78.76 7.5 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.116 -0.947 . . . . 62.25 109.368 173.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 151' ' ' PHE . . . . . 0.617 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 49.5 p90 -111.22 164.45 12.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.557 -0.747 . . . . 73.04 110.802 -176.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 152' ' ' LYS . . . . . 0.401 ' HD3' HD13 ' B' ' 157' ' ' ILE . 6.8 tppt? -90.22 116.4 28.18 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.861 -0.609 . . . . 72.0 110.85 -177.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 153' ' ' CYS . . . . . . . . . . . . . 44.6 t -130.69 114.07 14.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.291 -0.413 . . . . 65.42 110.328 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 64.26 22.8 12.92 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.578 -0.737 . . . . 73.41 112.56 173.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 109.75 -24.52 19.32 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.143 -1.027 . . . . 72.34 112.988 176.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -112.73 149.89 32.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 117.163 0.482 . . . . 73.12 110.889 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . 0.401 HD13 ' HD3' ' B' ' 152' ' ' LYS . 46.9 mm -79.81 130.91 35.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.074 -0.512 . . . . 74.11 109.953 176.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 158' ' ' LYS . . . . . 0.842 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 26.5 mmmt -100.71 157.3 16.79 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.068 -0.716 . . . . 72.1 109.068 178.212 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -132.58 109.32 9.67 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.94 0.4 . . . . 73.22 110.919 174.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 160' ' ' PHE . . . . . 0.427 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 80.2 m-85 -120.73 115.41 23.26 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.115 -0.493 . . . . 74.13 111.149 -179.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 33.9 m -98.03 4.6 49.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.187 0.518 . . . . 72.2 110.603 178.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -147.14 126.55 13.16 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.065 -0.516 . . . . 74.11 109.751 -177.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 92.5 mt -71.82 -21.27 61.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.515 -0.311 . . . . 73.34 110.859 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 164' ' ' GLN . . . . . 0.519 ' OE1' ' HE3' ' B' ' 168' ' ' LYS . 0.6 OUTLIER -69.73 -41.77 74.86 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.779 -0.822 . . . . 74.31 108.779 176.103 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 32.6 t -67.69 -42.38 82.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.295 -0.866 . . . . 63.22 109.895 175.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 64.9 tp -63.66 -31.52 72.72 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.041 -0.527 . . . . 75.22 110.489 178.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . 0.521 ' HD2' HD23 ' B' ' 184' ' ' LEU . 56.3 ttt180 -56.8 -45.86 81.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.226 -0.443 . . . . 74.15 110.868 176.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 168' ' ' LYS . . . . . 0.519 ' HE3' ' OE1' ' B' ' 164' ' ' GLN . 93.1 mttt -63.8 -30.56 71.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.123 -0.489 . . . . 74.05 110.864 -178.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -80.46 -47.88 13.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.947 -0.57 . . . . 73.43 110.61 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -66.18 -29.6 69.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.948 -0.569 . . . . 65.52 111.619 -175.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 34.2 p -68.68 -45.4 71.76 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 121.124 -0.23 . . . . 75.34 110.914 -179.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -82.88 -3.87 57.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.191 0.52 . . . . 73.03 110.858 -178.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 173' ' ' LYS . . . . . 0.43 ' HB3' ' HE3' ' B' ' 173' ' ' LYS . 24.2 mmmt -86.74 111.02 20.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.078 -0.51 . . . . 75.42 110.035 173.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 48.3 t -55.82 -37.48 68.72 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.797 0.332 . . . . 75.3 111.711 -177.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 8.6 p -78.26 -46.64 19.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.845 0.355 . . . . 75.01 111.602 -178.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 81.6 mtp -76.29 -12.79 60.14 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.352 -0.385 . . . . 73.14 111.688 -175.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 19.0 ttmm -57.24 -30.09 64.34 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.869 -0.605 . . . . 74.31 111.15 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -100.58 5.02 43.85 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.356 0.598 . . . . 75.44 110.716 -175.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 179' ' ' LEU . . . . . 0.507 ' HB3' HG22 ' A' ' 33' ' ' ILE . 63.4 mt -97.51 -53.59 3.4 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.578 -0.737 . . . . 74.43 110.217 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 180' ' ' LEU . . . . . 0.473 ' HB3' HD12 ' B' ' 184' ' ' LEU . 3.5 mm? -86.39 1.39 51.42 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.807 -0.633 . . . . 64.51 111.322 -176.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -49.33 -29.14 5.65 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.111 0.782 . . . . 75.31 113.111 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -73.12 -28.51 62.3 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.413 0.523 . . . . 64.14 112.413 -174.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 183' ' ' VAL . . . . . 0.742 HG21 ' HG ' ' B' ' 184' ' ' LEU . 31.5 m -112.01 -14.32 10.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.864 0.364 . . . . 73.3 111.122 179.437 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 184' ' ' LEU . . . . . 0.742 ' HG ' HG21 ' B' ' 183' ' ' VAL . 42.5 mt . . . . . 0 C--N 1.325 -0.484 0 CA-C-N 116.12 -0.491 . . . . 75.54 110.133 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 45.7 p90 . . . . . 0 N--CA 1.456 -0.145 0 CA-C-O 120.781 0.324 . . . . 75.14 110.838 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.51 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 6.8 t30 -62.42 -44.15 97.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.319 -0.4 . . . . 71.21 111.124 -178.217 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 39.5 mm -55.39 -46.22 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-O 121.332 0.587 . . . . 63.35 110.705 177.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.507 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 68.7 mt -65.46 -32.59 74.29 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.684 -0.689 . . . . 73.41 111.178 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -70.0 -38.99 76.15 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.798 0.332 . . . . 75.53 110.219 177.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.51 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 6.0 mm-40 -70.21 -23.08 62.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.172 -0.467 . . . . 75.43 110.819 179.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 28.9 m-80 -99.59 1.95 44.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.227 -0.442 . . . . 73.32 110.927 177.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 60.85 43.47 11.9 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.543 -0.753 . . . . 74.2 112.185 176.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.507 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 3.4 m-85 -80.06 -11.66 59.75 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.875 -0.602 . . . . 75.43 109.451 171.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 57.32 73.93 0.72 Allowed Pre-proline 0 C--O 1.231 0.108 0 CA-C-N 114.806 -1.088 . . . . 71.23 111.054 -175.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.547 ' C ' ' HE2' ' A' ' 42' ' ' LYS . 83.3 Cg_endo -86.42 147.27 8.66 Favored 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.735 2.29 . . . . 72.32 111.685 177.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.547 ' HE2' ' C ' ' A' ' 41' ' ' PRO . 1.4 mpmm? . . . . . 0 C--N 1.322 -0.614 0 CA-C-O 121.326 0.584 . . . . 72.04 111.072 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.449 -0.502 0 N-CA-C 108.867 -0.79 . . . . 75.4 108.867 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.796 ' H ' HD23 ' A' ' 49' ' ' LEU . 0.3 OUTLIER -76.15 91.47 3.16 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.32 0.581 . . . . 55.11 110.891 -175.404 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.557 ' HB2' HG21 ' A' ' 59' ' ' THR . . . -84.54 78.32 9.86 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.177 -0.92 . . . . 72.24 109.638 173.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.503 ' HB3' ' HA ' ' B' ' 141' ' ' PRO . 52.1 p90 -97.98 162.57 13.16 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.012 -0.54 . . . . 63.4 110.791 -174.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -93.17 119.73 32.69 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.118 -0.492 . . . . 73.35 110.078 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.475 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 45.4 t -128.7 108.96 10.9 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.372 -0.376 . . . . 61.23 110.621 178.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.5 t70 72.88 2.15 4.27 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.581 -0.736 . . . . 72.01 111.97 171.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 129.39 -25.87 4.46 Favored Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.184 -1.008 . . . . 71.23 112.587 179.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.47 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 11.2 pt-20 -106.07 149.18 26.96 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.643 -0.423 . . . . 71.44 110.788 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 44.6 mm -84.39 117.14 29.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.032 -0.531 . . . . 71.14 109.778 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.568 ' HB3' ' CE1' ' A' ' 60' ' ' PHE . 30.1 mmmt -99.2 102.43 14.08 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.328 -0.396 . . . . 64.44 110.362 -177.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.557 HG21 ' HB2' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -82.86 101.91 11.3 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.242 -0.435 . . . . 75.51 110.588 178.186 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.568 ' CE1' ' HB3' ' A' ' 58' ' ' LYS . 4.8 m-85 -108.25 136.1 48.47 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.43 -0.35 . . . . 71.14 111.576 -177.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.4 p -118.73 -0.46 11.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.996 -0.547 . . . . 71.33 111.006 174.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.462 ' HB2' ' HG ' ' A' ' 65' ' ' SER . 35.7 m-20 -130.43 135.58 48.14 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 120.853 0.359 . . . . 74.52 111.841 -177.269 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.9 tp -70.69 -34.96 72.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.713 -0.676 . . . . 75.31 109.594 174.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -57.45 -44.98 85.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.607 -0.724 . . . . 75.15 110.615 176.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.462 ' HG ' ' HB2' ' A' ' 62' ' ' ASP . 50.9 m -69.75 -33.12 72.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.842 -0.617 . . . . 75.35 110.829 179.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 46.6 tp -68.22 -37.79 81.21 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.993 -0.373 . . . . 74.31 109.993 177.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 51.6 ttp180 -58.6 -50.16 74.82 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.874 -0.603 . . . . 73.42 111.0 178.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.529 ' HD3' ' N ' ' A' ' 69' ' ' PHE . 0.0 OUTLIER -67.7 -39.59 84.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.799 0.333 . . . . 72.13 111.396 -178.202 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.529 ' N ' ' HD3' ' A' ' 68' ' ' LYS . 74.0 t80 -67.11 -44.83 78.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.897 -0.592 . . . . 75.35 110.933 -178.58 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.74 -30.01 70.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.347 -0.388 . . . . 73.34 111.134 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.8 t -72.72 -35.16 67.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.34 -0.391 . . . . 53.03 110.818 -178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -86.81 -11.9 49.57 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.035 0.445 . . . . 74.55 110.729 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.475 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 27.3 mmmt -89.82 122.77 33.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.095 -0.502 . . . . 74.02 110.2 175.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.5 m -63.99 -38.65 91.85 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.585 0.231 . . . . 65.14 111.344 -178.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.406 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 10.7 p -72.98 -40.23 65.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.882 0.372 . . . . 55.41 111.367 -179.544 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.446 ' HA ' HD13 ' A' ' 79' ' ' LEU . 74.3 mtp -85.18 -15.21 44.46 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.935 0.346 . . . . 64.22 111.935 -174.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 81.0 tttt -59.84 -37.47 79.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.217 -0.447 . . . . 72.45 111.79 -174.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.621 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 28.2 mt-10 -102.51 7.74 40.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.644 0.735 . . . . 73.12 110.651 -176.221 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.636 ' HB3' HG23 ' B' ' 133' ' ' ILE . 70.0 mt -87.3 -41.18 13.85 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.138 -0.937 . . . . 75.34 109.549 174.037 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -101.02 6.44 43.46 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.609 -0.723 . . . . 64.03 110.509 -178.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.621 ' HB3' ' HA ' ' A' ' 78' ' ' GLU . 18.8 ptmt -61.27 -12.83 14.86 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.447 -0.797 . . . . 74.33 112.124 -178.147 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -81.57 -46.08 14.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.751 0.31 . . . . 73.33 110.931 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 24.6 m -84.62 -18.83 9.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.1 0.476 . . . . 73.55 110.66 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 55.3 mt . . . . . 0 C--N 1.323 -0.555 0 N-CA-C 108.448 -0.945 . . . . 72.43 108.448 171.655 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 40.5 p90 . . . . . 0 N--CA 1.454 -0.241 0 CA-C-O 121.261 0.553 . . . . 74.12 109.604 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -63.02 -63.54 1.17 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.136 -0.938 . . . . 65.13 111.72 -173.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 133' ' ' ILE . . . . . 0.636 HG23 ' HB3' ' A' ' 79' ' ' LEU . 48.6 mm -60.45 -37.58 75.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.399 0.618 . . . . 74.41 110.609 -178.326 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.524 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 79.0 mt -60.94 -40.03 91.71 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.473 -0.785 . . . . 75.44 111.143 179.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' B' ' 135' ' ' ARG . 28.4 ttt180 -65.61 -42.93 91.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.733 0.301 . . . . 74.43 110.359 177.408 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -61.33 -35.62 77.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.867 -0.606 . . . . 64.24 111.317 -179.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -98.09 9.21 43.42 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.186 -0.461 . . . . 74.34 110.841 -179.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 63.1 41.09 8.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.422 -0.808 . . . . 74.22 112.619 171.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 139' ' ' PHE . . . . . 0.524 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 26.3 m-85 -74.01 -15.39 61.09 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.541 -0.54 . . . . 75.01 109.541 170.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 52.5 74.62 0.75 Allowed Pre-proline 0 C--O 1.234 0.262 0 CA-C-N 114.89 -1.05 . . . . 71.11 110.952 -176.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . 0.503 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 95.8 Cg_endo -88.22 178.42 3.04 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.875 2.383 . . . . 74.44 111.904 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.325 -0.497 0 CA-C-O 121.33 0.586 . . . . 75.3 111.211 -179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.448 -0.57 0 CA-C-O 121.251 0.548 . . . . 74.14 109.756 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.716 HD22 ' H ' ' B' ' 149' ' ' LEU . 0.3 OUTLIER -76.96 90.11 3.54 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.273 -0.421 . . . . 74.44 110.692 -178.34 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.582 ' HA ' ' O ' ' B' ' 158' ' ' LYS . . . -80.15 85.0 5.76 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.531 -0.759 . . . . 74.52 109.831 174.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 151' ' ' PHE . . . . . 0.434 ' HB3' ' HA ' ' A' ' 41' ' ' PRO . 52.1 p90 -104.67 165.5 11.02 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.924 -0.58 . . . . 75.12 110.319 -177.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 2.4 tppp? -93.65 116.11 28.59 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.006 -0.543 . . . . 65.32 110.032 176.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 153' ' ' CYS . . . . . 0.42 ' C ' ' H ' ' B' ' 155' ' ' GLY . 23.1 t -88.85 -131.61 0.08 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.322 -0.854 . . . . 75.41 110.028 178.229 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . 0.46 ' CG ' ' HZ1' ' B' ' 173' ' ' LYS . 0.2 OUTLIER -74.06 35.98 0.09 Allowed 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 123.962 0.905 . . . . 71.44 111.556 -179.068 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 155' ' ' GLY . . . . . 0.42 ' H ' ' C ' ' B' ' 153' ' ' CYS . . . 110.59 -17.18 28.39 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.676 -0.773 . . . . 60.41 111.541 -177.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 156' ' ' GLU . . . . . 0.423 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 13.1 pt-20 -106.06 140.85 38.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.879 0.371 . . . . 74.45 110.631 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 41.3 mm -82.93 120.65 34.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 109.494 -0.558 . . . . 75.52 109.494 176.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 158' ' ' LYS . . . . . 0.582 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 31.6 mmmt -103.99 132.75 49.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.682 0.277 . . . . 74.15 111.084 -176.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -112.58 103.7 11.76 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.212 -0.449 . . . . 74.43 111.377 177.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 160' ' ' PHE . . . . . 0.454 ' CD2' HD12 ' B' ' 166' ' ' LEU . 64.6 m-85 -120.01 143.69 47.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.135 -0.484 . . . . 73.05 110.722 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 18.9 p -118.57 -18.37 9.08 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.49 0.662 . . . . 64.24 109.481 173.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -111.16 138.66 47.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.293 -0.867 . . . . 63.33 109.206 178.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.9 pp -81.69 -10.96 59.25 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.858 -0.423 . . . . 72.35 109.858 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -65.49 -51.98 56.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.364 0.602 . . . . 73.0 109.83 175.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 165' ' ' SER . . . . . 0.506 ' O ' ' HG3' ' B' ' 168' ' ' LYS . 0.3 OUTLIER -70.42 -31.64 68.91 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.363 -0.835 . . . . 64.11 110.623 179.287 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . 0.454 HD12 ' CD2' ' B' ' 160' ' ' PHE . 68.7 tp -69.99 -41.36 74.51 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.179 -0.464 . . . . 75.14 110.593 177.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . 0.673 ' HG3' HD12 ' B' ' 184' ' ' LEU . 50.6 ttp180 -61.88 -47.63 84.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.364 -0.38 . . . . 74.31 110.772 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 168' ' ' LYS . . . . . 0.506 ' HG3' ' O ' ' B' ' 165' ' ' SER . 0.0 OUTLIER -65.22 -36.54 84.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.925 0.393 . . . . 73.11 110.879 -179.711 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -65.52 -48.62 71.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.738 -0.665 . . . . 74.34 110.606 175.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.02 -37.04 83.41 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.403 -0.362 . . . . 60.13 111.446 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 10.9 t -68.43 -22.31 64.61 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.401 -0.363 . . . . 73.22 111.26 -177.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -102.05 3.53 38.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.955 0.407 . . . . 74.44 110.633 178.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 173' ' ' LYS . . . . . 0.46 ' HZ1' ' CG ' ' B' ' 154' ' ' ASP . 27.4 mmmt -104.27 111.81 24.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.181 -0.463 . . . . 75.03 110.747 -179.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 25.2 m -52.8 -31.75 40.38 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 123.241 0.338 . . . . 61.33 111.898 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 11.0 p -81.84 -49.49 10.3 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.757 0.313 . . . . 74.44 111.622 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 176' ' ' MET . . . . . 0.415 ' HA ' HD13 ' B' ' 179' ' ' LEU . 82.1 mtp -80.78 -18.61 47.04 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.201 0.445 . . . . 72.4 112.201 -172.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 177' ' ' LYS . . . . . 0.432 ' HB2' ' O ' ' B' ' 173' ' ' LYS . 79.8 tttt -60.88 -31.31 70.79 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.183 -0.462 . . . . 74.43 110.936 -176.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . 0.898 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 44.4 mt-10 -99.15 3.28 46.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.457 0.646 . . . . 65.54 110.641 -174.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 179' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' B' ' 176' ' ' MET . 86.3 mt -93.38 -56.44 2.94 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.464 -0.789 . . . . 72.51 110.378 178.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -76.54 -10.98 59.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.665 -0.698 . . . . 75.32 111.666 -176.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 181' ' ' LYS . . . . . 0.898 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 17.5 ptmt -61.37 -9.43 5.36 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.851 0.686 . . . . 74.43 112.851 -174.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -76.09 -31.91 58.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.998 0.428 . . . . 73.02 110.585 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 20.8 m -113.24 -10.77 12.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.016 -0.538 . . . . 75.42 110.806 178.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 184' ' ' LEU . . . . . 0.673 HD12 ' HG3' ' B' ' 167' ' ' ARG . 95.7 mt . . . . . 0 C--N 1.327 -0.388 0 N-CA-C 108.977 -0.749 . . . . 74.44 108.977 173.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 43.5 p90 . . . . . 0 C--O 1.234 0.252 0 CA-C-O 120.637 0.256 . . . . 75.23 111.062 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.583 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 6.5 t30 -65.69 -42.5 91.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.27 -0.423 . . . . 72.12 110.922 -173.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.619 HG22 ' HB3' ' B' ' 179' ' ' LEU . 30.2 mm -74.26 -32.8 32.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.643 0.735 . . . . 72.23 110.479 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.483 HD12 HD21 ' B' ' 149' ' ' LEU . 76.6 mt -70.75 -34.48 71.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.387 -0.824 . . . . 73.0 111.749 -175.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.55 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 7.9 ptm180 -69.62 -37.24 76.76 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.969 0.414 . . . . 74.44 110.536 178.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.583 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 38.2 mt-10 -63.33 -44.68 94.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.61 -0.723 . . . . 75.14 111.387 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 -95.41 5.99 50.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.255 -0.43 . . . . 75.2 110.973 -175.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 55.48 65.77 1.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.355 -0.839 . . . . 74.01 112.685 177.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -90.53 -3.61 57.48 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.461 -0.791 . . . . 73.31 109.397 170.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 56.98 71.17 1.18 Allowed Pre-proline 0 CA--C 1.53 0.186 0 CA-C-N 114.958 -1.019 . . . . 64.42 111.565 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.461 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 85.1 Cg_endo -85.18 170.11 9.69 Favored 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 122.456 2.104 . . . . 73.41 111.693 177.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.684 ' HD3' ' HB2' ' B' ' 150' ' ' ALA . 5.1 mptp? . . . . . 0 C--N 1.323 -0.586 0 C-N-CA 121.07 -0.252 . . . . 73.43 110.359 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.436 0 CA-C-O 121.475 0.655 . . . . 74.42 109.79 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.776 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.9 mp -75.55 94.8 3.22 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.353 -0.84 . . . . 74.31 110.949 -175.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -87.25 59.33 5.5 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.637 -0.505 . . . . 63.34 109.637 172.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.776 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 54.9 p90 -88.08 166.94 14.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.097 -0.501 . . . . 74.24 110.713 -176.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.4 tppp? -96.15 131.51 42.52 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.524 -0.762 . . . . 73.44 110.415 179.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.473 ' SG ' ' HE2' ' A' ' 69' ' ' PHE . 49.7 t -139.35 107.73 5.82 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.869 0.366 . . . . 73.22 110.478 175.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 t70 70.54 13.56 7.36 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.429 -0.805 . . . . 74.04 111.56 172.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 120.17 -29.6 5.92 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.291 -0.957 . . . . 64.51 112.702 177.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.435 ' CD ' ' HD3' ' A' ' 58' ' ' LYS . 12.7 pt-20 -102.17 155.2 18.36 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 110.064 -0.347 . . . . 75.3 110.064 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 47.8 mm -86.86 129.2 38.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.494 -0.558 . . . . 74.32 109.494 176.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.544 ' HB3' ' CE2' ' A' ' 60' ' ' PHE . 31.7 mmmt -117.56 97.01 5.65 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 121.266 -0.174 . . . . 64.15 110.767 -176.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.559 ' HA ' ' O ' ' A' ' 49' ' ' LEU . 0.6 OUTLIER -79.09 110.31 14.22 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.872 0.323 . . . . 74.1 111.872 -179.855 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.544 ' CE2' ' HB3' ' A' ' 58' ' ' LYS . 82.6 m-85 -129.47 140.1 51.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.803 0.335 . . . . 65.5 110.369 176.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.7 p -124.01 13.32 9.09 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.234 0.54 . . . . 62.43 110.557 176.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -140.01 -177.74 5.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.849 -0.614 . . . . 72.21 110.738 -176.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 26.6 tp -127.91 32.6 4.91 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.746 -0.661 . . . . 73.32 109.972 -179.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -120.82 -42.66 2.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.171 0.51 . . . . 73.45 109.871 177.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.6 m -81.14 -43.05 19.96 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.641 -0.503 . . . . 73.34 109.641 174.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.527 HD13 ' HB2' ' A' ' 60' ' ' PHE . 5.9 tt -63.4 -41.52 98.76 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.447 -0.575 . . . . 74.52 109.447 177.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.6 ttt180 -60.0 -38.66 83.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.808 -0.633 . . . . 74.24 110.996 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.1 mtmm -64.71 -43.24 94.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.935 0.397 . . . . 75.02 110.673 175.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.473 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 64.1 t80 -63.44 -44.91 93.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.002 -0.545 . . . . 74.42 110.541 179.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.46 -25.58 66.79 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.855 -0.612 . . . . 72.25 111.95 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.1 t -80.71 -28.48 36.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.506 0.193 . . . . 73.41 111.21 -177.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -88.38 -19.32 26.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.209 0.528 . . . . 75.44 110.16 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -86.68 118.8 26.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.586 -0.733 . . . . 72.12 110.67 176.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.4 m -62.21 -40.33 95.75 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.004 0.43 . . . . 74.04 110.303 178.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 36.4 t -63.67 -49.11 74.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.679 -0.691 . . . . 73.42 110.787 -179.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 68.9 mtp -78.62 -14.99 59.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.295 -0.411 . . . . 71.3 111.183 -175.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.426 ' HB2' ' HE3' ' A' ' 77' ' ' LYS . 38.8 ttmt -64.3 -32.65 74.34 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.082 -0.508 . . . . 75.42 110.549 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.459 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 20.6 mm-40 -88.99 -4.26 58.48 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 121.639 0.733 . . . . 71.41 110.127 -178.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.595 ' HB3' HG22 ' B' ' 133' ' ' ILE . 49.0 mt -95.19 -52.96 3.97 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.835 -1.075 . . . . 73.03 109.583 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.66 ' HB3' HD12 ' A' ' 84' ' ' LEU . 4.1 mm? -84.8 -0.75 54.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.298 -0.864 . . . . 71.33 111.412 -176.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.459 ' HD3' ' HA ' ' A' ' 78' ' ' GLU . 64.7 pttt -56.74 -14.44 3.34 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 111.895 0.331 . . . . 73.05 111.895 176.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -63.4 -42.11 98.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.995 0.426 . . . . 75.23 110.862 176.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 7.5 p -111.52 -15.64 9.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.308 0.575 . . . . 64.12 111.009 -176.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.66 HD12 ' HB3' ' A' ' 80' ' ' LEU . 11.2 mp . . . . . 0 C--N 1.327 -0.412 0 N-CA-C 109.882 -0.414 . . . . 54.52 109.882 173.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 49.8 p90 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.769 0.319 . . . . 75.54 111.291 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 132' ' ' ASN . . . . . 0.467 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 50.4 t30 -59.2 -51.1 71.44 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 116.117 -0.492 . . . . 74.32 110.965 -178.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 133' ' ' ILE . . . . . 0.595 HG22 ' HB3' ' A' ' 79' ' ' LEU . 4.0 mp -67.88 -34.09 65.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.367 0.603 . . . . 73.03 110.563 -177.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.607 HD13 HD22 ' A' ' 49' ' ' LEU . 92.4 mt -73.47 -25.24 60.39 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.834 -0.621 . . . . 74.43 111.985 -175.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . 0.586 ' HG3' ' N ' ' B' ' 136' ' ' GLU . 3.5 ptp180 -75.96 -40.43 53.96 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.54 -0.464 . . . . 74.35 109.82 175.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 136' ' ' GLU . . . . . 0.586 ' N ' ' HG3' ' B' ' 135' ' ' ARG . 10.4 mm-40 -58.7 -45.51 89.35 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.355 -0.839 . . . . 62.03 111.142 -179.183 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -95.81 5.83 50.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.783 -0.644 . . . . 64.23 111.323 -175.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 52.54 70.11 0.61 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.512 -0.767 . . . . 73.21 112.742 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -96.09 4.88 52.21 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.55 -0.75 . . . . 74.32 109.989 172.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 55.57 67.69 2.87 Favored Pre-proline 0 C--O 1.232 0.155 0 CA-C-N 115.023 -0.989 . . . . 74.43 111.238 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . 0.527 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 90.1 Cg_endo -88.2 165.31 6.93 Favored 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 122.528 2.152 . . . . 74.2 112.415 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? . . . . . 0 C--N 1.325 -0.459 0 CA-C-N 115.816 -0.629 . . . . 73.41 109.512 175.493 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . 0.582 ' H ' ' HD3' ' B' ' 148' ' ' LYS . 0.3 OUTLIER . . . . . 0 CA--C 1.513 -0.476 0 N-CA-C 109.123 -0.695 . . . . 73.43 109.123 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.708 ' HB3' ' HD1' ' B' ' 151' ' ' PHE . 9.7 mp -71.65 90.61 1.05 Allowed 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.51 -0.768 . . . . 74.21 110.511 -178.233 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.684 ' HB2' ' HD3' ' A' ' 42' ' ' LYS . . . -87.7 68.29 9.43 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.621 -0.511 . . . . 70.52 109.621 174.654 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 151' ' ' PHE . . . . . 0.708 ' HD1' ' HB3' ' B' ' 149' ' ' LEU . 53.5 p90 -100.17 164.91 11.76 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.763 -0.653 . . . . 72.44 110.622 -176.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 5.3 tppp? -93.98 120.16 33.86 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.744 -0.662 . . . . 74.24 110.431 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 153' ' ' CYS . . . . . 0.476 ' SG ' ' HE2' ' B' ' 169' ' ' PHE . 43.5 t -125.77 108.77 11.82 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 116.448 -0.342 . . . . 61.55 110.528 177.316 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 2.0 t70 68.8 10.25 7.8 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.527 -0.76 . . . . 71.24 111.852 170.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 119.99 -19.94 9.35 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.314 -0.946 . . . . 75.24 112.824 179.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 156' ' ' GLU . . . . . 0.571 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 9.9 pt-20 -112.95 139.04 48.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.798 0.333 . . . . 75.43 110.284 178.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 44.0 mm -75.48 118.4 21.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.216 -0.447 . . . . 74.44 109.919 177.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 158' ' ' LYS . . . . . 0.571 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 31.7 mmmt -107.78 94.52 5.12 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.557 -0.292 . . . . 70.44 110.896 -175.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 159' ' ' THR . . . . . 0.488 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.7 OUTLIER -74.44 117.21 15.99 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.954 0.406 . . . . 63.32 110.852 177.852 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 160' ' ' PHE . . . . . 0.512 ' CD2' HD12 ' B' ' 166' ' ' LEU . 41.4 m-85 -126.29 120.09 29.07 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.139 -0.482 . . . . 74.43 110.003 176.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 25.5 p -101.1 6.7 43.37 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.378 0.609 . . . . 73.33 109.844 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -150.29 162.22 40.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.322 -0.854 . . . . 71.52 110.137 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . 0.452 ' CD1' HD21 ' B' ' 166' ' ' LEU . 35.3 tp -96.28 -1.61 47.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.171 0.51 . . . . 74.11 111.151 -176.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 164' ' ' GLN . . . . . 0.452 ' O ' ' HG2' ' B' ' 168' ' ' LYS . 61.5 tt0 -81.42 -52.03 7.69 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.727 -0.472 . . . . 72.43 109.727 -178.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 3.2 m -67.25 -28.56 68.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.576 -0.738 . . . . 72.21 110.104 177.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . 0.512 HD12 ' CD2' ' B' ' 160' ' ' PHE . 43.5 tp -64.54 -39.47 93.82 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.16 -0.473 . . . . 75.21 110.258 178.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 75.2 ttt180 -65.04 -38.0 89.44 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.818 -0.438 . . . . 75.24 109.818 175.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 168' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' B' ' 164' ' ' GLN . 13.1 mmmm -56.51 -36.95 69.76 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.583 -0.735 . . . . 72.42 110.576 179.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 169' ' ' PHE . . . . . 0.518 ' O ' ' HG2' ' B' ' 173' ' ' LYS . 58.0 t80 -89.54 -47.73 7.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.463 -0.79 . . . . 74.14 110.945 -177.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.18 -33.18 74.05 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.664 0.616 . . . . 75.23 112.664 -176.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 6.5 t -67.54 -20.13 65.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.658 0.266 . . . . 50.31 111.441 -175.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -105.49 -3.2 22.75 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.913 0.387 . . . . 75.42 110.534 179.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 173' ' ' LYS . . . . . 0.579 ' HB2' ' HB2' ' B' ' 176' ' ' MET . 29.8 mmmt -87.23 129.89 34.79 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.176 -0.466 . . . . 63.34 111.017 -178.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 3.5 m -56.66 -45.6 81.56 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.701 -0.681 . . . . 61.04 110.593 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 175' ' ' SER . . . . . 0.463 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 40.1 t -82.92 -49.17 9.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.018 -0.537 . . . . 73.41 111.703 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 176' ' ' MET . . . . . 0.579 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 66.1 mtp -70.75 -20.53 62.62 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.405 0.52 . . . . 74.31 112.405 -169.324 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 177' ' ' LYS . . . . . 0.494 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 88.8 tttt -62.11 -35.01 77.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.982 0.42 . . . . 74.52 110.641 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . 0.454 ' HA ' ' HD3' ' B' ' 181' ' ' LYS . 25.9 mm-40 -91.22 -8.76 47.56 Favored 'General case' 0 CA--C 1.511 -0.519 0 CA-C-O 121.619 0.723 . . . . 73.53 110.213 -176.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 179' ' ' LEU . . . . . 0.619 ' HB3' HG22 ' A' ' 33' ' ' ILE . 81.2 mt -89.9 -48.41 7.24 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.883 -1.053 . . . . 75.32 109.798 178.535 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 180' ' ' LEU . . . . . 0.651 ' HB3' HD11 ' B' ' 184' ' ' LEU . 4.2 mm? -86.17 -11.05 53.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.574 -0.739 . . . . 72.44 111.778 -176.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 181' ' ' LYS . . . . . 0.494 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 64.1 pttt -55.71 -18.3 7.83 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 111.625 0.232 . . . . 73.24 111.625 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -60.16 -46.85 88.27 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.821 0.343 . . . . 75.11 110.879 177.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 17.4 m -105.98 -14.46 9.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.128 -0.487 . . . . 74.13 111.375 -176.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 184' ' ' LEU . . . . . 0.651 HD11 ' HB3' ' B' ' 180' ' ' LEU . 8.2 mp . . . . . 0 C--N 1.324 -0.502 0 N-CA-C 109.739 -0.467 . . . . 74.0 109.739 176.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 81.0 t80 . . . . . 0 C--O 1.233 0.199 0 CA-C-O 120.905 0.383 . . . . 72.23 110.44 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.523 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 8.5 t30 -60.0 -51.7 68.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.629 -0.714 . . . . 75.22 110.698 178.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.471 HG22 ' OD1' ' A' ' 37' ' ' ASN . 50.1 mm -58.67 -53.59 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 116.39 -0.368 . . . . 74.24 110.718 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.444 ' HB2' ' HG3' ' A' ' 41' ' ' PRO . 88.7 mt -54.92 -32.55 61.25 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.148 -0.478 . . . . 73.34 111.759 -178.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 34.6 ttt180 -69.29 -41.28 77.0 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.854 -0.339 . . . . 74.42 110.361 176.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 30.2 mt-10 -68.69 -35.53 77.31 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.299 -0.41 . . . . 71.04 110.353 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.471 ' OD1' HG22 ' A' ' 33' ' ' ILE . 4.3 m120 -73.48 -13.62 61.09 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.122 -0.49 . . . . 72.35 109.806 177.152 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.4 t70 68.4 36.4 3.02 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.202 -0.908 . . . . 73.33 110.982 -178.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -75.67 -22.92 56.26 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.848 -0.615 . . . . 73.41 109.522 172.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 60.31 82.66 0.22 Allowed Pre-proline 0 N--CA 1.463 0.191 0 CA-C-N 114.806 -1.088 . . . . 72.33 111.046 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.749 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 60.1 Cg_endo -87.83 178.24 3.28 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.878 2.385 . . . . 75.24 111.929 177.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.459 0 CA-C-O 120.744 0.307 . . . . 73.12 110.989 -177.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 mptt . . . . . 0 N--CA 1.446 -0.646 0 N-CA-C 107.737 -1.209 . . . . 74.15 107.737 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 35.5 tp -79.96 68.42 6.07 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.497 -0.927 . . . . 74.3 108.497 173.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.592 ' HB2' HG23 ' A' ' 59' ' ' THR . . . -84.3 97.86 9.68 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 114.892 -1.049 . . . . 60.44 110.616 -176.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -111.39 165.99 11.49 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.974 -0.557 . . . . 74.2 110.376 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -90.28 124.9 35.27 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.139 -0.482 . . . . 71.54 110.275 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 14.7 t -138.54 116.88 11.94 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.777 -0.453 . . . . 71.5 109.777 178.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 64.63 16.22 10.2 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.714 0.635 . . . . 63.34 112.714 176.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 107.69 -17.5 36.0 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.068 -1.063 . . . . 74.51 112.412 177.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -111.78 146.66 37.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.777 0.323 . . . . 72.51 110.433 177.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 45.2 mm -79.84 126.9 39.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.165 -0.47 . . . . 74.11 110.14 178.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.469 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 27.6 mmmt -107.33 117.3 33.71 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.113 -0.329 . . . . 74.11 110.113 -179.134 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.592 HG23 ' HB2' ' A' ' 50' ' ' ALA . 2.6 p -93.91 123.88 37.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.166 -0.47 . . . . 74.33 111.044 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.444 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 71.9 m-85 -131.2 135.2 47.19 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.303 -0.408 . . . . 72.33 111.21 178.436 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.7 p -126.55 -5.02 6.51 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.826 -0.624 . . . . 64.24 109.983 175.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -125.32 130.57 52.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.724 -0.671 . . . . 75.33 110.181 178.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.1 mp -73.72 -33.23 64.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.443 . . . . 74.55 111.665 -175.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -60.43 -46.04 91.47 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.32 0.581 . . . . 74.25 110.474 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.0 t -61.54 -46.89 88.01 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.717 -0.674 . . . . 64.32 110.533 177.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 48.3 tp -65.95 -36.61 83.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.015 -0.538 . . . . 74.51 111.436 -177.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -56.78 -41.5 77.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.079 0.466 . . . . 73.13 110.541 176.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.549 ' HZ2' ' HB2' ' A' ' 68' ' ' LYS . 10.4 mtmp? -69.94 -30.86 68.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.891 -0.595 . . . . 74.23 111.08 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.521 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 46.9 t80 -74.49 -45.75 43.93 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.94 -0.573 . . . . 74.4 110.647 -178.198 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.41 -27.53 67.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.295 -0.412 . . . . 74.23 111.364 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 43.8 t -67.29 -42.18 84.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.302 -0.408 . . . . 63.31 111.371 -178.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 13.9 pt20 -73.96 -25.04 59.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.123 0.487 . . . . 74.54 110.618 -176.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.589 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 71.1 mmtt -70.57 139.31 51.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.928 -0.578 . . . . 74.3 110.374 178.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 29.2 m -75.39 -39.87 58.59 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.993 0.425 . . . . 72.53 110.576 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.421 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 15.7 m -78.06 -50.49 11.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.212 -0.449 . . . . 64.24 111.136 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.589 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 83.4 mtp -67.78 -19.86 65.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 75.4 111.792 -174.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.635 ' HB2' ' HZ3' ' A' ' 77' ' ' LYS . 4.6 ttmp? -58.79 -35.3 72.59 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.023 0.439 . . . . 72.51 110.769 177.068 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.407 ' O ' ' HE3' ' A' ' 81' ' ' LYS . 35.6 mt-10 -100.74 2.02 40.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.135 0.493 . . . . 74.12 110.333 -176.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.435 ' HB3' ' CG2' ' B' ' 133' ' ' ILE . 68.0 mt -89.0 -48.61 7.31 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.859 -0.609 . . . . 72.54 110.094 177.163 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.649 ' HB3' HD11 ' A' ' 84' ' ' LEU . 3.5 mm? -90.94 7.54 39.67 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.708 -0.678 . . . . 75.25 111.218 -176.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.407 ' HE3' ' O ' ' A' ' 78' ' ' GLU . 21.3 pttp -56.19 -24.48 42.0 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.532 -0.758 . . . . 74.42 112.112 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -81.06 -9.11 59.87 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 111.997 0.369 . . . . 62.14 111.997 -175.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 12.6 m -127.0 -33.42 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 C-N-CA 120.983 -0.287 . . . . 72.34 111.422 178.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.649 HD11 ' HB3' ' A' ' 80' ' ' LEU . 10.3 mp . . . . . 0 C--N 1.325 -0.47 0 CA-C-N 116.629 -0.26 . . . . 74.14 110.402 178.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 131' ' ' PHE . . . . . 0.445 ' HE1' HH11 ' B' ' 135' ' ' ARG . 53.0 t80 . . . . . 0 N--CA 1.456 -0.125 0 N-CA-C 110.126 -0.324 . . . . 73.12 110.126 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 132' ' ' ASN . . . . . 0.607 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 6.4 t30 -57.92 -48.92 78.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.934 -0.576 . . . . 75.31 111.439 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 133' ' ' ILE . . . . . 0.435 ' CG2' ' HB3' ' A' ' 79' ' ' LEU . 2.4 mp -61.49 -47.52 93.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 CA-C-O 121.056 0.455 . . . . 72.35 110.691 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 87.1 mt -62.65 -31.32 72.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.945 -0.57 . . . . 65.4 110.543 178.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . 0.445 HH11 ' HE1' ' B' ' 131' ' ' PHE . 24.9 ttt180 -73.02 -42.07 63.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.159 -0.473 . . . . 75.43 110.762 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 136' ' ' GLU . . . . . 0.607 ' HG3' ' O ' ' B' ' 132' ' ' ASN . 41.2 mt-10 -60.07 -47.08 87.34 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.204 0.526 . . . . 75.32 110.8 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -86.83 -0.71 56.93 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.693 -0.685 . . . . 74.41 111.083 -177.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 25.6 t0 57.92 67.91 0.9 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.382 -0.826 . . . . 73.42 111.894 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -96.53 -3.91 42.3 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.193 -0.912 . . . . 73.43 109.032 169.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 55.69 78.07 0.4 Allowed Pre-proline 0 C--O 1.232 0.161 0 CA-C-N 114.566 -1.197 . . . . 72.55 111.275 -176.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . 0.413 ' C ' ' HD2' ' B' ' 142' ' ' LYS . 92.8 Cg_endo -82.99 163.41 15.65 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 123.076 2.517 . . . . 73.55 111.432 176.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 142' ' ' LYS . . . . . 0.413 ' HD2' ' C ' ' B' ' 141' ' ' PRO . 0.8 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-O 121.096 0.474 . . . . 71.44 111.321 -175.437 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.511 -0.546 0 N-CA-C 108.544 -0.91 . . . . 74.41 108.544 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 5.4 mp -73.92 86.83 1.78 Allowed 'General case' 0 C--N 1.317 -0.816 0 O-C-N 123.244 0.34 . . . . 75.11 110.104 177.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.574 ' HA ' ' O ' ' B' ' 158' ' ' LYS . . . -91.58 97.61 11.15 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.414 -0.812 . . . . 75.52 109.561 174.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 151' ' ' PHE . . . . . 0.749 ' HB3' ' HA ' ' A' ' 41' ' ' PRO . 47.4 p90 -132.55 166.55 21.83 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.087 -0.506 . . . . 71.02 110.817 -176.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -94.23 114.03 26.06 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.133 -0.485 . . . . 74.11 110.053 178.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 153' ' ' CYS . . . . . 0.46 ' HB2' ' HE1' ' B' ' 151' ' ' PHE . 49.0 t -126.32 120.8 30.83 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.095 -0.502 . . . . 73.12 110.166 178.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 19.6 t70 70.48 6.0 5.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.875 -0.602 . . . . 73.5 111.789 170.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 111.19 -6.4 28.75 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.502 -0.856 . . . . 63.23 112.316 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 156' ' ' GLU . . . . . 0.499 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 12.6 pt-20 -120.91 145.74 47.36 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 110.023 -0.362 . . . . 74.31 110.023 177.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 42.5 mm -77.92 126.94 38.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 109.723 -0.473 . . . . 71.5 109.723 176.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 158' ' ' LYS . . . . . 0.574 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 29.1 mmmt -109.78 137.52 47.46 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.872 -0.418 . . . . 74.25 109.872 179.431 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.01 104.6 8.99 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 123.194 0.309 . . . . 73.34 110.791 178.443 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 160' ' ' PHE . . . . . 0.578 ' CD2' HD12 ' B' ' 166' ' ' LEU . 94.9 m-85 -117.11 122.62 44.62 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.782 -0.367 . . . . 72.44 111.017 178.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 10.5 p -92.81 -5.78 50.34 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.161 -0.472 . . . . 53.0 110.557 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -132.81 157.1 45.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.872 -0.604 . . . . 72.22 109.884 177.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -89.18 -16.84 30.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.274 -0.421 . . . . 71.13 111.055 -177.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 164' ' ' GLN . . . . . 0.404 ' O ' ' HG3' ' B' ' 168' ' ' LYS . 6.2 tp60 -67.94 -51.45 47.57 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.418 -0.355 . . . . 74.41 111.12 -176.573 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 165' ' ' SER . . . . . 0.927 ' HA ' ' HE3' ' B' ' 168' ' ' LYS . 11.5 t -69.6 -34.15 73.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.852 0.358 . . . . 71.0 110.38 -178.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . 0.578 HD12 ' CD2' ' B' ' 160' ' ' PHE . 33.5 tp -68.02 -35.13 77.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.975 0.416 . . . . 75.12 110.515 177.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -62.41 -37.07 84.37 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.11 -0.495 . . . . 74.13 110.464 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 168' ' ' LYS . . . . . 0.927 ' HE3' ' HA ' ' B' ' 165' ' ' SER . 9.2 mtmp? -67.19 -42.87 83.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.866 -0.606 . . . . 74.31 110.295 175.406 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 169' ' ' PHE . . . . . 0.424 ' HA ' ' HG2' ' B' ' 172' ' ' GLN . 63.9 t80 -64.89 -44.28 90.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.5 -0.773 . . . . 75.34 110.755 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -59.1 -31.36 68.85 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.156 -0.475 . . . . 74.53 110.93 177.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 26.3 t -72.34 -41.84 66.04 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.822 -0.626 . . . . 75.51 111.003 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . 0.424 ' HG2' ' HA ' ' B' ' 169' ' ' PHE . 19.2 pt20 -77.34 -22.64 51.54 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.952 0.406 . . . . 70.44 110.781 -176.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 173' ' ' LYS . . . . . 0.854 ' HE2' ' HA ' ' B' ' 173' ' ' LYS . 9.1 mmpt? -75.75 142.68 42.32 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.813 -0.44 . . . . 72.52 109.813 173.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 19.9 m -80.25 -42.46 23.14 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.749 -0.463 . . . . 62.4 109.749 177.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 175' ' ' SER . . . . . 0.522 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 47.4 m -69.49 -50.44 45.25 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.413 -0.358 . . . . 73.42 110.863 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 176' ' ' MET . . . . . 0.702 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 68.0 mtp -63.11 -27.66 69.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.201 -0.454 . . . . 74.35 112.064 -174.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 177' ' ' LYS . . . . . 0.569 ' HZ2' ' HB2' ' B' ' 177' ' ' LYS . 4.3 ttmp? -62.36 -28.66 69.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.008 0.432 . . . . 74.0 110.691 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -100.63 1.04 40.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.281 0.562 . . . . 75.21 110.616 -176.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 179' ' ' LEU . . . . . 0.678 HD11 ' HA ' ' B' ' 176' ' ' MET . 77.2 mt -95.32 -55.67 2.97 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.419 -0.81 . . . . 74.0 109.832 178.291 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -78.98 -6.65 56.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.378 -0.828 . . . . 65.5 111.881 -176.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -55.36 -19.22 8.29 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.436 0.532 . . . . 73.45 112.436 -176.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -60.23 -36.82 78.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.967 0.413 . . . . 74.1 111.125 179.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 13.2 m -123.06 -17.32 4.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.314 -0.403 . . . . 75.3 111.743 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 184' ' ' LEU . . . . . . . . . . . . . 10.2 mp . . . . . 0 C--N 1.327 -0.397 0 N-CA-C 109.723 -0.473 . . . . 73.24 109.723 177.993 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 12.8 p90 . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 114.461 1.282 . . . . 74.2 114.461 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.501 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 11.8 t30 -58.12 -45.09 87.89 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 122.317 0.247 . . . . 73.1 111.578 -175.359 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.46 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 44.4 mm -60.16 -41.16 85.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.033 0.444 . . . . 72.12 111.399 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.547 HD12 HD23 ' B' ' 149' ' ' LEU . 88.3 mt -68.37 -27.57 66.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.189 -0.46 . . . . 75.32 110.691 -178.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -74.07 -34.67 64.11 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.123 -0.49 . . . . 73.54 109.95 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 5.8 mm-40 -71.52 -27.65 63.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.127 0.489 . . . . 73.05 110.736 178.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -101.55 4.37 40.97 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.15 -0.477 . . . . 73.43 111.04 -178.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 60.18 43.99 13.35 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.603 -0.726 . . . . 75.13 112.361 174.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.529 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 11.8 m-85 -77.74 -12.81 60.01 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.122 0.487 . . . . 74.21 109.995 171.182 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 58.9 73.85 0.66 Allowed Pre-proline 0 C--O 1.236 0.345 0 CA-C-N 114.99 -1.005 . . . . 71.41 110.859 -174.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -81.44 148.62 16.43 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.513 2.142 . . . . 74.25 111.304 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.3 mptt . . . . . 0 C--N 1.323 -0.555 0 CA-C-O 121.133 0.492 . . . . 73.51 110.856 -177.954 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.575 0 N-CA-C 109.762 -0.458 . . . . 71.33 109.762 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.704 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.5 mp -67.92 88.42 0.26 Allowed 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.507 -0.769 . . . . 74.35 110.384 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.658 ' H ' ' HB2' ' B' ' 142' ' ' LYS . . . -85.17 58.05 4.81 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.851 -0.426 . . . . 73.54 109.851 176.113 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.704 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 51.5 p90 -86.02 162.55 18.43 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.982 -0.554 . . . . 75.45 110.731 -177.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.1 tptm -98.12 118.91 35.79 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.324 -0.853 . . . . 74.41 110.109 -176.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 46.5 t -120.18 99.89 6.86 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.917 0.389 . . . . 74.33 110.691 178.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 66.84 6.37 4.56 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.413 -0.812 . . . . 73.43 112.968 171.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 133.26 -27.58 3.4 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.403 -0.903 . . . . 72.23 112.636 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -107.86 139.33 42.62 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.253 0.549 . . . . 70.23 110.868 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 45.9 mm -77.37 123.41 33.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.473 -0.785 . . . . 75.11 109.939 178.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.417 ' HE2' ' CE1' ' A' ' 69' ' ' PHE . 30.9 mmmt -107.81 90.65 3.36 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 121.084 -0.246 . . . . 74.54 110.722 -177.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.58 110.09 7.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.33 -0.395 . . . . 70.24 111.572 -178.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -120.92 123.41 42.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.345 -0.388 . . . . 75.1 110.447 174.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 7.0 t -100.71 -4.31 28.48 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.396 0.617 . . . . 72.4 109.357 179.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -142.84 159.4 42.3 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.533 -0.758 . . . . 73.11 110.007 177.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 46.6 tp -87.14 -20.58 26.83 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.272 -0.422 . . . . 75.25 110.452 -175.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -61.6 -51.33 68.97 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.901 -0.591 . . . . 74.32 110.484 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.7 t -66.27 -36.82 83.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.818 -0.628 . . . . 63.21 110.429 178.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.463 HD21 ' O ' ' A' ' 66' ' ' LEU . 6.2 tt -66.1 -37.77 86.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.724 -0.671 . . . . 73.34 110.428 -178.213 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.832 ' HG3' HD21 ' A' ' 84' ' ' LEU . 55.3 ttp180 -57.65 -38.71 75.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 73.12 110.967 -179.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -63.39 -38.36 90.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 75.44 110.979 177.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.417 ' CE1' ' HE2' ' A' ' 58' ' ' LYS . 54.0 t80 -68.41 -47.86 66.17 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.082 -0.508 . . . . 73.24 110.554 -178.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.405 ' HA ' ' HB2' ' A' ' 73' ' ' LYS . . . -62.56 -28.74 70.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.828 0.347 . . . . 74.31 111.349 177.483 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 34.6 t -67.43 -31.15 71.14 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.143 -0.48 . . . . 63.23 111.084 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -100.76 6.71 43.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.353 0.597 . . . . 73.0 109.98 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.405 ' HB2' ' HA ' ' A' ' 70' ' ' ALA . 21.3 mmmt -112.54 102.9 10.96 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.369 -0.832 . . . . 64.35 110.584 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.475 ' O ' ' HB3' ' A' ' 77' ' ' LYS . 14.8 p -54.51 -38.74 66.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.331 -0.395 . . . . 62.41 111.591 -178.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.527 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 47.3 t -66.37 -49.61 66.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.796 0.331 . . . . 74.0 110.919 178.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 80.9 mtp -71.76 -22.22 61.63 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.931 0.396 . . . . 73.43 110.728 -175.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.475 ' HB3' ' O ' ' A' ' 74' ' ' SER . 29.3 tttp -53.82 -34.64 59.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.661 -0.699 . . . . 75.02 110.707 172.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.503 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 32.8 mm-40 -101.7 3.82 40.05 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.75 -0.659 . . . . 74.34 110.419 -175.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.575 HD22 ' ND2' ' B' ' 137' ' ' ASN . 53.2 mt -101.06 -47.26 4.81 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.17 -0.923 . . . . 73.41 109.168 175.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.0 mt -91.86 2.25 56.64 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.716 -0.675 . . . . 74.13 111.024 -175.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.503 ' HD2' ' HA ' ' A' ' 78' ' ' GLU . 20.8 ptmt -54.41 -20.72 8.0 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.146 -0.479 . . . . 70.3 112.278 178.125 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -82.27 -37.62 25.6 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.05 0.453 . . . . 65.31 110.945 178.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 24.3 t -79.75 -40.2 20.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.066 -0.515 . . . . 74.11 110.308 -178.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.832 HD21 ' HG3' ' A' ' 67' ' ' ARG . 10.6 mp . . . . . 0 C--N 1.324 -0.509 0 CA-C-N 115.843 -0.617 . . . . 64.13 110.5 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 131' ' ' PHE . . . . . 0.584 ' HB3' HD21 ' A' ' 49' ' ' LEU . 26.0 p90 . . . . . 0 N--CA 1.481 1.116 0 N-CA-C 113.92 1.081 . . . . 74.01 113.92 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -56.58 -55.12 37.88 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.85 0.357 . . . . 73.51 111.324 -177.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 133' ' ' ILE . . . . . 0.526 HG22 ' HB3' ' A' ' 79' ' ' LEU . 49.1 mm -58.11 -41.42 80.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.002 -0.544 . . . . 74.11 111.247 -178.252 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 84.5 mt -63.65 -36.97 85.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.02 -0.536 . . . . 75.12 110.906 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -72.42 -38.89 68.27 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.653 -0.249 . . . . 62.14 110.488 179.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -64.31 -43.14 95.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.241 -0.436 . . . . 64.11 111.282 179.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 137' ' ' ASN . . . . . 0.575 ' ND2' HD22 ' A' ' 79' ' ' LEU . 92.1 m-20 -92.21 7.61 41.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.161 -0.472 . . . . 73.44 111.227 -178.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 55.63 57.91 4.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.408 -0.815 . . . . 74.43 112.96 174.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -82.97 -10.1 58.96 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.595 -0.891 . . . . 70.43 108.595 165.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 59.6 71.8 0.87 Allowed Pre-proline 0 C--O 1.234 0.274 0 CA-C-N 114.204 -1.362 . . . . 75.42 110.828 -176.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . 0.529 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 89.1 Cg_endo -79.95 144.94 17.34 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.508 2.139 . . . . 75.11 111.591 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 142' ' ' LYS . . . . . 0.658 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 13.9 mptt . . . . . 0 C--N 1.32 -0.684 0 CA-C-O 121.036 0.446 . . . . 70.54 110.448 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . 0.448 ' HB3' ' HB2' ' B' ' 161' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.49 0 N-CA-C 109.758 -0.46 . . . . 74.41 109.758 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.754 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.5 mp -74.14 86.67 1.89 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.597 -0.729 . . . . 74.3 110.359 -178.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.485 ' HB2' HG22 ' B' ' 159' ' ' THR . . . -85.19 62.34 7.44 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.014 -0.539 . . . . 75.12 109.649 174.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 151' ' ' PHE . . . . . 0.754 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 49.6 p90 -92.09 164.01 13.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.015 -0.539 . . . . 74.21 110.737 -175.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -92.08 117.38 29.79 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.704 -0.68 . . . . 75.02 110.794 -178.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 153' ' ' CYS . . . . . 0.605 ' HB3' ' CG ' ' B' ' 158' ' ' LYS . 50.8 t -131.56 116.96 18.1 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.541 -0.3 . . . . 54.42 110.889 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 67.71 11.53 8.41 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.674 -0.694 . . . . 74.43 112.408 175.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 110.06 -16.24 30.37 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.407 -0.901 . . . . 65.15 112.572 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 156' ' ' GLU . . . . . 0.456 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 9.6 pt-20 -116.42 143.98 44.88 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.841 0.353 . . . . 75.34 110.41 177.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 43.5 mm -70.59 118.69 15.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.209 -0.451 . . . . 75.31 110.045 177.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 158' ' ' LYS . . . . . 0.605 ' CG ' ' HB3' ' B' ' 153' ' ' CYS . 31.5 mmmt -104.08 88.31 2.98 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.945 -0.391 . . . . 70.33 109.945 -179.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 159' ' ' THR . . . . . 0.485 HG22 ' HB2' ' B' ' 150' ' ' ALA . 0.2 OUTLIER -75.63 110.19 9.83 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.892 -0.595 . . . . 73.31 111.461 -175.965 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -121.8 124.41 44.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.521 -0.308 . . . . 75.23 111.009 178.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 161' ' ' SER . . . . . 0.448 ' HB2' ' HB3' ' B' ' 148' ' ' LYS . 9.5 t -106.38 0.61 25.05 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.038 -0.727 . . . . 73.53 109.038 176.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -121.28 124.18 44.0 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.499 -0.773 . . . . 71.51 110.339 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 55.2 tp -68.56 -32.77 72.93 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.149 -0.686 . . . . 72.04 109.149 175.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -59.62 -50.32 74.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.333 -0.849 . . . . 73.33 110.922 176.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 32.3 t -67.54 -39.6 85.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.203 -0.453 . . . . 72.2 110.432 -178.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . 0.418 HD21 ' O ' ' B' ' 166' ' ' LEU . 4.1 tt -65.71 -36.46 83.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.07 -0.514 . . . . 74.51 110.294 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . 0.541 ' HG3' HD11 ' B' ' 184' ' ' LEU . 43.3 ttp180 -62.78 -34.88 78.17 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.249 0.547 . . . . 72.01 110.062 179.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -66.66 -38.56 87.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.818 -0.628 . . . . 72.34 110.458 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 169' ' ' PHE . . . . . 0.493 ' CZ ' ' HE3' ' B' ' 173' ' ' LYS . 69.8 t80 -67.05 -46.38 74.54 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.424 -0.807 . . . . 72.44 110.661 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.61 -26.67 68.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.504 -0.316 . . . . 60.52 111.428 179.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 8.6 t -64.98 -27.84 69.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.241 -0.436 . . . . 72.03 110.59 -178.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -106.08 15.98 25.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.248 0.547 . . . . 74.44 110.33 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 173' ' ' LYS . . . . . 0.493 ' HE3' ' CZ ' ' B' ' 169' ' ' PHE . 64.1 mmtt -117.3 115.63 25.64 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.612 -0.722 . . . . 74.44 110.427 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.2 p -57.7 -41.44 81.68 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.909 0.385 . . . . 73.12 111.869 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 175' ' ' SER . . . . . 0.515 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 45.7 t -82.04 -47.08 13.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.827 0.346 . . . . 72.11 110.325 -178.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 176' ' ' MET . . . . . 0.465 ' HB2' ' CB ' ' B' ' 173' ' ' LYS . 70.9 mtp -67.47 -25.85 66.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.454 -0.339 . . . . 64.41 111.866 -174.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 177' ' ' LYS . . . . . 0.484 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 26.0 ttpp -62.11 -35.09 77.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.842 0.353 . . . . 73.03 110.558 176.152 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . 0.579 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 18.8 mm-40 -89.71 -12.11 40.39 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-O 121.661 0.743 . . . . 74.22 109.88 -175.134 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 179' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' B' ' 175' ' ' SER . 74.7 mt -82.08 -47.82 12.13 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.767 -1.106 . . . . 73.34 109.173 175.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 7.5 mt -94.27 0.92 55.95 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.764 -0.653 . . . . 72.42 111.451 -173.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 181' ' ' LYS . . . . . 0.579 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 17.8 ptmt -58.6 -8.44 1.26 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 112.083 0.401 . . . . 74.3 112.083 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -68.29 -37.01 80.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.021 0.438 . . . . 74.1 110.411 175.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 183' ' ' VAL . . . . . 0.45 HG23 HD13 ' B' ' 184' ' ' LEU . 31.2 m -104.47 -15.29 8.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.15 -0.477 . . . . 73.4 111.198 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 184' ' ' LEU . . . . . 0.541 HD11 ' HG3' ' B' ' 167' ' ' ARG . 11.1 mp . . . . . 0 C--N 1.325 -0.488 0 N-CA-C 109.676 -0.49 . . . . 74.11 109.676 175.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.557 ' HB2' ' HB3' ' A' ' 41' ' ' PRO . 11.6 p90 . . . . . 0 CA--C 1.523 -0.081 0 CA-C-O 121.319 0.581 . . . . 75.24 109.536 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.514 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 9.4 t30 -64.87 -54.61 28.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.22 -0.9 . . . . 74.32 111.548 -170.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.481 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 47.7 mm -57.32 -41.67 78.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 CA-C-O 121.03 0.443 . . . . 72.13 111.377 -176.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.783 HD13 HD23 ' B' ' 149' ' ' LEU . 80.0 mt -66.59 -37.38 84.79 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.0 -0.545 . . . . 75.32 110.646 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 20.5 ttt85 -64.47 -40.56 95.93 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.202 -0.454 . . . . 74.12 110.687 178.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.514 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 4.6 mm-40 -72.0 -27.59 62.84 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.991 -0.549 . . . . 74.42 111.671 -177.019 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -100.9 4.29 42.54 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.877 0.37 . . . . 70.11 111.034 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 22.2 t70 61.66 69.68 0.63 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.406 -0.815 . . . . 61.34 111.487 177.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.549 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 7.6 m-85 -107.22 -7.39 16.8 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.231 -0.895 . . . . 73.53 109.882 172.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 68.51 93.73 0.05 OUTLIER Pre-proline 0 C--O 1.232 0.173 0 CA-C-N 114.81 -1.086 . . . . 64.05 111.128 -177.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.557 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 67.5 Cg_endo -75.29 166.27 29.19 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.774 2.316 . . . . 75.42 111.444 175.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.672 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 13.9 tptt . . . . . 0 C--N 1.327 -0.399 0 C-N-CA 119.596 -0.842 . . . . 75.4 112.63 -177.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.41 ' O ' ' HB3' ' B' ' 142' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.509 -0.622 0 N-CA-C 109.02 -0.733 . . . . 75.52 109.02 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.829 HD21 HD12 ' B' ' 134' ' ' LEU . 41.2 tp -75.25 87.96 2.51 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.282 0.563 . . . . 73.44 110.384 -175.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.939 ' HB2' HG23 ' A' ' 59' ' ' THR . . . -97.14 96.36 8.39 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.03 -0.986 . . . . 65.22 110.216 177.324 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 53.7 p90 -111.81 167.61 10.23 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.071 -0.513 . . . . 70.11 110.289 -179.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -97.03 122.91 40.54 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.304 -0.407 . . . . 71.41 111.031 -178.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 46.0 t -132.95 107.5 8.32 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.164 -0.471 . . . . 72.22 110.0 176.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 68.07 23.61 8.03 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.284 0.476 . . . . 74.45 112.284 174.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 104.25 -19.03 44.08 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.277 -0.963 . . . . 74.42 112.428 177.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.451 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 9.7 pt-20 -108.4 138.96 43.83 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.183 0.515 . . . . 74.25 110.723 179.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.0 mm -77.31 124.22 35.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.738 -0.665 . . . . 75.5 109.6 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.451 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 26.2 mmmt -103.78 90.57 3.68 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.816 -0.438 . . . . 74.32 109.816 -179.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.939 HG23 ' HB2' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -81.39 105.64 12.73 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.927 -0.579 . . . . 72.1 111.309 -177.784 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -110.48 133.11 53.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.304 -0.407 . . . . 72.1 110.805 178.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.3 p -79.63 -18.69 50.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.946 -0.57 . . . . 75.44 111.443 -178.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -152.95 172.71 16.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.167 -0.47 . . . . 54.13 110.588 -178.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -84.88 -12.59 53.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.111 -0.495 . . . . 75.53 111.612 -176.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -74.97 -42.66 57.16 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.975 -0.75 . . . . 71.44 108.975 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.554 ' HA ' ' HE2' ' A' ' 68' ' ' LYS . 15.0 m -65.99 -37.07 85.02 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.407 -0.815 . . . . 75.14 110.137 177.159 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.498 HD11 HD13 ' B' ' 134' ' ' LEU . 6.0 tt -68.19 -38.3 81.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.82 -0.627 . . . . 74.21 109.784 178.206 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.665 ' HG3' HD21 ' A' ' 84' ' ' LEU . 54.8 ttp180 -51.41 -38.76 55.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.076 -0.965 . . . . 75.24 111.02 -179.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.554 ' HE2' ' HA ' ' A' ' 65' ' ' SER . 49.8 mtmt -64.94 -51.36 62.27 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.72 -0.673 . . . . 72.1 110.785 178.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -64.52 -42.11 95.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.353 -0.839 . . . . 63.53 111.36 -175.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.19 -33.1 75.2 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.207 -0.451 . . . . 73.21 111.234 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.1 m -74.38 -22.73 59.05 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.673 0.273 . . . . 74.13 111.374 -178.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -98.83 5.98 47.12 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.283 0.563 . . . . 74.43 110.459 177.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.7 mmmt -108.0 109.41 20.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.421 -0.809 . . . . 74.31 109.334 172.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.0 p -51.18 -35.98 38.89 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.469 0.544 . . . . 75.35 112.469 -174.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 41.2 t -78.13 -56.35 4.54 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.674 0.274 . . . . 74.55 110.807 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 78.0 mtp -64.24 -21.38 66.56 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.871 0.367 . . . . 74.13 111.513 -174.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.401 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 88.5 tttt -59.6 -25.64 64.79 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.845 -0.616 . . . . 75.22 111.106 179.253 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.52 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 32.4 mt-10 -104.93 5.49 32.85 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.233 0.54 . . . . 74.02 110.629 -178.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.523 ' HB3' HG22 ' B' ' 133' ' ' ILE . 10.6 mp -91.55 -52.09 4.94 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.42 -0.809 . . . . 75.3 109.447 173.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -81.2 -10.48 59.61 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.511 -0.768 . . . . 61.34 111.256 -176.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.52 ' HD3' ' HA ' ' A' ' 78' ' ' GLU . 64.8 pttt -59.83 -18.46 44.09 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 111.975 0.361 . . . . 75.54 111.975 -176.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -66.2 -36.51 83.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.968 0.413 . . . . 75.33 110.636 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 29.2 m -110.12 4.34 8.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.239 0.543 . . . . 74.33 110.45 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.665 HD21 ' HG3' ' A' ' 67' ' ' ARG . 45.0 tp . . . . . 0 C--N 1.324 -0.518 0 CA-C-N 115.599 -0.728 . . . . 74.1 110.661 -175.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 10.7 p90 . . . . . 0 CA--C 1.534 0.339 0 N-CA-C 111.93 0.345 . . . . 74.14 111.93 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 132' ' ' ASN . . . . . 0.458 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 64.4 t30 -57.97 -53.73 54.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.028 0.442 . . . . 71.33 110.617 -176.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 133' ' ' ILE . . . . . 0.523 HG22 ' HB3' ' A' ' 79' ' ' LEU . 49.1 mm -60.55 -43.71 95.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.787 -0.642 . . . . 73.04 111.549 -177.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.829 HD12 HD21 ' A' ' 49' ' ' LEU . 80.8 mt -67.46 -24.3 65.6 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.263 -0.426 . . . . 75.05 111.266 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -73.63 -46.05 49.19 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.122 0.486 . . . . 71.45 110.062 177.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 136' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 26.7 mm-40 -65.45 -33.24 75.49 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.472 -0.785 . . . . 75.34 110.97 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -99.04 5.56 47.02 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.546 -0.297 . . . . 72.31 111.432 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 52.37 70.59 0.55 Allowed 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.55 0.944 . . . . 64.34 113.55 175.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 139' ' ' PHE . . . . . 0.434 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 28.1 m-85 -99.77 0.99 42.78 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.832 -0.622 . . . . 74.43 109.645 169.133 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 61.75 89.94 0.1 OUTLIER Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 114.842 -1.072 . . . . 74.13 111.472 -173.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . 0.414 ' HA ' ' CD1' ' A' ' 49' ' ' LEU . 22.4 Cg_exo -65.94 143.54 73.2 Favored 'Trans proline' 0 N--CA 1.463 -0.318 0 C-N-CA 122.632 2.221 . . . . 74.02 110.695 172.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 142' ' ' LYS . . . . . 0.64 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 17.2 tptt . . . . . 0 C--N 1.327 -0.406 0 C-N-CA 119.658 -0.817 . . . . 73.31 111.652 -176.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . 0.583 ' HB3' ' HA ' ' B' ' 161' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.499 0 N-CA-C 109.553 -0.536 . . . . 74.24 109.553 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.783 HD23 HD13 ' A' ' 34' ' ' LEU . 39.1 tp -76.03 98.18 4.24 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.243 -0.89 . . . . 73.43 110.743 -173.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.886 ' HB3' HG21 ' B' ' 159' ' ' THR . . . -102.25 102.45 12.85 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.112 -0.949 . . . . 73.22 110.213 177.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 151' ' ' PHE . . . . . 0.569 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 37.6 p90 -125.89 166.65 16.5 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.84 -0.618 . . . . 74.42 110.13 -178.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -87.04 115.52 24.48 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.183 0.516 . . . . 74.55 110.802 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 153' ' ' CYS . . . . . 0.48 ' HB3' ' CG ' ' B' ' 158' ' ' LYS . 45.7 t -134.13 122.86 23.48 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.845 -0.616 . . . . 75.33 110.183 177.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.1 t70 70.23 8.63 6.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.233 -0.894 . . . . 72.3 111.956 174.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 111.53 -9.11 28.32 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.267 -0.968 . . . . 61.33 112.959 176.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -124.24 160.99 26.73 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.673 -0.491 . . . . 75.23 109.673 175.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 47.2 mm -80.12 119.53 29.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.737 -0.468 . . . . 73.3 109.737 175.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 158' ' ' LYS . . . . . 0.48 ' CG ' ' HB3' ' B' ' 153' ' ' CYS . 30.7 mmmt -98.39 98.32 9.56 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.876 -0.416 . . . . 63.41 109.876 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 159' ' ' THR . . . . . 0.886 HG21 ' HB3' ' B' ' 150' ' ' ALA . 0.2 OUTLIER -84.06 102.78 12.76 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.268 -0.424 . . . . 72.32 110.997 179.83 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -99.6 114.59 27.72 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.348 -0.387 . . . . 74.51 110.85 178.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 161' ' ' SER . . . . . 0.583 ' HA ' ' HB3' ' B' ' 148' ' ' LYS . 5.3 p -76.69 -33.46 58.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.976 -0.557 . . . . 72.02 110.167 176.098 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -116.37 149.5 39.25 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.604 -0.726 . . . . 72.41 109.684 176.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -90.19 -9.21 48.96 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.13 0.49 . . . . 74.54 110.327 -178.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -63.93 -49.6 71.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.629 -0.714 . . . . 75.31 110.183 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 10.7 m -66.43 -36.1 81.96 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.88 -0.6 . . . . 75.31 110.753 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 3.9 tt -60.29 -43.36 96.34 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.069 0.461 . . . . 75.51 110.131 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 15.9 ttp180 -60.83 -23.38 65.05 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.373 -0.83 . . . . 74.41 110.899 -175.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -88.32 -43.24 11.68 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.184 0.516 . . . . 75.04 110.207 176.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 169' ' ' PHE . . . . . 0.429 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 59.1 t80 -62.81 -39.3 93.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.39 -0.823 . . . . 75.42 111.051 -178.032 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -67.1 -29.09 68.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.059 -0.519 . . . . 74.2 111.532 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 22.9 t -75.6 -32.61 60.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.758 0.314 . . . . 73.3 111.112 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -82.79 -16.09 49.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.907 0.385 . . . . 73.53 110.651 179.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 173' ' ' LYS . . . . . 0.405 ' HA ' ' HD2' ' B' ' 173' ' ' LYS . 25.7 mmmt -81.31 117.92 22.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.225 -0.443 . . . . 74.44 110.281 174.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.1 p -54.16 -44.84 71.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.129 -0.487 . . . . 73.32 111.89 -178.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 4.5 p -71.45 -50.73 28.82 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.957 -0.565 . . . . 74.44 111.658 -178.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 82.3 mtp -73.61 -16.77 61.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.321 -0.4 . . . . 71.1 112.077 -172.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 177' ' ' LYS . . . . . 0.442 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 47.4 tttp -62.8 -26.11 68.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.307 -0.406 . . . . 73.44 110.91 -178.197 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . 0.406 ' HA ' ' HD3' ' B' ' 181' ' ' LYS . 5.1 mm-40 -94.33 -8.19 39.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.434 0.635 . . . . 72.24 109.917 -176.295 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 179' ' ' LEU . . . . . 0.481 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 11.2 mp -87.64 -54.88 4.04 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.029 -0.987 . . . . 74.33 109.844 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -81.03 -14.25 58.06 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.207 -0.906 . . . . 73.04 112.19 -173.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 181' ' ' LYS . . . . . 0.443 ' HA ' ' O ' ' B' ' 184' ' ' LEU . 64.9 pttt -57.46 -19.2 22.63 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.347 0.499 . . . . 72.41 112.347 -176.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -58.51 -36.39 73.73 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.061 0.458 . . . . 72.01 110.783 177.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 26.9 m -119.32 11.77 6.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.223 0.535 . . . . 74.31 110.367 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 184' ' ' LEU . . . . . 0.443 ' O ' ' HA ' ' B' ' 181' ' ' LYS . 55.6 tp . . . . . 0 C--N 1.323 -0.548 0 CA-C-N 115.736 -0.666 . . . . 73.1 110.534 -175.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.41 ' HB3' HD13 ' B' ' 149' ' ' LEU . 22.1 p90 . . . . . 0 CA--C 1.534 0.347 0 CA-C-O 120.991 0.424 . . . . 74.05 111.185 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.517 ' O ' ' HB3' ' A' ' 35' ' ' ARG . 48.6 t30 -60.17 -51.13 70.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.703 -0.68 . . . . 73.13 111.368 -174.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.49 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 48.5 mm -58.78 -47.54 88.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.167 -0.469 . . . . 74.13 111.469 -177.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.1 mt -60.3 -35.45 75.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.007 0.432 . . . . 74.11 110.746 177.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.517 ' HB3' ' O ' ' A' ' 32' ' ' ASN . 23.4 ttt-85 -62.38 -49.94 73.53 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.637 -0.711 . . . . 75.43 110.374 176.477 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 15.9 mm-40 -66.67 -31.95 72.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.672 -0.695 . . . . 74.35 111.898 -176.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -98.04 3.62 49.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.771 0.319 . . . . 73.22 111.159 -177.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 38.2 t70 57.73 62.06 2.22 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.592 0.711 . . . . 73.11 111.929 175.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -89.3 -3.33 58.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.816 -0.629 . . . . 75.51 110.534 170.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 61.06 67.28 1.47 Allowed Pre-proline 0 CA--C 1.534 0.333 0 CA-C-N 115.624 -0.716 . . . . 75.02 110.029 -173.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -80.65 168.88 17.4 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.535 2.157 . . . . 65.42 111.583 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.465 ' HE2' ' HB2' ' B' ' 150' ' ' ALA . 10.7 mptt . . . . . 0 C--N 1.321 -0.673 0 C-N-CA 120.431 -0.508 . . . . 75.32 110.866 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.575 0 CA-C-O 121.042 0.448 . . . . 73.13 110.073 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.66 ' HB3' ' HD1' ' A' ' 51' ' ' PHE . 10.6 mp -76.09 88.51 3.01 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.719 -0.673 . . . . 74.43 109.868 178.29 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.08 59.71 4.59 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.156 0.503 . . . . 65.35 109.683 175.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.66 ' HD1' ' HB3' ' A' ' 49' ' ' LEU . 52.5 p90 -90.5 166.96 12.94 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.993 -0.548 . . . . 71.34 110.203 -175.364 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -100.41 123.31 44.47 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 120.981 0.419 . . . . 73.44 110.697 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.632 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 52.9 t -125.77 112.32 15.92 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.726 -0.67 . . . . 71.14 109.577 176.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 68.04 21.27 8.84 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.862 -0.608 . . . . 72.22 111.39 177.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 107.8 -32.75 6.82 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.75 -0.738 . . . . 63.42 112.433 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -98.37 143.87 28.37 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.073 0.463 . . . . 71.14 110.8 -176.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.2 mm -74.5 118.32 20.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.027 -0.533 . . . . 74.31 110.289 178.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 29.9 mmmt -106.17 107.72 18.87 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.198 -0.667 . . . . 74.15 109.198 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.514 ' HA ' ' O ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -98.51 112.92 24.8 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.061 -0.518 . . . . 74.33 111.919 -171.178 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -128.56 139.18 52.43 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.246 -0.433 . . . . 75.3 110.2 177.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 65.4 p -104.21 -16.69 15.13 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.121 0.486 . . . . 62.21 110.1 176.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -127.16 150.14 49.64 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.813 -0.63 . . . . 71.22 111.237 -176.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.0 mt -67.92 -23.39 65.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.712 -0.677 . . . . 75.43 110.477 177.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -60.63 -48.8 80.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.093 0.473 . . . . 74.54 110.55 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 9.9 m -68.11 -41.92 81.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.892 -0.594 . . . . 72.14 110.705 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.4 tp -65.28 -36.11 83.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.941 -0.572 . . . . 74.15 110.648 -178.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.71 ' HG2' HD11 ' A' ' 84' ' ' LEU . 62.8 mtt180 -53.77 -49.51 68.08 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.222 -0.445 . . . . 73.15 111.806 178.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 40.7 mtmt -73.06 -28.9 62.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.994 -0.548 . . . . 74.31 111.353 -173.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.481 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 81.5 t80 -79.21 -43.48 23.77 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.869 0.366 . . . . 72.53 110.658 178.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.18 -32.28 73.89 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.416 -0.356 . . . . 72.34 111.61 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.0 p -75.88 -15.5 60.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.555 -0.293 . . . . 70.13 111.624 -178.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.481 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 19.4 pt20 -102.1 -2.12 30.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.183 0.516 . . . . 75.32 110.106 176.342 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.632 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 30.2 mmmt -98.49 120.01 38.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.842 -0.617 . . . . 74.45 110.36 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.2 p -58.85 -40.52 84.53 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.349 -0.387 . . . . 64.22 111.299 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.0 m -77.43 -31.89 54.23 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.033 -0.53 . . . . 65.23 111.74 -177.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.421 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 80.0 mtp -94.42 -10.93 30.92 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.862 0.319 . . . . 72.45 111.862 -174.344 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -59.28 -37.31 77.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.048 0.451 . . . . 73.25 111.421 -176.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.449 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 61.9 mm-40 -96.69 5.07 51.4 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.3 0.571 . . . . 74.2 110.548 -175.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.575 ' HB3' HG22 ' B' ' 133' ' ' ILE . 53.6 mt -95.63 -52.29 4.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.172 -0.922 . . . . 74.43 109.687 177.133 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -85.7 -4.81 59.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.529 -0.76 . . . . 74.22 111.808 -176.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.449 ' HD2' ' HA ' ' A' ' 78' ' ' GLU . 18.4 ptmt -54.68 -18.09 4.17 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.854 0.359 . . . . 74.42 111.63 177.491 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -69.12 -44.28 72.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.393 -0.367 . . . . 64.45 111.386 179.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . 0.573 HG22 HD13 ' A' ' 84' ' ' LEU . 16.1 m -100.46 5.28 10.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-O 120.878 0.37 . . . . 72.22 111.865 -176.02 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.71 HD11 ' HG2' ' A' ' 67' ' ' ARG . 8.2 mp . . . . . 0 C--N 1.321 -0.669 0 N-CA-C 108.895 -0.78 . . . . 73.24 108.895 172.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 20.0 p90 . . . . . 0 N--CA 1.478 0.957 0 N-CA-C 113.881 1.067 . . . . 72.14 113.881 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 132' ' ' ASN . . . . . 0.491 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 52.0 t30 -55.12 -58.04 9.3 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.746 0.308 . . . . 65.3 111.632 -173.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 133' ' ' ILE . . . . . 0.575 HG22 ' HB3' ' A' ' 79' ' ' LEU . 49.5 mm -57.36 -42.54 80.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.183 0.516 . . . . 74.52 111.108 -178.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.536 HD13 HD23 ' A' ' 49' ' ' LEU . 86.2 mt -67.63 -26.52 66.28 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.052 -0.522 . . . . 71.15 111.35 -177.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 46.1 ttt180 -71.73 -46.44 58.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.998 0.428 . . . . 75.43 109.942 175.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 136' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 16.8 mm-40 -63.05 -27.08 69.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.51 -0.768 . . . . 75.45 111.358 -177.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -106.17 3.36 27.84 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.411 -0.359 . . . . 70.0 111.305 -177.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 32.9 t70 55.37 65.61 1.44 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.562 0.696 . . . . 73.12 111.887 177.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -94.03 6.3 48.97 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.827 -0.624 . . . . 71.32 111.025 172.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 58.44 66.26 2.67 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 116.004 -0.544 . . . . 71.12 110.485 -175.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -86.76 156.82 8.89 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.772 2.314 . . . . 74.21 112.691 -176.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 12.7 mptt . . . . . 0 C--N 1.328 -0.347 0 CA-C-O 120.942 0.401 . . . . 70.23 110.95 -179.084 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . 0.51 ' HD3' HG22 ' B' ' 159' ' ' THR . 0.1 OUTLIER . . . . . 0 CA--C 1.51 -0.573 0 N-CA-C 107.304 -1.369 . . . . 71.42 107.304 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.569 ' O ' ' HA ' ' B' ' 159' ' ' THR . 2.6 mm? -65.23 93.95 0.14 Allowed 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.49 -0.484 . . . . 75.12 110.719 -175.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.542 ' HA ' ' O ' ' B' ' 158' ' ' LYS . . . -103.27 75.92 1.39 Allowed 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.014 -0.994 . . . . 73.34 108.75 176.112 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 151' ' ' PHE . . . . . 0.545 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 46.2 p90 -110.64 164.5 12.67 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.274 -0.876 . . . . 74.44 110.575 -173.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -101.73 116.26 32.34 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.049 0.452 . . . . 75.1 111.011 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 153' ' ' CYS . . . . . 0.655 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 49.2 t -112.32 107.7 16.63 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.84 -0.618 . . . . 70.21 109.66 178.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 66.92 6.72 4.83 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 116.093 -0.503 . . . . 73.33 111.883 176.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 126.56 -29.98 4.35 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.724 -0.75 . . . . 70.03 112.442 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 156' ' ' GLU . . . . . 0.577 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 14.1 pt-20 -91.89 140.37 29.74 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 122.682 -0.304 . . . . 75.01 110.262 -178.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 44.9 mm -83.38 123.83 39.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.879 0.371 . . . . 73.31 110.103 177.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 158' ' ' LYS . . . . . 0.577 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 27.0 mmmt -106.35 148.06 28.5 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.149 -0.686 . . . . 61.31 109.149 179.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 159' ' ' THR . . . . . 0.569 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.0 OUTLIER -130.46 124.87 33.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.049 0.452 . . . . 73.44 111.584 178.449 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 160' ' ' PHE . . . . . 0.406 ' CD2' HD12 ' B' ' 166' ' ' LEU . 90.1 m-85 -132.68 126.84 33.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.587 -0.733 . . . . 74.34 110.405 176.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.7 -23.1 62.41 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.976 -0.557 . . . . 71.41 111.495 -179.09 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -150.97 177.25 10.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.851 0.358 . . . . 61.52 110.471 175.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 76.3 mt -86.65 -7.56 58.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.881 -0.6 . . . . 74.54 111.736 -175.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 164' ' ' GLN . . . . . 0.495 ' OE1' ' HD3' ' B' ' 167' ' ' ARG . 5.7 tp-100 -78.59 -40.11 35.53 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.991 -0.744 . . . . 75.32 108.991 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 22.5 t -67.79 -39.24 84.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.435 -0.802 . . . . 73.12 110.014 175.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . 0.406 HD12 ' CD2' ' B' ' 160' ' ' PHE . 53.0 tp -68.06 -29.87 68.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.875 -0.602 . . . . 75.14 110.476 177.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . 0.495 ' HD3' ' OE1' ' B' ' 164' ' ' GLN . 58.5 ttt180 -60.46 -28.05 68.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.992 -0.549 . . . . 75.15 110.908 178.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -79.89 -26.37 40.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.142 -0.481 . . . . 75.22 111.175 177.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -88.3 -42.37 12.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.159 -0.473 . . . . 71.2 110.834 -176.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.64 -23.06 67.14 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.092 -0.504 . . . . 74.21 111.535 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 3.1 p -81.14 -26.28 36.24 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.409 -0.36 . . . . 74.33 111.826 -178.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -92.73 -14.63 27.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.041 0.448 . . . . 74.43 110.526 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 173' ' ' LYS . . . . . 0.655 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 29.4 mmmt -85.56 117.34 24.4 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.01 -0.541 . . . . 75.34 109.822 175.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 11.2 m -59.67 -35.97 75.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.883 0.373 . . . . 71.42 111.449 -175.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 7.0 p -76.51 -47.83 21.48 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.269 -0.423 . . . . 73.34 111.102 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 176' ' ' MET . . . . . 0.46 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 82.3 mtp -72.31 -18.79 61.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.828 0.347 . . . . 65.44 111.293 -176.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 177' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' B' ' 173' ' ' LYS . 84.0 tttt -58.75 -41.59 86.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.904 -0.589 . . . . 72.21 111.28 -177.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . 0.586 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 9.2 mm-40 -89.23 -6.76 56.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.601 0.715 . . . . 70.12 109.647 -174.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 179' ' ' LEU . . . . . 0.49 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 64.3 mt -82.77 -43.1 17.15 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.051 -0.977 . . . . 74.4 109.971 177.129 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 180' ' ' LEU . . . . . 0.642 ' HB3' HD12 ' B' ' 184' ' ' LEU . 4.3 mm? -95.89 -9.78 30.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.872 -0.604 . . . . 74.22 112.102 -174.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 181' ' ' LYS . . . . . 0.586 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 17.5 ptmt -56.5 -20.93 22.61 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.841 0.682 . . . . 72.34 112.841 -175.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -68.66 -40.16 80.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.989 0.423 . . . . 75.53 111.252 179.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 26.3 m -103.07 -15.58 7.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.081 -0.508 . . . . 75.02 111.537 -176.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 184' ' ' LEU . . . . . 0.642 HD12 ' HB3' ' B' ' 180' ' ' LEU . 9.9 mp . . . . . 0 C--N 1.325 -0.457 0 N-CA-C 109.654 -0.498 . . . . 74.54 109.654 175.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.573 ' HB3' HD12 ' B' ' 149' ' ' LEU . 26.1 p90 . . . . . 0 C--O 1.233 0.188 0 CA-C-O 120.76 0.314 . . . . 74.44 110.806 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.543 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 8.8 t30 -60.54 -46.1 91.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.063 -0.517 . . . . 71.42 110.156 178.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.495 HG22 ' HB3' ' B' ' 179' ' ' LEU . 45.2 mm -62.66 -35.98 73.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-O 121.22 0.534 . . . . 74.4 110.439 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 72.0 mt -64.36 -39.18 93.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.758 -0.655 . . . . 71.41 110.225 178.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 57.3 ttt85 -69.51 -40.95 76.66 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.099 -0.501 . . . . 75.45 110.858 178.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.543 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 5.5 mm-40 -64.48 -31.08 72.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.831 0.348 . . . . 72.11 111.406 -178.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -100.52 1.35 40.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.02 0.438 . . . . 53.35 110.824 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 58.79 58.15 3.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.128 -0.942 . . . . 63.13 112.259 177.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -84.18 -2.86 57.62 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.478 -0.783 . . . . 73.45 109.388 169.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 60.68 75.09 0.48 Allowed Pre-proline 0 C--O 1.234 0.252 0 CA-C-N 114.912 -1.04 . . . . 74.23 111.114 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -82.54 159.21 16.86 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.632 2.222 . . . . 74.44 111.214 176.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.768 ' HD3' ' HB1' ' B' ' 150' ' ' ALA . 3.6 mptp? . . . . . 0 C--N 1.325 -0.477 0 N-CA-C 112.418 0.525 . . . . 74.24 112.418 -177.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.525 ' H ' ' HD2' ' A' ' 48' ' ' LYS . 1.7 mptp? . . . . . 0 N--CA 1.446 -0.659 0 N-CA-C 108.471 -0.937 . . . . 75.43 108.471 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.562 HD21 ' HB3' ' B' ' 131' ' ' PHE . 21.0 tp -92.92 23.27 4.3 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 109.52 -0.548 . . . . 73.12 109.52 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.69 ' HB3' ' HD3' ' B' ' 142' ' ' LYS . . . -34.3 103.7 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 O-C-N 124.553 1.158 . . . . 64.15 112.895 -173.035 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.758 ' HB3' ' HA ' ' B' ' 141' ' ' PRO . 46.8 p90 -132.09 172.04 12.87 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.086 -0.961 . . . . 74.43 109.969 -178.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -101.46 115.11 29.77 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.277 0.56 . . . . 72.51 110.871 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.498 ' O ' ' HG2' ' A' ' 56' ' ' GLU . 41.9 t -112.31 99.84 8.33 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.432 -0.804 . . . . 61.05 110.454 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.6 t70 64.61 15.34 9.63 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.449 0.642 . . . . 73.42 110.817 176.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.17 -35.41 3.11 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.788 -0.72 . . . . 65.32 112.801 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.767 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 13.4 pt-20 -88.72 133.31 34.26 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.712 0.292 . . . . 75.12 110.902 -176.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.404 ' HA ' ' O ' ' A' ' 51' ' ' PHE . 47.9 mm -80.91 120.37 32.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 109.24 -0.652 . . . . 74.53 109.24 176.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.767 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 28.9 mmmt -111.2 112.27 23.93 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.932 0.396 . . . . 75.2 111.509 -173.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.498 HG21 ' HB1' ' A' ' 50' ' ' ALA . 1.0 OUTLIER -88.88 104.09 16.61 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.964 -0.562 . . . . 64.14 110.488 172.818 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.515 ' CD2' HD11 ' A' ' 66' ' ' LEU . 21.4 m-85 -120.32 142.74 48.84 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.054 -0.521 . . . . 75.23 110.953 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 32.9 p -137.05 -14.26 1.57 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.149 -0.932 . . . . 73.24 109.667 173.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.446 ' HB2' ' OG ' ' A' ' 65' ' ' SER . 9.3 m-20 -98.97 157.71 16.14 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.651 -0.704 . . . . 71.42 109.265 177.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.5 mp -92.72 -39.5 11.22 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.919 -0.4 . . . . 73.03 109.919 177.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -55.03 -43.83 74.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.895 -0.593 . . . . 74.3 111.408 178.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.446 ' OG ' ' HB2' ' A' ' 62' ' ' ASP . 16.9 p -65.42 -52.01 56.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.849 0.357 . . . . 74.14 110.891 -179.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.515 HD11 ' CD2' ' A' ' 60' ' ' PHE . 63.1 tp -63.47 -34.14 77.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.04 -0.527 . . . . 75.42 110.705 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.484 ' HG3' HD22 ' A' ' 84' ' ' LEU . 20.3 ttt180 -60.81 -40.16 91.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.786 -0.643 . . . . 74.44 110.297 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.407 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 46.1 mtmt -71.97 -45.11 62.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.99 -0.55 . . . . 74.22 110.737 174.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -58.89 -49.76 76.57 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.795 -0.639 . . . . 75.45 110.949 -175.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.57 -38.18 74.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.876 0.37 . . . . 74.03 111.501 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 42.9 m -70.77 -30.52 67.03 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.27 -0.423 . . . . 72.45 111.462 -177.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 13.1 pt20 -97.12 12.14 33.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.209 0.528 . . . . 74.22 110.662 178.214 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.421 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 26.2 mmmt -119.07 114.84 23.12 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.83 -0.623 . . . . 74.21 110.086 175.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.5 m -58.59 -33.42 69.96 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.247 0.546 . . . . 73.43 110.545 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 12.1 m -78.54 -23.64 46.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.884 -0.598 . . . . 73.33 111.974 -176.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.456 ' HE2' HD13 ' A' ' 66' ' ' LEU . 46.6 mtp -104.94 -18.28 14.24 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.792 0.664 . . . . 63.34 112.792 -176.249 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.555 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 81.8 tttt -72.92 -17.37 61.5 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.264 0.554 . . . . 73.33 110.208 -176.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.558 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 56.5 mm-40 -102.66 4.11 37.86 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.512 -0.767 . . . . 65.33 109.665 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.584 ' HB3' HG21 ' B' ' 133' ' ' ILE . 71.8 mt -100.61 -44.48 5.83 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.15 -0.932 . . . . 72.41 109.657 175.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.9 mt -97.09 0.02 47.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.862 -0.608 . . . . 74.01 110.691 -175.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.558 ' HD3' ' HA ' ' A' ' 78' ' ' GLU . 64.4 pttt -56.61 -22.69 35.69 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.195 -0.457 . . . . 74.12 111.781 178.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -75.73 -56.58 4.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.914 0.387 . . . . 73.45 110.879 178.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 29.8 m -80.64 -20.47 11.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.076 -0.511 . . . . 73.03 112.184 -172.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.484 HD22 ' HG3' ' A' ' 67' ' ' ARG . 10.7 mp . . . . . 0 C--N 1.326 -0.449 0 N-CA-C 109.222 -0.658 . . . . 75.51 109.222 172.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 131' ' ' PHE . . . . . 0.562 ' HB3' HD21 ' A' ' 49' ' ' LEU . 33.5 p90 . . . . . 0 C--O 1.23 0.076 0 N-CA-C 111.841 0.311 . . . . 74.14 111.841 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -63.77 -37.42 87.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.277 0.56 . . . . 71.21 109.979 175.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 133' ' ' ILE . . . . . 0.584 HG21 ' HB3' ' A' ' 79' ' ' LEU . 22.7 mm -64.33 -34.06 66.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.266 -0.879 . . . . 75.42 110.751 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 77.1 mt -66.92 -34.9 78.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.789 -0.641 . . . . 73.42 111.228 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -71.85 -41.27 68.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.909 0.385 . . . . 75.14 110.343 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -59.92 -46.77 88.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.954 -0.566 . . . . 73.32 111.172 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -92.53 3.18 56.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.139 -0.482 . . . . 75.4 111.349 -176.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 53.42 71.14 0.52 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.906 0.706 . . . . 63.13 112.906 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -89.65 -6.21 56.38 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.798 -0.637 . . . . 74.42 110.331 171.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 58.68 74.96 0.56 Allowed Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 115.486 -0.779 . . . . 74.04 110.81 178.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . 0.758 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 5.0 Cg_exo -74.77 -179.57 5.04 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.36 2.707 . . . . 75.03 111.801 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 142' ' ' LYS . . . . . 0.69 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 11.5 tptp . . . . . 0 C--N 1.33 -0.282 0 C-N-CA 119.899 -0.72 . . . . 71.2 110.812 -178.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.5 0 N-CA-C 107.921 -1.14 . . . . 72.32 107.921 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.719 ' HB3' ' HD1' ' B' ' 151' ' ' PHE . 3.7 mm? -51.32 -51.45 54.29 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.212 0.32 . . . . 74.14 111.742 -175.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.768 ' HB1' ' HD3' ' A' ' 42' ' ' LYS . . . 47.32 36.67 4.99 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 123.976 0.797 . . . . 74.43 111.673 176.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 151' ' ' PHE . . . . . 0.719 ' HD1' ' HB3' ' B' ' 149' ' ' LEU . 28.5 p90 -87.66 167.68 13.67 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.867 -0.606 . . . . 73.1 109.992 -177.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -96.87 121.34 38.63 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.174 -0.466 . . . . 75.55 110.294 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 153' ' ' CYS . . . . . 0.438 ' HB2' ' CE2' ' B' ' 151' ' ' PHE . 48.7 t -122.06 113.2 19.2 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.795 -0.639 . . . . 74.52 109.635 176.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.1 t70 68.63 16.46 9.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.613 -0.721 . . . . 72.21 111.127 174.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 116.71 -32.25 5.59 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.568 -0.825 . . . . 62.52 112.827 178.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 156' ' ' GLU . . . . . 0.464 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 13.4 pt-20 -97.87 157.68 15.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.831 0.348 . . . . 75.35 110.67 -177.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.9 mm -92.23 123.55 44.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.388 -0.369 . . . . 73.13 110.389 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 158' ' ' LYS . . . . . 0.464 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 26.5 mmmt -106.59 103.82 13.36 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.987 0.422 . . . . 74.13 110.89 -177.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.17 96.25 10.48 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.084 0.468 . . . . 75.24 111.687 -179.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -110.34 123.82 50.54 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.962 -0.563 . . . . 74.21 110.046 174.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 16.2 m -93.8 -26.4 16.97 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.216 -0.661 . . . . 72.04 109.216 174.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -102.77 153.64 19.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.282 -0.872 . . . . 74.31 109.48 177.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -87.73 -20.09 26.7 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.744 0.307 . . . . 73.45 110.809 -176.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -64.11 -47.6 79.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.322 -0.399 . . . . 74.44 110.805 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 15.7 m -65.9 -35.46 80.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.549 -0.296 . . . . 62.33 110.97 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 65.3 tp -66.44 -43.4 85.72 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.02 0.438 . . . . 74.31 110.136 177.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . 0.48 ' HG3' ' CD2' ' B' ' 184' ' ' LEU . 68.4 ttt180 -62.12 -41.5 98.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.868 -0.606 . . . . 74.04 110.471 178.38 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -66.48 -41.65 88.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.996 -0.547 . . . . 64.04 110.887 177.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -62.69 -46.3 88.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 74.33 110.666 -179.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 170' ' ' ALA . . . . . 0.401 ' CB ' HD12 ' B' ' 180' ' ' LEU . . . -61.48 -30.42 70.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.29 -0.413 . . . . 75.03 111.518 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 20.4 m -82.75 -12.3 57.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.775 0.322 . . . . 72.01 111.652 -175.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -106.77 -1.99 22.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.436 0.636 . . . . 75.44 109.454 175.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -110.25 103.4 12.07 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.073 -0.967 . . . . 72.42 109.525 177.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 19.9 m -56.87 -32.11 65.5 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.9 0.381 . . . . 72.34 110.984 -177.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 6.2 m -66.11 -40.98 91.13 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.047 -0.524 . . . . 71.3 111.045 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 76.5 mtp -88.28 -21.15 24.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.392 -0.367 . . . . 64.42 111.077 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 177' ' ' LYS . . . . . 0.506 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 85.6 tttt -65.68 -23.09 66.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.308 0.575 . . . . 72.51 110.269 -179.261 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -95.59 -8.62 34.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.509 -0.769 . . . . 74.44 109.881 -178.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 179' ' ' LEU . . . . . 0.495 ' HB3' HG22 ' A' ' 33' ' ' ILE . 89.8 mt -94.04 -52.0 4.6 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 114.853 -1.067 . . . . 73.23 109.482 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 180' ' ' LEU . . . . . 0.401 HD12 ' CB ' ' B' ' 170' ' ' ALA . 6.0 mt -87.75 -12.45 45.16 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.791 -0.641 . . . . 71.45 112.368 -171.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 181' ' ' LYS . . . . . 0.506 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 64.2 pttt -62.15 -12.01 17.48 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.44 -0.504 . . . . 72.22 111.786 -178.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -70.03 -40.44 75.17 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.101 0.477 . . . . 74.01 110.445 175.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 25.9 m -104.65 -13.23 9.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.939 -0.573 . . . . 64.32 111.094 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 184' ' ' LEU . . . . . 0.48 ' CD2' ' HG3' ' B' ' 167' ' ' ARG . 9.1 mp . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 115.92 -0.582 . . . . 74.23 109.774 175.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.429 ' HB3' HD23 ' B' ' 149' ' ' LEU . 18.4 p90 . . . . . 0 N--CA 1.484 1.24 0 N-CA-C 114.653 1.353 . . . . 74.23 114.653 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -57.33 -46.42 83.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.035 0.445 . . . . 54.04 111.023 -178.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.441 HG21 HD22 ' A' ' 37' ' ' ASN . 48.8 mm -64.56 -43.53 96.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.937 -0.574 . . . . 75.44 110.887 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.767 HD11 HD21 ' B' ' 149' ' ' LEU . 85.5 mt -65.25 -17.94 64.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 74.43 111.617 -178.078 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -79.93 -34.38 38.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.113 0.482 . . . . 75.14 110.115 175.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -71.88 -46.17 58.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.753 -0.658 . . . . 64.14 111.293 -176.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.453 ' OD1' ' HA ' ' A' ' 34' ' ' LEU . 11.9 p30 -91.15 -8.0 49.93 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.866 -0.606 . . . . 74.05 110.753 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.1 t0 55.39 73.33 0.43 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.174 -0.921 . . . . 70.45 112.077 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -86.02 12.91 8.46 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.129 -0.942 . . . . 75.41 110.241 170.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.554 ' O ' ' HA ' ' B' ' 151' ' ' PHE . 1.1 tm-20 66.54 73.28 0.39 Allowed Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 115.62 -0.718 . . . . 72.42 110.215 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -76.88 161.31 33.34 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 123.352 2.702 . . . . 72.45 111.959 -178.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.47 ' HD2' ' HA ' ' A' ' 42' ' ' LYS . 10.8 tptt . . . . . 0 N--CA 1.463 0.194 0 C-N-CA 120.195 -0.602 . . . . 72.31 112.438 -176.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.506 -0.738 0 N-CA-C 109.505 -0.554 . . . . 74.44 109.505 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.981 HD22 HD11 ' B' ' 134' ' ' LEU . 47.2 tp -79.54 80.4 5.92 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 109.383 -0.599 . . . . 74.44 109.383 175.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.691 ' H ' ' HB2' ' B' ' 142' ' ' LYS . . . -88.4 77.06 8.2 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.514 -0.766 . . . . 63.14 110.146 178.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.573 ' HD1' ' HG ' ' A' ' 49' ' ' LEU . 43.7 p90 -93.77 168.76 10.79 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.638 -0.71 . . . . 73.34 110.919 -174.23 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.457 ' HE3' ' CD1' ' A' ' 57' ' ' ILE . 4.5 tppp? -96.78 114.08 25.68 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.999 -0.546 . . . . 63.42 110.368 -178.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.484 ' SG ' ' HE1' ' A' ' 69' ' ' PHE . 48.7 t -121.57 112.57 18.64 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.141 -0.481 . . . . 52.13 110.66 179.375 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.5 t70 68.88 0.98 2.94 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.298 -0.865 . . . . 74.54 112.456 171.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 127.98 -13.62 6.37 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.182 -1.009 . . . . 43.31 112.91 178.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.591 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 11.9 pt-20 -118.09 144.78 45.35 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.072 0.463 . . . . 75.22 110.272 177.417 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.457 ' CD1' ' HE3' ' A' ' 52' ' ' LYS . 41.0 mm -75.16 126.07 35.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.866 -0.607 . . . . 73.24 109.767 177.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.591 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 30.9 mmmt -114.17 117.51 31.4 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.187 -0.301 . . . . 75.24 110.187 -178.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.56 105.54 16.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.111 0.481 . . . . 70.14 111.458 178.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.436 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 25.5 m-85 -123.29 151.42 42.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.034 -0.53 . . . . 74.3 111.424 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.4 t -158.89 19.06 0.2 Allowed 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.075 -1.083 . . . . 74.11 108.075 173.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -129.88 117.05 19.55 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 114.809 -1.087 . . . . 75.31 109.373 -173.162 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.457 HD11 HD12 ' A' ' 84' ' ' LEU . 51.6 tp -65.38 -37.57 87.39 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.633 0.254 . . . . 74.23 110.535 179.192 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 44.5 tt0 -59.47 -50.39 74.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.09 0.471 . . . . 72.42 111.019 177.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.4 m -66.51 -42.09 87.85 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.101 -0.5 . . . . 71.13 110.881 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 36.4 tp -65.48 -33.17 75.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.271 -0.422 . . . . 63.01 110.714 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.549 ' HA ' HD22 ' A' ' 84' ' ' LEU . 54.3 ttp180 -57.95 -40.38 80.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.328 -0.396 . . . . 75.24 110.659 177.023 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -69.88 -40.61 75.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.081 -0.509 . . . . 74.3 111.228 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.553 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 33.9 t80 -74.66 -45.19 46.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 73.34 111.068 -176.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.48 -28.36 67.79 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.753 0.311 . . . . 74.34 111.028 -177.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 31.6 t -63.92 -29.32 70.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.137 -0.483 . . . . 73.31 111.18 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.553 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 13.5 pt20 -95.9 0.95 52.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.167 0.508 . . . . 73.15 110.199 -179.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.472 ' HD3' ' HA ' ' A' ' 73' ' ' LYS . 43.3 mmtt -102.74 111.38 23.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.944 -0.571 . . . . 71.44 111.067 -178.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.8 m -53.99 -35.53 61.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.019 -0.537 . . . . 64.52 111.228 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.2 p -81.8 -56.88 3.7 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.236 0.541 . . . . 74.1 111.28 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.495 ' HA ' HD11 ' A' ' 79' ' ' LEU . 74.9 mtp -66.23 -24.0 66.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.674 -0.694 . . . . 73.12 112.312 -173.238 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.418 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 45.4 tttm -61.9 -33.99 75.22 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.858 0.361 . . . . 74.15 110.989 179.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -87.76 -14.06 40.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.572 0.701 . . . . 73.04 109.517 -174.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.495 HD11 ' HA ' ' A' ' 76' ' ' MET . 84.8 mt -82.26 -48.19 11.52 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.746 -1.116 . . . . 71.44 109.302 175.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.436 ' O ' ' HB3' ' A' ' 84' ' ' LEU . 4.3 mm? -79.31 -24.3 42.92 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.145 -0.934 . . . . 73.14 112.077 -177.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.418 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 64.2 pttt -57.85 -16.84 13.06 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.486 0.55 . . . . 72.52 112.486 -174.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -81.1 -45.43 16.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.856 0.36 . . . . 74.03 111.178 -177.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 11.5 m -106.99 -2.19 9.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.225 0.536 . . . . 71.31 111.169 -174.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.549 HD22 ' HA ' ' A' ' 67' ' ' ARG . 40.6 tp . . . . . 0 C--N 1.32 -0.71 0 CA-C-N 115.716 -0.675 . . . . 75.12 109.82 -176.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 131' ' ' PHE . . . . . 0.647 ' HD1' HD21 ' A' ' 49' ' ' LEU . 57.2 m-85 . . . . . 0 N--CA 1.471 0.609 0 N-CA-C 112.13 0.419 . . . . 75.44 112.13 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -55.11 -36.75 66.03 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.352 0.501 . . . . 74.44 112.352 -176.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 133' ' ' ILE . . . . . 0.45 ' CG2' ' HB3' ' A' ' 79' ' ' LEU . 40.6 mm -58.0 -50.7 77.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.922 0.391 . . . . 60.14 110.797 177.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.981 HD11 HD22 ' A' ' 49' ' ' LEU . 40.3 mt -69.35 -9.07 51.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.037 -0.528 . . . . 72.52 111.558 -178.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -82.34 -30.1 30.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.848 0.356 . . . . 71.12 110.109 176.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -73.62 -53.87 9.47 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.269 0.556 . . . . 73.1 110.324 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 137' ' ' ASN . . . . . 0.537 ' OD1' ' HA ' ' B' ' 134' ' ' LEU . 16.1 p30 -80.48 -14.04 58.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.233 -0.894 . . . . 74.33 111.606 -177.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 11.5 t70 55.85 70.91 0.59 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.754 0.787 . . . . 73.4 110.403 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 139' ' ' PHE . . . . . 0.51 ' O ' ' HB2' ' B' ' 140' ' ' GLU . 1.8 m-85 -86.15 26.63 1.0 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.181 -0.918 . . . . 73.32 110.462 178.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 140' ' ' GLU . . . . . 0.516 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 12.4 mm-40 70.36 61.34 0.5 Allowed Pre-proline 0 N--CA 1.464 0.258 0 O-C-N 123.951 0.782 . . . . 72.04 110.529 -177.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . 0.439 ' HD3' ' N ' ' B' ' 140' ' ' GLU . 6.5 Cg_exo -72.8 139.77 31.07 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.722 2.281 . . . . 54.53 112.073 -175.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 142' ' ' LYS . . . . . 0.691 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 13.6 mptt . . . . . 0 C--N 1.327 -0.409 0 CA-C-O 120.952 0.406 . . . . 75.21 111.328 -178.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . 0.42 ' O ' ' HB3' ' A' ' 42' ' ' LYS . 1.3 mptt . . . . . 0 CA--C 1.508 -0.67 0 N-CA-C 108.662 -0.866 . . . . 73.42 108.662 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.767 HD21 HD11 ' A' ' 34' ' ' LEU . 65.9 tp -80.26 84.86 5.85 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.636 0.731 . . . . 72.52 109.147 174.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.565 ' HB1' HG23 ' B' ' 159' ' ' THR . . . -94.76 115.72 27.86 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 114.811 -1.086 . . . . 65.53 109.082 176.666 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 151' ' ' PHE . . . . . 0.554 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 44.8 p90 -130.78 164.78 24.39 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.084 -0.507 . . . . 73.42 110.716 -179.087 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -87.52 123.2 32.17 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.131 -0.486 . . . . 73.42 110.012 179.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 153' ' ' CYS . . . . . 0.576 ' SG ' ' HE3' ' B' ' 173' ' ' LYS . 38.1 t -133.69 104.58 6.4 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.342 -0.39 . . . . 73.41 110.546 178.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 15.0 t70 70.21 14.02 7.65 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.259 -0.882 . . . . 74.51 111.948 172.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 124.54 -29.72 4.9 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.424 -0.893 . . . . 71.54 112.953 176.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 156' ' ' GLU . . . . . 0.428 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 15.4 pt-20 -106.68 150.85 25.83 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 122.553 -0.38 . . . . 74.53 110.644 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 44.6 mm -84.77 127.34 39.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.555 -0.535 . . . . 74.12 109.555 177.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 158' ' ' LYS . . . . . 0.525 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 29.2 mmmt -107.52 112.05 24.63 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.498 -0.319 . . . . 75.02 110.557 -177.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 159' ' ' THR . . . . . 0.565 HG23 ' HB1' ' B' ' 150' ' ' ALA . 0.8 OUTLIER -86.35 103.54 15.02 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.921 0.391 . . . . 74.32 110.988 176.777 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 160' ' ' PHE . . . . . 0.441 ' HD2' HD11 ' B' ' 166' ' ' LEU . 20.4 m-30 -120.66 116.56 25.54 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.173 -0.467 . . . . 74.41 111.197 178.254 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 8.0 t -109.64 10.53 24.91 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.354 -0.98 . . . . 75.45 108.354 171.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -122.09 121.62 37.35 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 114.863 -1.062 . . . . 74.42 110.104 -177.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 63.0 tp -65.96 -35.48 80.71 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.925 -0.398 . . . . 75.54 109.925 177.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -62.29 -42.29 99.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.941 -0.572 . . . . 75.22 110.813 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 43.6 m -67.15 -43.5 82.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.215 -0.448 . . . . 75.11 110.645 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . 0.441 HD11 ' HD2' ' B' ' 160' ' ' PHE . 64.5 tp -65.35 -38.0 88.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.253 -0.431 . . . . 73.33 110.532 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 36.6 ttp180 -58.37 -41.08 83.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.341 -0.391 . . . . 60.12 110.55 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 40.0 mtmt -65.19 -51.97 57.76 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.01 -0.541 . . . . 74.13 110.886 177.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -65.97 -44.8 83.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.296 -0.865 . . . . 72.1 111.266 -171.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.57 -30.52 71.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.374 -0.375 . . . . 62.33 111.511 -179.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 25.6 t -77.67 -20.47 53.67 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.495 -0.321 . . . . 71.14 111.111 -177.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -100.07 1.68 42.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.247 0.546 . . . . 75.02 110.618 178.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 173' ' ' LYS . . . . . 0.576 ' HE3' ' SG ' ' B' ' 153' ' ' CYS . 60.8 mmtt -102.18 118.11 36.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.57 -0.741 . . . . 73.15 109.58 173.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 4.2 p -59.01 -43.12 91.5 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.14 0.495 . . . . 40.22 111.007 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 4.5 m -69.6 -32.87 71.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.815 -0.63 . . . . 60.44 111.687 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 176' ' ' MET . . . . . 0.488 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 77.1 mtp -96.82 -10.85 25.76 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.698 0.258 . . . . 63.42 111.698 -172.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -56.58 -40.85 75.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.25 -0.432 . . . . 74.33 111.723 -177.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . 0.595 ' HA ' ' HD3' ' B' ' 181' ' ' LYS . 31.9 mt-10 -94.51 -0.31 54.74 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.262 0.553 . . . . 71.52 110.622 -173.456 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 179' ' ' LEU . . . . . 0.44 ' HB3' HG22 ' A' ' 33' ' ' ILE . 83.8 mt -83.21 -51.01 7.85 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.465 -0.789 . . . . 74.31 109.496 176.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 180' ' ' LEU . . . . . 0.625 ' HB3' HD12 ' B' ' 184' ' ' LEU . 3.7 mm? -92.01 1.54 57.13 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.775 -0.648 . . . . 73.31 111.481 -175.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 181' ' ' LYS . . . . . 0.595 ' HD3' ' HA ' ' B' ' 178' ' ' GLU . 63.8 pttt -65.19 -2.35 2.88 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.714 0.635 . . . . 73.34 112.714 -176.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -79.48 -31.0 42.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.357 0.599 . . . . 74.55 109.939 174.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 5.3 p -107.23 -21.25 5.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.46 -0.791 . . . . 73.21 110.006 177.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 184' ' ' LEU . . . . . 0.625 HD12 ' HB3' ' B' ' 180' ' ' LEU . 10.1 mp . . . . . 0 C--N 1.327 -0.41 0 CA-C-N 115.998 -0.547 . . . . 74.14 109.927 174.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.542 ' HB3' HD13 ' B' ' 149' ' ' LEU . 13.0 p90 . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.543 0.211 . . . . 75.12 111.475 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.614 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 9.2 t30 -59.3 -61.13 2.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.323 -0.399 . . . . 70.25 111.217 -174.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.535 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 1.7 mp -53.45 -41.59 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.44 -0.345 . . . . 65.11 111.508 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.1 mt -60.06 -40.49 89.66 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.13 -0.487 . . . . 73.32 111.27 178.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -67.83 -43.39 79.68 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 116.605 -0.27 . . . . 74.21 110.799 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.614 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 4.8 mm-40 -63.5 -38.93 93.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 70.3 111.005 -177.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -92.23 1.17 57.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 72.22 111.032 -178.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 56.77 53.45 8.28 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.608 -0.724 . . . . 72.1 112.371 177.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -81.37 -11.34 59.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.856 -0.611 . . . . 73.44 109.629 171.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 60.25 81.85 0.24 Allowed Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 114.506 -1.225 . . . . 72.43 111.734 176.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.583 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 20.9 Cg_exo -66.27 164.28 28.72 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.719 2.279 . . . . 74.3 110.969 175.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 1.132 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.478 0 C-N-CA 119.595 -0.842 . . . . 64.11 110.476 -176.347 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.387 0 N-CA-C 109.396 -0.594 . . . . 75.54 109.396 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.68 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 11.0 mp -72.61 92.35 1.51 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.339 -0.391 . . . . 74.24 110.293 178.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.625 ' HA ' ' O ' ' A' ' 58' ' ' LYS . . . -87.56 70.25 9.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.966 -0.561 . . . . 75.41 109.834 175.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.68 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 45.3 p90 -100.92 169.29 9.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.622 -0.717 . . . . 72.24 110.527 -177.413 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -105.65 121.72 44.57 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.477 -0.328 . . . . 73.15 111.391 -176.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.555 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 48.5 t -110.18 103.62 12.34 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.109 -0.496 . . . . 65.0 109.891 175.136 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 65.01 12.81 8.21 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.676 0.621 . . . . 73.24 112.676 174.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.45 -28.94 4.9 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.402 -0.904 . . . . 63.13 112.482 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.404 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 12.0 pt-20 -95.54 131.92 41.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.015 0.436 . . . . 74.21 110.721 -179.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 50.0 mm -75.26 129.64 36.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.103 -0.499 . . . . 72.33 110.375 177.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.625 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 28.0 mmmt -113.05 155.36 25.0 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.078 -0.712 . . . . 64.44 109.078 178.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.4 p -128.45 108.82 10.86 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.001 0.429 . . . . 74.54 110.889 175.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.452 ' CD2' HD12 ' A' ' 66' ' ' LEU . 87.2 m-85 -121.17 123.69 42.9 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.94 -0.573 . . . . 73.23 111.27 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.7 p -116.82 -17.27 10.51 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.396 -0.82 . . . . 74.31 109.527 174.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -106.97 127.3 53.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.472 -0.786 . . . . 70.34 110.526 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.5 tt -65.35 -44.06 88.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.996 -0.547 . . . . 74.04 110.328 -176.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.534 ' O ' ' HG3' ' A' ' 68' ' ' LYS . 47.9 tp60 -58.55 -41.48 85.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.095 -0.502 . . . . 75.1 110.84 -177.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.7 m -62.91 -45.76 90.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.12 -0.491 . . . . 74.31 111.011 178.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.452 HD12 ' CD2' ' A' ' 60' ' ' PHE . 55.2 tp -70.35 -31.8 69.24 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 75.43 110.888 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.417 ' HG2' ' HG ' ' A' ' 84' ' ' LEU . 3.4 tmm_? -62.79 -29.22 70.54 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.173 -0.467 . . . . 72.31 110.378 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.534 ' HG3' ' O ' ' A' ' 64' ' ' GLN . 91.5 mttt -70.02 -46.16 65.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.352 0.596 . . . . 71.14 110.599 176.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -67.28 -48.8 66.6 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.186 -0.915 . . . . 73.53 110.956 -176.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.1 -26.69 67.58 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.17 -0.468 . . . . 72.22 111.636 -177.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 35.9 t -75.97 -23.53 55.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.559 -0.291 . . . . 75.53 111.472 -178.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -102.82 2.01 34.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.328 0.585 . . . . 74.34 110.299 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.555 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 28.2 mmmt -103.5 101.12 11.0 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.216 -0.902 . . . . 73.34 109.751 175.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.4 p -55.83 -33.32 64.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.04 0.448 . . . . 73.2 111.07 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.444 ' O ' HD12 ' A' ' 79' ' ' LEU . 3.0 m -62.34 -45.64 92.3 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.727 -0.669 . . . . 72.53 110.937 177.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 82.0 mtp -90.95 -13.51 33.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.159 -0.473 . . . . 74.12 111.482 -174.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.636 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 33.6 ttpt -75.24 -9.05 58.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.778 0.323 . . . . 72.21 110.709 -176.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -99.06 -5.06 31.0 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.904 0.859 . . . . 74.24 109.492 174.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.713 ' HB3' HG21 ' B' ' 133' ' ' ILE . 10.7 mp -97.62 -55.92 2.67 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.442 -1.254 . . . . 74.34 109.42 176.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.806 ' HB3' HD13 ' A' ' 84' ' ' LEU . 3.8 mm? -81.19 -7.79 59.63 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 114.806 -1.088 . . . . 74.42 112.111 -176.254 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.636 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 64.8 pttt -55.05 -20.22 9.03 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.812 0.339 . . . . 75.4 111.729 178.012 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -69.24 -33.69 73.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.348 -0.387 . . . . 74.22 111.219 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 27.0 m -115.9 -8.3 12.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.018 0.377 . . . . 72.04 112.018 -175.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.806 HD13 ' HB3' ' A' ' 80' ' ' LEU . 8.3 mp . . . . . 0 C--N 1.326 -0.413 0 CA-C-N 116.464 -0.334 . . . . 64.14 110.823 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 29.7 p90 . . . . . 0 N--CA 1.463 0.178 0 CA-C-O 120.716 0.293 . . . . 73.45 111.569 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 132' ' ' ASN . . . . . 0.43 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 30.0 t30 -58.13 -54.55 45.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.855 -0.612 . . . . 70.4 111.079 -179.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 133' ' ' ILE . . . . . 0.713 HG21 ' HB3' ' A' ' 79' ' ' LEU . 4.1 mp -62.0 -40.57 87.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.138 0.494 . . . . 73.41 110.651 -177.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 89.9 mt -64.27 -31.38 72.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.928 -0.578 . . . . 74.44 111.142 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 54.2 ttt-85 -70.52 -45.02 66.36 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.113 0.482 . . . . 72.01 110.359 177.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 136' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 14.6 mm-40 -66.25 -33.08 74.94 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.587 -0.733 . . . . 73.13 111.58 -176.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -100.22 7.99 44.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.707 0.289 . . . . 74.43 111.22 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 56.16 68.16 0.9 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.718 -0.673 . . . . 73.14 112.639 175.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 139' ' ' PHE . . . . . 0.412 ' O ' ' HB2' ' A' ' 51' ' ' PHE . 11.4 m-85 -97.96 1.86 48.4 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.996 -0.547 . . . . 75.15 110.377 173.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 140' ' ' GLU . . . . . 0.453 ' HG3' ' HZ3' ' B' ' 142' ' ' LYS . 18.4 tp10 66.81 71.57 0.44 Allowed Pre-proline 0 CA--C 1.534 0.362 0 O-C-N 123.886 0.741 . . . . 74.5 110.696 -178.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -74.18 160.3 42.7 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.648 2.232 . . . . 61.25 111.689 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 142' ' ' LYS . . . . . 0.453 ' HZ3' ' HG3' ' B' ' 140' ' ' GLU . 11.4 mptt . . . . . 0 C--N 1.325 -0.494 0 N-CA-C 112.151 0.426 . . . . 71.31 112.151 -176.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? . . . . . 0 CA--C 1.519 -0.241 0 CA-C-O 121.206 0.527 . . . . 72.04 110.648 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.542 HD13 ' HB3' ' A' ' 31' ' ' PHE . 23.5 tp -98.2 15.11 25.43 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.402 -0.817 . . . . 74.44 109.02 172.663 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.639 ' HB1' HG22 ' B' ' 159' ' ' THR . . . -34.61 104.11 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 O-C-N 124.317 1.011 . . . . 74.42 113.242 -173.29 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 151' ' ' PHE . . . . . 0.583 ' HB3' ' HA ' ' A' ' 41' ' ' PRO . 50.5 p90 -119.04 174.23 6.43 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 114.921 -1.036 . . . . 75.53 109.543 -177.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -100.56 123.45 44.79 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.146 0.498 . . . . 70.41 111.578 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 153' ' ' CYS . . . . . 0.539 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 49.8 t -124.8 116.59 22.53 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.399 -0.819 . . . . 74.5 109.229 174.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . 0.504 ' CG ' ' HZ2' ' B' ' 173' ' ' LYS . 1.0 OUTLIER 63.29 17.58 10.36 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.462 -0.335 . . . . 72.04 111.469 178.542 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 110.44 -29.59 8.96 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.641 -0.79 . . . . 73.2 112.714 178.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 156' ' ' GLU . . . . . 0.613 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 12.7 pt-20 -93.79 146.66 23.71 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.051 0.453 . . . . 64.15 110.677 -177.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.7 mm -85.06 120.17 35.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.227 -0.442 . . . . 73.41 110.162 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 158' ' ' LYS . . . . . 0.613 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 28.4 mmmt -102.54 120.03 39.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.458 -0.337 . . . . 74.31 110.267 -178.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 159' ' ' THR . . . . . 0.639 HG22 ' HB1' ' B' ' 150' ' ' ALA . 2.5 p -95.69 110.52 22.64 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.118 -0.492 . . . . 74.12 112.164 -176.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 160' ' ' PHE . . . . . 0.56 ' CD2' HD13 ' B' ' 166' ' ' LEU . 61.5 m-85 -132.65 151.94 51.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.709 -0.678 . . . . 73.04 110.192 176.577 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 13.2 p -134.03 14.11 3.92 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.049 -0.523 . . . . 73.44 110.006 176.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -146.96 144.59 29.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.757 -0.656 . . . . 74.02 110.598 -176.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . 0.431 ' O ' HD12 ' B' ' 163' ' ' LEU . 2.6 tm? -78.19 -34.28 49.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.456 . . . . 75.52 110.679 -175.304 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -67.17 -46.77 73.0 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.688 0.28 . . . . 74.03 110.496 -178.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 41.8 m -61.42 -39.12 89.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.359 -0.382 . . . . 63.14 110.86 177.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . 0.56 HD13 ' CD2' ' B' ' 160' ' ' PHE . 62.5 tp -71.47 -31.83 67.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.423 -0.353 . . . . 71.54 110.858 179.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 21.5 ttm180 -57.5 -39.35 76.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.356 -0.384 . . . . 74.31 110.543 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -60.11 -51.95 67.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.942 -0.572 . . . . 75.22 110.591 177.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 169' ' ' PHE . . . . . 0.425 ' CZ ' ' HE2' ' B' ' 158' ' ' LYS . 73.9 t80 -66.16 -43.6 86.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.261 -0.881 . . . . 74.32 111.074 -176.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -59.9 -40.89 90.3 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.121 -0.491 . . . . 64.44 111.977 -177.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 12.8 t -78.54 -21.32 48.95 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.759 0.281 . . . . 73.21 111.759 -174.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -93.96 -13.53 26.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.193 0.521 . . . . 72.13 110.617 179.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 173' ' ' LYS . . . . . 0.539 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 27.7 mmmt -88.59 117.16 27.35 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.042 -0.526 . . . . 75.11 110.28 176.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 1.5 m -51.42 -46.26 62.89 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 123.449 0.468 . . . . 65.12 110.96 -179.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 5.4 m -67.26 -43.87 80.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.897 -0.592 . . . . 71.34 111.556 -179.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 176' ' ' MET . . . . . 0.421 ' HA ' HD13 ' B' ' 179' ' ' LEU . 73.5 mtp -80.09 -22.39 42.27 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.779 0.323 . . . . 74.44 111.712 -174.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 177' ' ' LYS . . . . . 0.452 ' HE2' ' HB3' ' B' ' 177' ' ' LYS . 33.8 ttpt -58.37 -38.94 78.28 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.02 -0.536 . . . . 75.53 110.851 -177.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -86.1 -3.23 58.91 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.644 0.735 . . . . 74.3 110.063 -174.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 179' ' ' LEU . . . . . 0.535 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 78.1 mt -94.48 -42.13 9.01 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 114.89 -1.05 . . . . 74.24 109.667 179.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 180' ' ' LEU . . . . . 0.602 ' HB3' HD12 ' B' ' 184' ' ' LEU . 4.0 mm? -96.38 -9.84 29.04 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.608 -0.724 . . . . 73.11 111.929 -176.29 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 181' ' ' LYS . . . . . 0.444 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 65.5 pttt -55.52 -17.61 5.7 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.838 0.681 . . . . 73.21 112.838 -177.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -70.9 -38.53 73.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.859 0.361 . . . . 43.23 110.687 179.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 31.5 m -107.67 -10.35 10.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.259 -0.428 . . . . 74.42 111.365 -176.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 184' ' ' LEU . . . . . 0.602 HD12 ' HB3' ' B' ' 180' ' ' LEU . 9.3 mp . . . . . 0 C--N 1.327 -0.406 0 CA-C-N 116.272 -0.422 . . . . 72.12 110.316 177.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.44 ' HB2' ' HB3' ' A' ' 41' ' ' PRO . 22.6 p90 . . . . . 0 N--CA 1.475 0.785 0 N-CA-C 113.918 1.081 . . . . 63.21 113.918 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.474 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 9.4 t30 -66.35 -53.09 40.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.878 0.37 . . . . 74.33 110.307 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.56 HG23 ' HB3' ' B' ' 179' ' ' LEU . 45.8 mm -58.07 -43.7 85.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.87 -0.604 . . . . 74.22 110.616 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.639 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 64.7 mt -60.3 -42.06 94.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.695 -0.684 . . . . 74.31 111.252 179.358 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -64.61 -42.43 95.54 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.408 -0.36 . . . . 75.4 110.185 -179.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 38.8 mm-40 -65.75 -32.81 74.56 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.257 -0.429 . . . . 73.21 111.32 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -99.67 7.16 45.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.947 0.403 . . . . 54.35 111.064 -178.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 56.65 54.63 7.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.433 -0.803 . . . . 75.4 112.278 177.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.639 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 7.9 m-85 -84.45 -7.94 59.12 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.13 -0.693 . . . . 74.54 109.13 168.271 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 64.15 88.14 0.12 Allowed Pre-proline 0 N--CA 1.455 -0.18 0 CA-C-N 114.633 -1.167 . . . . 74.2 111.685 179.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.44 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 51.1 Cg_endo -70.28 148.36 61.51 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.56 2.174 . . . . 75.42 111.362 175.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.582 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 3.6 tptp . . . . . 0 C--N 1.325 -0.46 0 C-N-CA 119.848 -0.741 . . . . 74.41 110.846 -179.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.567 ' O ' ' HB3' ' B' ' 142' ' ' LYS . 3.8 mptt . . . . . 0 CA--C 1.508 -0.645 0 N-CA-C 109.099 -0.704 . . . . 75.32 109.099 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.759 HD23 HD13 ' B' ' 134' ' ' LEU . 46.2 tp -111.26 78.87 1.15 Allowed 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 109.225 -0.657 . . . . 74.2 109.225 169.501 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.826 ' H ' ' HB2' ' B' ' 142' ' ' LYS . . . -90.95 83.33 5.64 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.196 -0.911 . . . . 74.34 109.506 176.051 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.528 ' HD1' ' HG ' ' A' ' 49' ' ' LEU . 31.2 p90 -103.53 170.94 7.64 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.427 -0.806 . . . . 75.42 109.732 -178.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -98.24 127.51 44.22 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 120.324 -0.55 . . . . 71.41 110.177 177.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.499 ' SG ' ' HE2' ' A' ' 69' ' ' PHE . 29.8 t -133.5 108.81 8.86 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.895 -0.593 . . . . 73.11 109.567 175.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 70.82 27.06 3.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.321 -0.854 . . . . 63.42 110.627 176.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 103.68 -36.48 4.32 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.482 -0.866 . . . . 71.34 112.771 177.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.448 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 10.7 pt-20 -91.77 148.95 21.86 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.211 0.529 . . . . 75.23 110.673 -178.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 50.7 mm -86.16 127.27 40.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.481 -0.781 . . . . 74.42 109.652 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.66 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 29.2 mmmt -112.58 128.26 56.31 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.421 -0.354 . . . . 62.22 110.331 -176.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.33 109.37 21.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.007 0.432 . . . . 70.24 111.189 179.15 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.66 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 35.5 m-85 -118.82 148.4 42.9 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.129 -0.487 . . . . 73.53 110.472 178.567 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 11.7 p -138.17 6.58 2.6 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.184 -0.462 . . . . 71.22 110.939 176.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -142.43 144.01 32.88 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.879 -0.415 . . . . 73.43 109.879 179.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.461 ' O ' HD11 ' A' ' 63' ' ' LEU . 1.4 tm? -72.11 -32.33 66.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.25 -0.432 . . . . 75.43 110.244 -179.355 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.414 ' NE2' HH21 ' A' ' 67' ' ' ARG . 7.0 tp60 -64.8 -44.98 88.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.97 0.414 . . . . 73.41 110.355 -178.066 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.4 m -64.69 -38.32 90.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.789 -0.641 . . . . 62.4 110.181 178.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.481 ' HA ' ' CE2' ' A' ' 60' ' ' PHE . 47.3 tp -70.83 -36.17 72.78 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.764 -0.653 . . . . 74.3 111.178 -177.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.414 HH21 ' NE2' ' A' ' 64' ' ' GLN . 56.8 ttp85 -54.48 -45.62 73.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.09 0.471 . . . . 74.24 111.2 178.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 39.0 mtmt -66.23 -38.6 88.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.983 -0.553 . . . . 73.14 111.076 -176.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.499 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 55.8 t80 -74.44 -39.32 62.64 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.239 0.542 . . . . 73.23 110.443 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.69 -23.89 66.18 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.013 -0.539 . . . . 73.4 111.449 179.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.1 t -74.94 -38.84 61.66 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.522 -0.308 . . . . 73.13 111.128 -179.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 20.6 pt20 -74.8 -28.2 60.62 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.006 0.431 . . . . 73.14 110.237 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.433 ' HE3' ' HB3' ' A' ' 73' ' ' LYS . 25.8 mmmt -79.23 109.9 13.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.942 -0.572 . . . . 75.34 110.68 176.192 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.5 p -61.53 -29.75 70.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.376 -0.374 . . . . 71.21 111.737 -176.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.7 p -76.4 -45.57 31.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.951 0.405 . . . . 63.22 110.973 178.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 81.2 mtp -71.42 -26.32 62.7 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.34 -0.391 . . . . 73.43 110.634 -178.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.539 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 26.1 ttpp -56.44 -29.3 61.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.906 -0.588 . . . . 74.54 111.081 177.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -96.36 -4.69 41.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.292 0.568 . . . . 73.14 110.641 -176.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.582 ' HB3' ' CG2' ' B' ' 133' ' ' ILE . 84.3 mt -91.97 -46.95 7.55 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.314 -0.857 . . . . 71.14 109.421 177.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.78 -11.6 53.12 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.318 -0.856 . . . . 74.15 111.693 -177.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.539 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 62.6 pttt -60.17 -18.59 49.04 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.372 0.508 . . . . 72.41 112.372 -177.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.53 -44.53 86.58 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.128 0.489 . . . . 62.31 110.399 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 23.1 m -98.46 -11.1 8.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.83 -0.623 . . . . 74.01 111.107 -177.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.9 mt . . . . . 0 C--N 1.325 -0.497 0 N-CA-C 109.334 -0.617 . . . . 75.25 109.334 174.134 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 131' ' ' PHE . . . . . 0.484 ' HB3' HD22 ' A' ' 49' ' ' LEU . 22.1 p90 . . . . . 0 N--CA 1.477 0.922 0 N-CA-C 113.426 0.898 . . . . 74.12 113.426 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 132' ' ' ASN . . . . . 0.46 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 8.9 t30 -69.98 -44.31 69.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.522 0.201 . . . . 72.24 110.844 -177.296 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 133' ' ' ILE . . . . . 0.582 ' CG2' ' HB3' ' A' ' 79' ' ' LEU . 50.3 mm -58.24 -43.54 86.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.395 0.617 . . . . 64.31 110.414 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.759 HD13 HD23 ' A' ' 49' ' ' LEU . 61.1 mt -67.4 -29.98 69.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.616 -0.72 . . . . 73.35 110.711 178.194 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -71.82 -41.56 68.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.988 -0.551 . . . . 74.51 110.1 178.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 136' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 11.1 mm-40 -66.7 -37.17 84.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.922 -0.581 . . . . 74.24 111.461 179.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -96.42 -0.64 48.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.468 -0.333 . . . . 74.13 111.36 -176.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 38.4 t70 58.34 69.24 0.75 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.648 0.737 . . . . 74.24 112.043 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 139' ' ' PHE . . . . . 0.543 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 3.2 m-85 -97.54 7.34 46.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.529 -0.759 . . . . 70.25 109.501 170.745 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 62.14 79.15 0.28 Allowed Pre-proline 0 C--N 1.332 -0.177 0 CA-C-N 114.61 -1.177 . . . . 74.55 111.046 -176.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.51 156.34 66.53 Favored 'Trans proline' 0 N--CA 1.464 -0.242 0 C-N-CA 122.388 2.059 . . . . 75.13 110.33 173.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 142' ' ' LYS . . . . . 0.826 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 23.3 tptt . . . . . 0 C--N 1.327 -0.385 0 C-N-CA 119.296 -0.962 . . . . 75.21 110.548 -178.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . 0.421 ' H ' ' HD2' ' B' ' 148' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.509 -0.618 0 N-CA-C 109.341 -0.614 . . . . 71.42 109.341 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.642 ' HG ' ' HD1' ' B' ' 151' ' ' PHE . 56.5 tp -75.11 83.52 2.32 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.263 0.554 . . . . 75.2 109.678 177.314 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.582 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -91.5 76.9 5.8 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.289 -0.869 . . . . 63.22 109.863 177.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 151' ' ' PHE . . . . . 0.642 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 42.3 p90 -94.01 167.87 11.32 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.52 -0.764 . . . . 73.31 110.323 -176.122 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -99.58 113.89 26.59 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 121.248 0.547 . . . . 74.23 110.66 179.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 153' ' ' CYS . . . . . 0.586 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 44.1 t -110.22 102.47 11.14 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.507 -0.769 . . . . 74.31 110.098 179.377 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 15.0 t70 68.91 17.93 8.59 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 115.545 -0.752 . . . . 73.01 111.234 175.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 122.26 -34.73 3.72 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.204 -0.998 . . . . 64.04 112.882 177.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -94.61 150.16 20.51 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.624 0.249 . . . . 72.13 110.611 -178.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.9 mm -84.23 131.39 34.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 109.899 -0.408 . . . . 74.12 109.899 175.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 158' ' ' LYS . . . . . 0.592 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 31.8 mmmt -120.98 129.81 53.57 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.032 -0.358 . . . . 74.35 110.032 178.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.83 107.14 17.88 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.102 0.477 . . . . 74.41 111.85 -176.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 160' ' ' PHE . . . . . 0.592 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 42.6 m-85 -120.47 135.54 55.03 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.18 -0.463 . . . . 75.32 110.78 178.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 31.4 p -120.7 10.12 10.92 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.103 0.478 . . . . 65.32 110.461 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -144.2 138.76 28.29 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.829 -0.623 . . . . 74.21 110.543 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -74.77 -39.31 61.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.864 -0.607 . . . . 75.41 110.275 -176.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -60.8 -45.67 93.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.086 0.469 . . . . 74.13 110.64 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 165' ' ' SER . . . . . 0.547 ' HA ' ' HE2' ' B' ' 168' ' ' LYS . 23.8 m -60.71 -38.21 84.29 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.815 -0.629 . . . . 73.23 110.63 176.282 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 53.3 tp -70.55 -32.08 69.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.093 -0.503 . . . . 73.22 111.091 -178.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -59.45 -38.27 80.29 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.666 0.27 . . . . 73.23 110.504 177.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 168' ' ' LYS . . . . . 0.547 ' HE2' ' HA ' ' B' ' 165' ' ' SER . 56.9 mtmt -61.6 -46.58 89.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.274 0.559 . . . . 73.32 110.588 177.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 169' ' ' PHE . . . . . 0.497 ' O ' ' HG2' ' B' ' 172' ' ' GLN . 66.9 t80 -66.67 -43.41 84.57 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.406 -0.816 . . . . 72.53 110.327 -179.465 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -60.8 -36.13 78.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.002 -0.545 . . . . 74.43 111.2 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 45.3 m -74.62 -22.25 59.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.487 -0.324 . . . . 65.44 111.849 -176.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . 0.497 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 13.7 pt20 -95.54 -7.73 37.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.091 0.472 . . . . 74.05 110.454 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 173' ' ' LYS . . . . . 0.586 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 30.1 mmmt -96.86 119.56 35.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.858 -0.61 . . . . 72.54 110.138 179.18 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 24.1 m -56.51 -37.59 70.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.99 0.424 . . . . 72.23 110.805 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 11.2 p -76.02 -49.83 16.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.678 -0.692 . . . . 74.01 111.521 -178.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 176' ' ' MET . . . . . 0.487 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 81.1 mtp -74.57 -22.3 59.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.092 -0.504 . . . . 74.34 111.996 -173.363 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -62.63 -25.91 68.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.136 0.493 . . . . 64.53 111.014 -178.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -103.27 8.31 38.33 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.612 0.72 . . . . 75.35 110.544 -177.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 179' ' ' LEU . . . . . 0.56 ' HB3' HG23 ' A' ' 33' ' ' ILE . 97.3 mt -103.31 -49.36 3.74 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.049 -0.978 . . . . 74.44 110.28 176.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 180' ' ' LEU . . . . . 0.496 ' HB3' HD13 ' B' ' 184' ' ' LEU . 4.0 mm? -85.05 -17.91 35.97 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.671 -0.695 . . . . 73.44 112.312 -174.1 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 59.2 pttt -64.26 -20.55 66.13 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.69 0.281 . . . . 74.22 111.665 -174.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -67.92 -47.99 67.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.977 0.418 . . . . 74.12 110.548 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 183' ' ' VAL . . . . . 0.416 HG21 ' HG ' ' B' ' 184' ' ' LEU . 31.4 m -91.82 -21.58 6.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.955 -0.566 . . . . 75.13 111.279 -177.377 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 184' ' ' LEU . . . . . 0.496 HD13 ' HB3' ' B' ' 180' ' ' LEU . 87.7 mt . . . . . 0 C--N 1.322 -0.6 0 N-CA-C 109.147 -0.686 . . . . 74.2 109.147 176.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.581 ' HB3' HD12 ' B' ' 149' ' ' LEU . 36.0 p90 . . . . . 0 N--CA 1.482 1.175 0 N-CA-C 114.549 1.314 . . . . 75.33 114.549 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -67.28 -57.17 7.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.839 0.352 . . . . 75.01 111.618 -175.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.485 HG21 ' HB3' ' B' ' 179' ' ' LEU . 48.7 mm -62.38 -37.81 79.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.367 0.603 . . . . 74.15 111.136 -177.245 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.4 mt -59.2 -33.15 70.62 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.332 -0.849 . . . . 74.25 111.551 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 51.4 ttt180 -68.56 -46.87 68.33 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.07 0.462 . . . . 71.22 110.406 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -69.04 -27.68 65.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.396 -0.82 . . . . 75.44 111.645 -173.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -106.61 6.83 30.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.548 -0.296 . . . . 72.43 111.19 -177.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.2 t70 58.55 69.89 0.69 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 115.494 -0.776 . . . . 75.53 111.919 175.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -98.76 3.13 47.48 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.697 -0.683 . . . . 74.42 111.037 172.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 58.02 71.37 1.06 Allowed Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 115.943 -0.571 . . . . 73.41 110.783 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -87.31 166.7 7.92 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.616 2.211 . . . . 75.13 112.505 -178.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.782 ' HB2' ' HA ' ' B' ' 149' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.333 -0.394 . . . . 75.43 110.413 177.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.428 ' HD2' ' O ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.445 -0.702 0 N-CA-C 109.59 -0.522 . . . . 74.41 109.59 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.771 ' HA ' ' HB2' ' B' ' 142' ' ' LYS . 0.2 OUTLIER -75.71 90.96 2.87 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 120.492 -0.483 . . . . 75.41 109.815 178.21 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.16 90.58 1.58 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.506 -0.77 . . . . 74.01 109.348 173.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.421 ' HA ' ' O ' ' B' ' 140' ' ' GLU . 53.9 p90 -107.16 166.84 10.33 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.525 -0.761 . . . . 73.14 110.514 -177.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.804 ' HE2' ' HA2' ' A' ' 55' ' ' GLY . 82.3 tttt -105.93 113.0 26.28 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.628 -0.715 . . . . 72.03 109.928 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.621 ' SG ' ' HE3' ' A' ' 73' ' ' LYS . 53.6 t -100.13 93.54 5.77 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.9 -0.591 . . . . 62.32 110.032 -179.248 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.9 t70 70.91 -9.09 0.87 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.664 0.745 . . . . 74.53 111.609 176.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.804 ' HA2' ' HE2' ' A' ' 52' ' ' LYS . . . 150.39 -27.25 1.09 Allowed Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.677 -0.692 . . . . 64.01 112.276 -178.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 53' ' ' CYS . 11.7 pt-20 -91.88 130.06 37.72 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.743 0.306 . . . . 75.53 110.695 -179.055 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.6 mm -80.9 122.38 36.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.682 -0.488 . . . . 74.21 109.682 177.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.585 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 30.6 mmmt -120.62 131.08 54.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.449 -0.342 . . . . 75.34 110.444 -177.744 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.1 p -101.09 113.73 27.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.068 0.461 . . . . 74.44 111.311 177.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.585 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 22.6 m-85 -120.85 139.48 53.11 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.892 -0.595 . . . . 75.21 110.825 178.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.4 t -120.85 -24.24 5.71 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.833 -0.803 . . . . 60.44 108.833 176.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -101.38 137.3 39.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.261 -0.881 . . . . 51.21 109.658 179.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.7 mt -83.25 -31.55 26.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.958 0.408 . . . . 75.14 110.701 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -69.39 -36.84 77.18 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.467 -0.333 . . . . 74.33 110.312 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.1 m -70.61 -32.71 70.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.032 0.444 . . . . 71.4 110.331 176.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.488 ' HA ' ' CE2' ' A' ' 60' ' ' PHE . 3.5 tm? -67.82 -42.16 81.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.719 -0.673 . . . . 65.11 109.721 177.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -33.6 70.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.466 -0.788 . . . . 75.32 110.128 -179.658 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -65.43 -47.84 74.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.651 -0.704 . . . . 75.24 111.057 176.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -63.35 -40.28 96.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.666 -0.697 . . . . 73.01 110.886 -175.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.8 -22.88 66.0 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.486 -0.325 . . . . 72.32 111.155 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.1 m -76.05 -20.73 57.5 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.302 -0.408 . . . . 73.54 111.673 -178.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -100.01 3.19 44.07 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.197 0.522 . . . . 75.41 110.724 178.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.621 ' HE3' ' SG ' ' A' ' 53' ' ' CYS . 70.6 mmtt -108.5 109.68 21.0 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.665 -0.698 . . . . 64.54 110.184 178.358 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.9 m -58.35 -32.41 68.51 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.823 0.344 . . . . 75.11 111.131 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.443 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 8.1 m -76.36 -37.96 56.52 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.304 -0.407 . . . . 71.41 111.251 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.557 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 77.4 mtp -86.35 -22.33 26.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.881 0.372 . . . . 71.42 111.566 -175.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -62.25 -30.0 70.8 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.994 -0.548 . . . . 74.02 111.981 -175.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -103.92 3.47 33.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.552 0.691 . . . . 74.55 110.319 -178.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 75' ' ' SER . 63.9 mt -86.52 -51.35 6.23 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.352 -0.84 . . . . 73.23 108.761 170.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.85 -7.66 56.98 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.88 -1.055 . . . . 73.0 111.393 -177.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.453 ' HE3' ' HB2' ' A' ' 81' ' ' LYS . 19.0 ptmt -57.85 -19.12 26.7 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.115 0.413 . . . . 74.13 112.115 -177.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -74.12 -43.77 56.31 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.998 -0.281 . . . . 75.22 110.773 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 32.7 m -91.41 -20.16 6.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.084 0.469 . . . . 71.4 110.909 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 40.9 mt . . . . . 0 C--N 1.326 -0.453 0 N-CA-C 108.991 -0.744 . . . . 75.23 108.991 175.438 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 131' ' ' PHE . . . . . 0.652 ' HB3' HD13 ' A' ' 49' ' ' LEU . 24.6 p90 . . . . . 0 N--CA 1.479 0.998 0 N-CA-C 114.086 1.143 . . . . 64.21 114.086 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -68.31 -61.55 1.79 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.95 0.405 . . . . 72.55 110.854 -178.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 133' ' ' ILE . . . . . . . . . . . . . 49.0 mm -60.06 -38.44 76.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.902 -0.59 . . . . 74.32 111.044 -177.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 70.0 mt -56.46 -37.41 70.26 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.545 -0.752 . . . . 73.52 111.158 177.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -69.45 -42.72 74.56 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.3 -0.409 . . . . 73.32 110.906 -178.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -69.93 -29.45 66.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.916 -0.584 . . . . 71.21 111.533 -175.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -98.47 -0.14 44.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.035 0.445 . . . . 70.35 110.677 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 26.4 t70 61.84 64.01 1.06 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.05 -0.977 . . . . 74.53 111.515 177.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -91.36 2.97 56.01 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.283 -0.871 . . . . 75.54 110.372 171.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 140' ' ' GLU . . . . . 0.421 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 14.7 tp10 61.71 63.41 2.23 Favored Pre-proline 0 CA--C 1.538 0.49 0 CA-C-N 115.948 -0.569 . . . . 75.15 111.397 178.617 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.4 163.47 34.41 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.262 1.975 . . . . 71.23 111.204 177.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 142' ' ' LYS . . . . . 0.81 ' HA ' ' HE3' ' B' ' 142' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.528 0 C-N-CA 120.81 -0.356 . . . . 75.24 111.372 -176.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . 0.529 ' CG ' HG23 ' B' ' 159' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.399 0 N-CA-C 110.22 -0.289 . . . . 74.42 110.22 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.782 ' HA ' ' HB2' ' A' ' 42' ' ' LYS . 0.5 OUTLIER -78.29 86.2 4.4 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 109.285 -0.635 . . . . 72.52 109.285 174.525 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -78.56 91.28 4.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.242 -0.89 . . . . 73.3 109.295 175.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 151' ' ' PHE . . . . . 0.442 ' CE2' ' HB2' ' B' ' 153' ' ' CYS . 52.6 p90 -108.57 164.7 12.12 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.08 -0.509 . . . . 75.11 110.736 -175.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 152' ' ' LYS . . . . . 0.726 ' HE2' ' HA2' ' B' ' 155' ' ' GLY . 78.0 tttt -92.9 104.92 17.12 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.762 -0.654 . . . . 72.25 110.015 179.232 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 153' ' ' CYS . . . . . 0.788 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 36.8 t -93.45 92.26 7.54 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.352 -0.84 . . . . 73.04 110.607 -174.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 16.8 t70 66.44 6.89 4.62 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.762 -0.654 . . . . 74.53 111.294 174.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 155' ' ' GLY . . . . . 0.726 ' HA2' ' HE2' ' B' ' 152' ' ' LYS . . . 138.53 -32.65 2.29 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.966 -0.635 . . . . 73.53 112.348 -179.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 156' ' ' GLU . . . . . 0.486 ' OE1' ' HD3' ' B' ' 158' ' ' LYS . 16.0 pt-20 -98.06 135.18 40.11 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.502 0.191 . . . . 71.03 110.665 -177.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 46.7 mm -77.48 120.14 27.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.54 -0.541 . . . . 75.42 109.54 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 158' ' ' LYS . . . . . 0.507 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 32.3 mmmt -117.17 123.58 47.04 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.81 0.338 . . . . 74.12 110.621 -177.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 159' ' ' THR . . . . . 0.529 HG23 ' CG ' ' B' ' 148' ' ' LYS . 0.3 OUTLIER -93.94 107.67 19.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.095 -0.502 . . . . 73.5 111.005 178.567 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 160' ' ' PHE . . . . . 0.507 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 57.3 m-85 -115.13 123.79 49.85 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.329 0.585 . . . . 74.44 111.482 179.126 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 23.3 t -120.79 10.75 11.01 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 107.665 -1.235 . . . . 73.14 107.665 171.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -129.7 110.39 11.74 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.36 -1.291 . . . . 63.24 109.476 -177.322 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -69.52 -32.96 72.11 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.486 -0.324 . . . . 71.12 111.087 -176.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -68.44 -45.8 71.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.847 0.356 . . . . 73.42 110.458 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 49.8 m -64.27 -30.78 71.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.215 -0.448 . . . . 55.42 110.485 176.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . 0.437 ' HA ' ' CE2' ' B' ' 160' ' ' PHE . 61.5 tp -68.1 -39.98 82.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.489 . . . . 71.14 110.69 177.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -59.55 -38.68 81.72 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.251 -0.431 . . . . 75.25 110.648 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -58.66 -54.84 42.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.294 0.569 . . . . 75.44 110.575 176.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 169' ' ' PHE . . . . . 0.607 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 57.0 t80 -66.56 -44.86 81.17 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.944 -1.025 . . . . 74.44 111.584 -172.273 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.4 -29.49 70.53 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 111.948 0.351 . . . . 73.31 111.948 -178.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 3.7 t -80.65 -23.55 39.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.754 0.312 . . . . 63.22 110.96 -175.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -95.27 -15.81 22.91 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.82 0.343 . . . . 71.03 111.102 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 173' ' ' LYS . . . . . 0.788 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 25.6 mmmt -78.41 116.25 18.68 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.522 -0.547 . . . . 73.24 109.522 173.617 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 22.0 t -59.51 -33.87 71.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.356 -0.384 . . . . 71.22 111.412 -174.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 175' ' ' SER . . . . . 0.427 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 5.1 p -78.97 -40.98 30.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.768 0.318 . . . . 71.42 111.291 179.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 176' ' ' MET . . . . . 0.525 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 70.3 mtp -75.21 -27.29 59.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.566 -0.288 . . . . 71.54 111.667 -177.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 45.8 tttm -52.79 -40.26 63.05 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.284 -0.416 . . . . 74.41 111.625 -178.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -92.33 -2.99 56.04 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.561 0.695 . . . . 65.23 110.051 -173.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 179' ' ' LEU . . . . . 0.485 ' HB3' HG21 ' A' ' 33' ' ' ILE . 60.1 mt -88.7 -47.72 8.04 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.014 -0.994 . . . . 63.1 108.92 173.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 180' ' ' LEU . . . . . 0.43 HD12 HG13 ' A' ' 33' ' ' ILE . 4.1 mm? -86.62 -7.94 57.9 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.881 -1.054 . . . . 72.34 111.689 -176.096 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 18.1 ptmt -53.21 -23.16 7.95 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.499 0.555 . . . . 72.32 112.499 -178.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -72.41 -40.85 66.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.239 0.543 . . . . 64.31 110.174 177.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 47.5 t -82.14 -35.71 13.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.77 0.795 . . . . 72.14 109.934 178.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 184' ' ' LEU . . . . . . . . . . . . . 30.8 mt . . . . . 0 C--N 1.316 -0.85 0 CA-C-N 115.104 -0.953 . . . . 73.44 109.47 -178.667 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 11.2 p90 . . . . . 0 C--O 1.232 0.181 0 N-CA-C 112.338 0.495 . . . . 73.12 112.338 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -73.3 -52.27 14.54 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.999 -0.28 . . . . 74.25 111.073 -175.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.52 HG21 ' HB3' ' B' ' 179' ' ' LEU . 43.3 mm -55.56 -45.33 78.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.22 0.533 . . . . 74.54 111.338 -178.457 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 1.008 HD13 HD22 ' B' ' 149' ' ' LEU . 66.2 mt -66.78 -26.87 67.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.809 -0.632 . . . . 70.34 111.414 -176.332 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.469 ' HB2' ' HG3' ' A' ' 41' ' ' PRO . 1.0 OUTLIER -68.77 -40.34 79.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.785 0.326 . . . . 74.11 110.39 176.994 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -76.56 -23.82 53.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.106 0.479 . . . . 74.11 110.8 -177.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -100.54 4.3 43.43 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.017 -0.538 . . . . 74.22 110.906 -179.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.7 t70 56.11 58.59 4.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.507 -0.77 . . . . 74.21 111.85 177.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.598 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 5.8 m-85 -96.69 7.15 47.23 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.797 -0.638 . . . . 71.2 109.578 172.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.448 ' O ' ' HA ' ' B' ' 151' ' ' PHE . 30.7 tt0 61.55 80.03 0.26 Allowed Pre-proline 0 C--N 1.333 -0.117 0 CA-C-N 114.829 -1.078 . . . . 73.22 110.942 -178.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.469 ' HG3' ' HB2' ' A' ' 35' ' ' ARG . 69.3 Cg_endo -75.31 152.36 39.24 Favored 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.583 2.189 . . . . 73.45 111.966 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.636 ' H ' HD12 ' B' ' 149' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.428 0 C-N-CA 120.785 -0.366 . . . . 75.23 110.675 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.429 ' H ' ' HD2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.512 0 N-CA-C 108.421 -0.955 . . . . 75.22 108.421 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.658 HD11 ' HB3' ' B' ' 141' ' ' PRO . 12.5 tp -74.93 86.49 2.28 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.012 0.434 . . . . 75.24 109.961 -176.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.54 ' HB2' HG22 ' A' ' 59' ' ' THR . . . -88.17 103.85 16.15 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.488 -0.778 . . . . 74.23 110.255 177.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -125.7 169.89 12.09 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.101 -0.5 . . . . 64.53 110.088 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.402 ' O ' ' HD1' ' B' ' 139' ' ' PHE . 32.2 ttmt -101.71 116.62 33.13 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.333 -0.394 . . . . 75.35 110.758 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.601 ' O ' ' HG2' ' A' ' 56' ' ' GLU . 52.7 t -116.18 104.12 11.21 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.937 -0.574 . . . . 60.13 110.365 179.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.8 t70 70.24 4.33 4.82 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.854 0.835 . . . . 73.54 110.805 175.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.12 -31.43 4.27 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.542 -0.753 . . . . 75.3 112.017 -179.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.601 ' HG2' ' O ' ' A' ' 53' ' ' CYS . 11.7 pt-20 -84.24 131.16 34.77 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.014 0.435 . . . . 74.21 110.082 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 41.1 mm -82.21 114.81 23.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.486 -0.561 . . . . 74.32 109.486 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.426 ' HE2' ' CE1' ' A' ' 69' ' ' PHE . 32.1 mmmt -109.63 129.72 55.57 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.23 -0.441 . . . . 73.14 111.187 -174.421 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.54 HG22 ' HB2' ' A' ' 50' ' ' ALA . 2.5 p -103.07 118.16 36.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.095 -0.502 . . . . 75.34 110.593 176.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.442 ' CD2' HD13 ' A' ' 66' ' ' LEU . 49.7 m-85 -129.72 121.36 26.75 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.206 0.527 . . . . 75.44 110.669 177.188 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.0 p -95.34 1.81 54.48 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.841 -0.618 . . . . 73.24 110.599 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -155.2 166.88 32.21 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.543 -0.753 . . . . 74.4 110.158 -178.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.518 ' O ' HD12 ' A' ' 63' ' ' LEU . 2.8 tm? -87.6 -21.22 25.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.167 -0.469 . . . . 74.3 109.898 -177.752 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -62.88 -47.66 82.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.088 -0.506 . . . . 71.52 110.946 -177.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 12.2 t -71.31 -34.26 70.43 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.372 -0.376 . . . . 74.55 110.196 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.442 HD13 ' CD2' ' A' ' 60' ' ' PHE . 57.1 tp -68.45 -34.53 76.12 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 120.996 -0.281 . . . . 74.13 110.457 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.558 ' HG3' HD12 ' A' ' 84' ' ' LEU . 50.8 ttt180 -56.17 -46.33 79.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.231 0.539 . . . . 74.31 109.914 173.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 15.8 mmmt -57.57 -36.16 71.32 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.058 -0.974 . . . . 73.35 111.299 177.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.462 ' CE2' ' HE3' ' A' ' 73' ' ' LYS . 58.5 t80 -84.87 -44.19 13.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.742 -0.663 . . . . 74.11 111.511 -175.519 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.12 -22.21 63.98 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.46 -0.336 . . . . 64.5 111.364 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 14.2 t -74.71 -17.9 60.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.316 -0.402 . . . . 74.4 111.286 -178.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 13.0 pt20 -101.79 -8.94 21.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.229 0.538 . . . . 74.13 110.185 176.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 70.0 mmtt -94.0 104.34 16.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.704 -0.68 . . . . 73.4 109.631 176.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.5 m -53.42 -32.58 50.36 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.879 0.371 . . . . 75.12 111.713 -178.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 26.9 m -76.94 -45.13 28.82 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.813 0.339 . . . . 73.41 111.297 179.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.509 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 61.4 mtp -78.38 -17.09 56.93 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.901 0.382 . . . . 74.44 111.422 -175.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.473 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 12.9 tmtt? -63.97 -24.15 67.61 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.944 -0.571 . . . . 72.23 110.593 177.205 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.543 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 28.3 mm-40 -98.24 6.62 47.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.295 0.569 . . . . 65.42 110.287 -178.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.738 ' HB3' HG23 ' B' ' 133' ' ' ILE . 43.2 mt -100.59 -46.99 5.02 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.226 -0.897 . . . . 72.24 110.233 178.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -94.92 -0.39 53.99 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.939 -0.573 . . . . 62.53 111.052 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.543 ' HD2' ' HA ' ' A' ' 78' ' ' GLU . 20.5 ptmt -51.2 -21.31 1.96 Allowed 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.364 0.876 . . . . 75.5 113.364 -178.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -76.25 -46.67 27.03 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.801 0.334 . . . . 75.21 111.476 -178.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 29.2 m -89.19 -12.58 9.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.263 -0.426 . . . . 74.24 111.221 -175.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.558 HD12 ' HG3' ' A' ' 67' ' ' ARG . 80.3 mt . . . . . 0 C--N 1.319 -0.734 0 CA-C-N 116.076 -0.511 . . . . 71.14 109.622 178.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 34.9 p90 . . . . . 0 CA--C 1.524 -0.054 0 N-CA-C 111.791 0.293 . . . . 72.3 111.791 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -64.25 -58.64 5.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.524 -0.307 . . . . 73.45 111.178 -177.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 133' ' ' ILE . . . . . 0.738 HG23 ' HB3' ' A' ' 79' ' ' LEU . 27.3 mm -61.05 -38.95 80.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-O 121.194 0.521 . . . . 74.22 110.828 -176.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.603 ' HA ' ' HD2' ' B' ' 139' ' ' PHE . 51.6 mt -65.4 -33.28 75.59 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.67 -0.695 . . . . 73.24 111.235 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 42.2 ttt-85 -65.36 -48.23 73.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.146 0.498 . . . . 74.25 110.154 175.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -61.2 -42.03 97.87 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.149 -0.932 . . . . 72.14 111.616 -177.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -86.46 0.12 54.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.304 -0.407 . . . . 65.51 110.997 -179.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 15.6 t70 56.66 62.79 2.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.298 -0.864 . . . . 74.54 112.016 177.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 139' ' ' PHE . . . . . 0.603 ' HD2' ' HA ' ' B' ' 134' ' ' LEU . 75.3 m-85 -91.3 -4.5 55.82 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.06 -0.518 . . . . 73.42 110.394 169.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 60.1 84.67 0.2 Allowed Pre-proline 0 CA--C 1.529 0.157 0 CA-C-N 115.316 -0.857 . . . . 65.22 110.859 -176.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . 0.658 ' HB3' HD11 ' A' ' 49' ' ' LEU . 17.6 Cg_exo -67.03 161.96 40.33 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 123.179 2.586 . . . . 72.21 112.092 177.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 142' ' ' LYS . . . . . 0.413 ' CB ' ' H ' ' A' ' 50' ' ' ALA . 23.4 tptt . . . . . 0 C--N 1.329 -0.311 0 C-N-CA 120.819 -0.352 . . . . 74.54 110.133 179.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.512 -0.511 0 N-CA-C 109.374 -0.602 . . . . 74.51 109.374 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 1.008 HD22 HD13 ' A' ' 34' ' ' LEU . 66.4 tp -77.32 92.57 3.92 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.519 -0.764 . . . . 71.44 110.811 -174.631 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.54 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -95.01 85.75 4.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.677 -0.692 . . . . 74.11 109.788 175.062 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 151' ' ' PHE . . . . . 0.588 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 45.4 p90 -102.54 171.95 7.14 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.876 -0.602 . . . . 75.31 110.349 -177.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -103.2 119.56 39.09 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.103 0.478 . . . . 75.14 110.625 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 153' ' ' CYS . . . . . 0.432 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 23.0 t -113.15 101.22 9.23 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.802 -0.636 . . . . 72.33 109.618 177.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 65.69 14.69 9.67 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.605 -0.725 . . . . 62.35 112.115 176.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 128.89 -32.82 3.21 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.103 -1.046 . . . . 70.01 112.84 177.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -100.2 142.13 32.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.145 0.498 . . . . 71.45 110.918 -177.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . 0.431 ' HA ' ' O ' ' B' ' 151' ' ' PHE . 49.1 mm -80.3 124.96 38.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.809 -0.632 . . . . 74.22 110.278 178.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 158' ' ' LYS . . . . . 0.436 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 26.7 mmmt -114.34 132.47 56.18 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.888 -0.412 . . . . 71.15 109.888 179.155 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.4 109.93 21.85 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.902 0.382 . . . . 74.44 111.667 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 160' ' ' PHE . . . . . 0.436 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 33.9 m-85 -119.8 128.99 54.22 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.047 -0.524 . . . . 73.34 110.438 177.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 2.9 p -100.85 -16.56 17.21 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.125 -0.489 . . . . 73.1 111.764 -178.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -139.37 164.44 29.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.924 0.392 . . . . 74.02 110.786 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . 0.45 ' O ' HD13 ' B' ' 163' ' ' LEU . 3.0 tm? -86.45 -25.29 25.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.763 -0.653 . . . . 73.42 110.251 -176.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 51.3 tt0 -60.85 -46.76 89.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.011 0.434 . . . . 72.14 110.86 -177.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 14.2 m -68.63 -34.43 75.73 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.845 -0.616 . . . . 74.22 110.373 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 42.8 tp -71.45 -26.95 62.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.915 -0.584 . . . . 72.21 110.615 -178.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -56.2 -43.35 78.41 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.664 -0.244 . . . . 70.33 110.681 177.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 28.0 mtmt -67.36 -43.15 82.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.033 0.444 . . . . 74.54 110.234 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 169' ' ' PHE . . . . . 0.562 ' O ' ' HG2' ' B' ' 173' ' ' LYS . 70.8 t80 -64.16 -45.9 86.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.516 -0.765 . . . . 73.3 110.54 -177.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -71.63 -28.62 63.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.101 -0.5 . . . . 72.51 111.286 -178.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 22.9 t -67.89 -32.89 73.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.622 -0.263 . . . . 63.24 111.127 -177.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -84.45 -16.04 43.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.872 0.368 . . . . 70.1 110.403 178.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 173' ' ' LYS . . . . . 0.562 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 31.6 mmmt -83.22 145.72 28.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.151 -0.477 . . . . 75.3 110.129 178.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 12.7 m -83.67 -44.79 14.14 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.284 0.564 . . . . 73.12 109.557 176.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 3.2 m -72.54 -40.29 66.86 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.52 -0.764 . . . . 63.23 111.504 -177.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 176' ' ' MET . . . . . 0.42 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 81.6 mtp -85.2 -17.85 35.86 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.391 0.515 . . . . 75.25 112.391 -172.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 177' ' ' LYS . . . . . 0.541 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 88.0 tttt -63.93 -31.06 72.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.979 0.419 . . . . 75.3 110.795 -178.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . 0.846 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 51.7 mm-40 -90.08 -0.3 57.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.521 0.677 . . . . 74.22 110.419 -175.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 179' ' ' LEU . . . . . 0.52 ' HB3' HG21 ' A' ' 33' ' ' ILE . 52.8 mt -94.78 -49.71 5.47 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.024 -0.989 . . . . 64.04 109.806 -179.244 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 180' ' ' LEU . . . . . 0.597 ' O ' ' HG ' ' B' ' 184' ' ' LEU . 3.4 mm? -88.89 -14.93 35.64 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.531 -0.759 . . . . 73.2 111.858 -176.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 181' ' ' LYS . . . . . 0.846 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 20.4 ptmt -53.89 -23.96 14.46 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 111.959 0.355 . . . . 73.51 111.959 -178.113 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -65.66 -23.75 66.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.022 -0.535 . . . . 71.53 111.942 -174.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 19.3 m -124.88 3.34 4.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 112.201 0.445 . . . . 74.51 112.201 -178.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 184' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' B' ' 180' ' ' LEU . 81.9 mt . . . . . 0 C--N 1.326 -0.452 0 C-N-CA 121.21 -0.196 . . . . 74.33 110.874 -179.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 33.8 p90 . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.86 0.362 . . . . 73.04 110.601 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -61.03 -50.96 71.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.893 -0.594 . . . . 74.54 110.962 -175.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.48 HG21 ' HB3' ' B' ' 179' ' ' LEU . 28.4 mm -60.59 -39.98 83.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.905 -0.589 . . . . 74.54 111.411 -178.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.462 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 86.4 mt -68.29 -22.49 64.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.863 -0.608 . . . . 71.51 110.982 -176.574 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 46.4 ttt-85 -73.32 -42.6 62.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.09 -0.505 . . . . 73.44 109.914 175.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -72.05 -23.43 61.37 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.925 -0.579 . . . . 64.24 111.04 -177.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -103.89 6.17 36.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.382 -0.372 . . . . 74.14 110.731 179.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 52.06 62.27 2.79 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.387 -0.824 . . . . 71.24 112.816 176.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.465 ' HB3' ' HB2' ' B' ' 151' ' ' PHE . 12.4 m-85 -94.36 -4.8 47.86 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.74 -0.664 . . . . 72.31 109.794 173.251 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 58.82 74.69 0.58 Allowed Pre-proline 0 C--O 1.232 0.183 0 CA-C-N 115.25 -0.886 . . . . 74.11 110.195 -174.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -78.58 142.42 18.29 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 123.006 2.471 . . . . 74.24 112.334 -176.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.643 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 1.4 mptm? . . . . . 0 C--N 1.322 -0.609 0 CA-C-N 116.072 -0.513 . . . . 75.34 110.061 177.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.563 ' HD3' HG21 ' A' ' 59' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.45 -0.436 0 N-CA-C 109.225 -0.657 . . . . 71.1 109.225 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.682 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 11.2 mp -70.43 86.57 0.62 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.469 -0.332 . . . . 70.05 110.491 -178.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.575 ' HA ' ' O ' ' A' ' 58' ' ' LYS . . . -84.98 63.08 7.9 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.629 -0.714 . . . . 61.04 110.047 175.459 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.682 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 51.8 p90 -95.33 171.57 8.63 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.485 -0.78 . . . . 74.03 110.077 -177.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -102.51 133.56 47.27 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.324 -0.398 . . . . 74.52 111.25 -178.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 42.3 t -135.8 114.69 12.11 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.695 -0.684 . . . . 74.5 109.453 175.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 70.34 13.95 7.52 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.143 0.577 . . . . 74.11 111.308 177.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 110.21 -32.32 6.76 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.682 -0.77 . . . . 74.4 112.186 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -89.01 156.1 19.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.006 0.432 . . . . 62.33 110.271 -179.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.1 mm -91.94 124.54 44.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 116.007 -0.542 . . . . 75.55 110.425 -179.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.575 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 27.4 mmmt -100.82 155.2 18.06 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.872 -0.788 . . . . 73.44 108.872 177.413 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.563 HG21 ' HD3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -133.45 102.18 5.43 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.177 0.513 . . . . 73.53 111.426 177.088 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.533 ' CD2' HD11 ' A' ' 66' ' ' LEU . 84.6 m-85 -108.35 119.83 40.63 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.804 -0.634 . . . . 74.45 110.448 177.327 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 32.6 t -97.06 -13.57 22.15 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.761 -0.654 . . . . 63.32 110.005 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -130.21 154.54 47.45 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.715 -0.675 . . . . 71.1 110.296 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.4 tt -83.23 -24.36 32.37 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.409 -0.589 . . . . 73.43 109.409 -178.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -54.18 -52.72 60.29 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.443 -0.798 . . . . 64.23 111.013 -178.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.8 m -69.75 -44.13 70.84 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.96 -0.564 . . . . 75.23 111.346 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.533 HD11 ' CD2' ' A' ' 60' ' ' PHE . 54.6 tp -65.74 -35.87 81.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.429 -0.35 . . . . 63.32 111.379 -174.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.429 ' HE ' ' HB3' ' A' ' 67' ' ' ARG . 17.7 ttp180 -58.11 -41.85 84.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.957 0.408 . . . . 73.3 110.342 176.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -72.4 -32.0 66.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.967 -0.561 . . . . 73.24 110.688 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.437 ' HA ' HE21 ' A' ' 72' ' ' GLN . 31.6 t80 -65.31 -44.86 86.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.907 -0.588 . . . . 74.11 109.907 177.392 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.73 -24.57 61.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.192 -0.458 . . . . 72.32 111.399 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.735 ' HA ' ' HE2' ' A' ' 77' ' ' LYS . 70.4 m -73.42 -18.78 61.1 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.599 -0.273 . . . . 72.43 111.294 -179.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.437 HE21 ' HA ' ' A' ' 69' ' ' PHE . 29.7 pt20 -106.52 4.1 27.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.367 0.604 . . . . 75.2 110.194 176.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 56.3 mmtt -105.11 107.58 18.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.599 -0.728 . . . . 75.22 110.183 177.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.3 t -56.89 -33.0 66.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.976 0.417 . . . . 65.22 110.598 -178.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.8 p -80.87 -52.12 7.83 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.123 -0.49 . . . . 74.41 111.293 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.6 ' HA ' HD11 ' A' ' 79' ' ' LEU . 72.9 mtp -67.76 -12.77 61.25 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.843 0.354 . . . . 64.15 111.578 -177.331 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.735 ' HE2' ' HA ' ' A' ' 71' ' ' SER . 16.7 mmtt -61.83 -25.96 67.83 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.072 -0.513 . . . . 74.21 110.513 174.181 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.446 ' O ' ' HE2' ' A' ' 81' ' ' LYS . 3.6 mm-40 -94.95 -5.31 45.02 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.411 0.625 . . . . 74.31 110.131 -178.581 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.6 HD11 ' HA ' ' A' ' 76' ' ' MET . 8.5 mp -92.43 -56.84 2.89 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.265 -0.88 . . . . 74.43 110.094 178.1 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.808 ' HB3' HD13 ' A' ' 84' ' ' LEU . 3.7 mm? -83.22 -4.47 58.44 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.023 -0.535 . . . . 74.32 111.752 -174.133 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.538 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 64.9 pttt -56.46 -18.5 11.57 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.611 0.597 . . . . 74.41 112.611 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -76.25 -26.03 55.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.76 0.314 . . . . 74.25 111.55 -177.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 7.5 p -116.14 -28.51 2.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.84 0.352 . . . . 71.14 111.375 -177.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.808 HD13 ' HB3' ' A' ' 80' ' ' LEU . 8.8 mp . . . . . 0 C--N 1.328 -0.342 0 N-CA-C 109.76 -0.459 . . . . 64.13 109.76 177.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 45.5 p90 . . . . . 0 N--CA 1.454 -0.248 0 CA-C-O 120.967 0.413 . . . . 65.11 110.016 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 132' ' ' ASN . . . . . 0.531 ' O ' ' HB3' ' B' ' 135' ' ' ARG . 8.1 t30 -67.47 -35.43 79.17 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.115 -0.493 . . . . 72.42 110.137 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 133' ' ' ILE . . . . . 0.435 HG23 ' HB3' ' A' ' 79' ' ' LEU . 46.4 mm -64.32 -41.03 91.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.204 0.526 . . . . 75.45 110.231 175.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.405 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 91.4 mt -70.42 -22.06 62.76 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.926 -0.579 . . . . 73.04 110.363 177.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . 0.531 ' HB3' ' O ' ' B' ' 132' ' ' ASN . 22.6 ttt180 -68.71 -51.54 40.42 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.679 -0.489 . . . . 74.31 109.679 171.447 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 136' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 69.7 mm-40 -55.36 -48.74 73.8 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.248 -0.887 . . . . 75.54 111.508 -179.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -87.82 0.64 55.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.47 . . . . 72.45 111.174 -177.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 33.2 t70 52.14 63.46 2.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.643 0.735 . . . . 74.51 111.95 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 139' ' ' PHE . . . . . 0.405 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 4.0 m-85 -93.16 0.81 57.28 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.485 -0.779 . . . . 75.01 109.835 174.081 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 74.3 81.97 0.14 Allowed Pre-proline 0 N--CA 1.465 0.294 0 O-C-N 124.328 1.017 . . . . 73.54 110.679 -176.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -85.27 127.81 3.45 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 122.521 2.147 . . . . 74.2 112.904 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 115.885 -0.598 . . . . 75.31 110.017 174.914 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.513 -0.446 0 N-CA-C 108.543 -0.91 . . . . 74.45 108.543 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.636 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.8 mp -70.0 91.48 0.68 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.268 -0.424 . . . . 71.42 109.934 -178.376 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.643 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -93.02 61.05 3.39 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.656 -0.498 . . . . 71.53 109.656 175.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 151' ' ' PHE . . . . . 0.636 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 50.5 p90 -88.93 165.7 14.42 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.661 -0.699 . . . . 73.45 110.711 -176.481 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 152' ' ' LYS . . . . . 0.58 ' HE2' ' HA2' ' B' ' 155' ' ' GLY . 57.9 tttt -98.03 115.87 29.09 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.079 -0.51 . . . . 74.12 110.172 -178.082 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 153' ' ' CYS . . . . . . . . . . . . . 53.6 t -117.68 103.38 9.97 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.236 -0.438 . . . . 63.44 110.147 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 65.89 29.14 10.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.444 -0.798 . . . . 74.01 111.374 175.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 155' ' ' GLY . . . . . 0.58 ' HA2' ' HE2' ' B' ' 152' ' ' LYS . . . 108.5 -33.35 6.28 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.525 -0.845 . . . . 52.05 112.987 176.495 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 156' ' ' GLU . . . . . 0.556 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 10.1 pt-20 -99.6 140.3 34.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.911 0.386 . . . . 65.21 110.92 -178.363 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 50.9 mm -76.63 120.56 27.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.045 -0.525 . . . . 75.54 110.173 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 158' ' ' LYS . . . . . 0.556 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 29.9 mmmt -110.54 110.05 20.62 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.827 -0.435 . . . . 75.1 109.827 -177.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 159' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.5 OUTLIER -87.82 126.77 35.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.086 0.47 . . . . 73.41 111.954 -178.75 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -130.27 124.78 33.19 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.783 -0.644 . . . . 74.23 110.592 177.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 34.3 t -112.51 -5.94 14.0 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.789 -0.642 . . . . 65.32 109.899 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -137.8 163.37 31.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.031 -0.531 . . . . 65.14 109.997 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 91.5 mt -97.92 1.41 48.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.424 -0.353 . . . . 63.14 111.583 -176.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -82.47 -53.08 6.27 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.371 -0.604 . . . . 75.15 109.371 178.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 15.1 m -62.96 -38.89 92.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.74 -0.663 . . . . 71.12 110.039 176.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 53.2 tp -67.66 -35.85 79.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.621 -0.718 . . . . 71.55 110.951 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 54.4 ttp180 -61.09 -46.04 92.28 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.989 0.423 . . . . 75.14 109.944 178.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -63.38 -41.31 98.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.632 -0.713 . . . . 64.4 110.611 178.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 169' ' ' PHE . . . . . 0.716 ' HA ' HE21 ' B' ' 172' ' ' GLN . 51.7 t80 -65.32 -46.64 79.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.7 -0.682 . . . . 72.12 110.985 -178.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -66.23 -28.38 68.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.361 -0.381 . . . . 71.11 111.373 -178.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 40.2 m -75.28 -34.06 61.3 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.52 -0.309 . . . . 75.33 111.305 -178.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . 0.716 HE21 ' HA ' ' B' ' 169' ' ' PHE . 29.6 pt20 -81.97 -25.56 34.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.247 0.546 . . . . 74.12 110.229 178.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 58.0 mmtt -81.25 109.11 15.46 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.587 -0.733 . . . . 71.45 110.762 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 11.8 t -67.2 -24.36 65.84 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.074 -0.713 . . . . 72.11 109.074 176.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 4.8 m -82.68 -12.26 57.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.411 -0.813 . . . . 73.42 111.617 -179.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 176' ' ' MET . . . . . 0.42 ' O ' ' HB2' ' B' ' 179' ' ' LEU . 79.1 mtp -121.77 -10.05 8.77 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.924 0.392 . . . . 72.24 111.441 -179.203 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 177' ' ' LYS . . . . . 0.408 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 89.0 tttt -64.81 -34.99 79.65 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.083 -0.508 . . . . 72.41 111.056 -177.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -84.43 -6.67 59.4 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 122.001 0.905 . . . . 74.14 109.494 -176.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 179' ' ' LEU . . . . . 0.48 ' HB3' HG21 ' A' ' 33' ' ' ILE . 11.0 mp -90.33 -56.29 3.27 Favored 'General case' 0 N--CA 1.438 -1.06 0 CA-C-N 114.054 -1.43 . . . . 73.54 109.801 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.01 -10.64 56.78 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.782 -0.644 . . . . 72.54 112.242 -173.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 181' ' ' LYS . . . . . 0.419 ' HA ' ' HB2' ' B' ' 184' ' ' LEU . 64.0 pttt -64.8 -5.92 6.97 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.405 -0.518 . . . . 73.02 111.493 178.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -74.75 -30.99 61.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.201 -0.454 . . . . 74.42 110.434 175.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 10.7 p -104.58 -18.87 6.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 71.52 110.764 -178.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 184' ' ' LEU . . . . . 0.419 ' HB2' ' HA ' ' B' ' 181' ' ' LYS . 9.1 mp . . . . . 0 C--N 1.33 -0.258 0 N-CA-C 109.898 -0.408 . . . . 74.43 109.898 176.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.418 ' HB3' HD11 ' B' ' 149' ' ' LEU . 53.1 p90 . . . . . 0 CA--C 1.52 -0.189 0 CA-C-O 120.713 0.292 . . . . 74.42 110.99 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.545 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 8.7 t30 -62.96 -57.23 11.45 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.211 -0.449 . . . . 74.35 111.478 -172.348 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.587 HG23 ' HB3' ' B' ' 179' ' ' LEU . 4.2 mp -65.35 -37.2 79.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.142 0.496 . . . . 73.23 110.985 -176.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.0 mt -63.92 -32.37 73.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.978 -0.555 . . . . 72.13 110.527 178.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -77.08 -29.16 54.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.745 -0.661 . . . . 74.44 110.417 178.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.545 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 95.6 mt-10 -70.21 -47.98 59.08 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.073 -0.512 . . . . 74.55 110.952 177.567 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -92.13 6.09 47.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.067 -0.515 . . . . 70.43 111.536 -175.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 57.2 60.67 2.84 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 113.089 0.774 . . . . 72.32 113.089 177.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -86.32 -1.1 57.21 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.883 -0.784 . . . . 75.4 108.883 167.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 60.43 78.15 0.34 Allowed Pre-proline 0 C--O 1.235 0.291 0 CA-C-N 114.333 -1.303 . . . . 70.24 110.946 -179.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -79.14 161.77 26.14 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.639 2.226 . . . . 72.02 111.529 177.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.7 mptt . . . . . 0 C--N 1.322 -0.626 0 CA-C-O 121.146 0.498 . . . . 73.32 111.63 -179.174 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.515 ' H ' ' HD2' ' A' ' 48' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.505 -0.765 0 N-CA-C 108.947 -0.76 . . . . 72.03 108.947 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.714 HD12 ' HB3' ' B' ' 131' ' ' PHE . 9.6 tp -66.01 -33.25 75.37 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.973 -0.751 . . . . 75.32 108.973 175.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.575 ' HB3' ' HG2' ' B' ' 142' ' ' LYS . . . 43.09 43.43 3.76 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 124.484 1.115 . . . . 75.1 112.639 169.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 41.6 p90 -84.55 165.08 18.33 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.061 -0.518 . . . . 64.11 110.544 -176.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -101.17 115.26 30.08 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.048 -0.524 . . . . 74.22 110.561 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.599 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 42.5 t -108.37 102.3 11.42 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.782 -0.644 . . . . 73.4 109.844 178.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.4 t70 68.2 8.39 6.53 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.878 -0.601 . . . . 72.24 111.435 174.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 129.52 -32.06 3.28 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.476 -0.869 . . . . 75.14 112.654 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.746 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 11.6 pt-20 -92.71 141.65 28.23 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.783 0.325 . . . . 74.11 110.602 -178.644 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.4 mm -85.88 120.71 36.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.708 -0.478 . . . . 73.21 109.708 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.746 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 26.7 mmmt -108.4 119.22 38.88 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.032 0.444 . . . . 73.13 110.634 -177.567 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.4 p -95.5 108.58 20.82 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.34 0.591 . . . . 71.32 111.838 -179.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -129.71 145.98 51.5 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.4 -0.818 . . . . 74.34 109.616 176.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.6 m -131.24 14.51 5.11 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.031 0.443 . . . . 71.1 110.576 178.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -152.3 173.14 15.4 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.991 -0.55 . . . . 74.04 109.631 177.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.1 mt -90.53 -25.68 20.12 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.264 0.468 . . . . 74.14 112.264 -174.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 51.0 tp60 -73.23 -43.55 61.02 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.651 0.262 . . . . 71.24 110.786 -173.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.0 p -68.09 -40.85 82.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.231 -0.44 . . . . 74.43 110.672 179.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.467 HD22 ' O ' ' A' ' 66' ' ' LEU . 6.3 tt -67.35 -36.65 81.82 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.05 -0.523 . . . . 72.5 109.969 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.636 ' HG3' HD11 ' A' ' 84' ' ' LEU . 66.7 ttt180 -58.21 -34.51 70.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.953 -0.567 . . . . 75.42 110.618 -179.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -59.27 -51.81 68.35 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.909 -0.587 . . . . 74.44 110.59 175.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -70.8 -45.94 63.73 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.024 -0.989 . . . . 72.52 111.195 -174.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.59 -31.22 71.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.298 -0.41 . . . . 71.53 111.859 -178.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.7 t -72.79 -40.88 65.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.706 0.289 . . . . 65.32 110.933 -178.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -82.85 -12.77 57.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.012 0.434 . . . . 74.44 111.226 -176.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.599 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 31.0 mmmt -80.78 143.37 32.92 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.244 -0.434 . . . . 74.25 110.141 174.216 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 5.5 m -77.18 -46.43 23.38 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.085 0.469 . . . . 71.43 109.949 178.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 14.0 p -70.15 -50.23 42.59 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.756 -0.657 . . . . 74.33 111.413 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.531 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 68.2 mtp -66.36 -20.13 65.99 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.409 -0.359 . . . . 74.45 111.571 -175.77 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.618 ' HZ2' ' HB2' ' A' ' 77' ' ' LYS . 4.5 ttmp? -61.23 -31.76 71.55 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.017 0.437 . . . . 74.22 110.492 177.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -97.36 1.42 49.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.452 0.644 . . . . 73.31 110.585 -177.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.449 ' HB3' HG22 ' B' ' 133' ' ' ILE . 81.4 mt -98.12 -47.59 5.43 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.377 -0.828 . . . . 75.22 109.433 177.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.554 ' HB3' HD12 ' A' ' 84' ' ' LEU . 4.2 mm? -85.5 -8.57 58.27 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.492 -0.776 . . . . 74.41 111.463 -177.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -56.84 -20.63 23.82 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.868 0.366 . . . . 75.2 111.284 176.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -72.73 -45.54 58.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.192 -0.458 . . . . 74.11 111.46 -176.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 27.1 m -105.67 -22.6 4.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 112.494 0.553 . . . . 74.5 112.494 -174.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.636 HD11 ' HG3' ' A' ' 67' ' ' ARG . 94.2 mt . . . . . 0 C--N 1.324 -0.537 0 C-N-CA 120.753 -0.379 . . . . 70.32 110.107 -179.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 131' ' ' PHE . . . . . 0.714 ' HB3' HD12 ' A' ' 49' ' ' LEU . 53.8 p90 . . . . . 0 CA--C 1.52 -0.176 0 CA-C-O 120.743 0.306 . . . . 74.45 110.823 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 132' ' ' ASN . . . . . 0.4 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 7.5 t30 -62.79 -50.63 70.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.018 -0.537 . . . . 73.33 111.151 -173.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 133' ' ' ILE . . . . . 0.449 HG22 ' HB3' ' A' ' 79' ' ' LEU . 3.4 mp -68.39 -41.52 83.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.176 0.512 . . . . 74.42 110.456 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.405 HD13 HD23 ' A' ' 49' ' ' LEU . 88.8 mt -62.95 -29.22 70.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.739 -0.664 . . . . 75.23 111.172 -178.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -72.02 -40.11 68.7 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.197 -0.456 . . . . 75.32 110.692 179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 136' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 9.6 mm-40 -72.8 -32.09 65.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.13 -0.486 . . . . 74.33 110.79 -178.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -95.48 3.72 53.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.005 -0.543 . . . . 72.51 111.072 -179.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 53.19 58.14 5.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.435 -0.802 . . . . 74.41 112.8 177.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -89.31 -1.07 57.92 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.282 0.563 . . . . 63.02 109.604 170.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 63.58 84.05 0.19 Allowed Pre-proline 0 C--O 1.233 0.225 0 CA-C-N 114.508 -1.224 . . . . 74.43 111.534 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . 0.435 ' HB3' ' HB2' ' B' ' 131' ' ' PHE . 60.0 Cg_endo -75.19 132.83 15.6 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.463 2.109 . . . . 73.12 110.604 172.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 142' ' ' LYS . . . . . 0.575 ' HG2' ' HB3' ' A' ' 50' ' ' ALA . 0.2 OUTLIER . . . . . 0 C--N 1.324 -0.533 0 N-CA-C 112.605 0.595 . . . . 74.33 112.605 -173.205 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.489 0 N-CA-C 109.896 -0.409 . . . . 73.44 109.896 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.609 ' HB3' ' HD1' ' B' ' 151' ' ' PHE . 4.2 mm? -53.44 -46.15 69.74 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 123.48 0.488 . . . . 72.14 109.963 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . 48.14 36.35 6.48 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 124.118 0.886 . . . . 52.04 111.871 174.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 151' ' ' PHE . . . . . 0.609 ' HD1' ' HB3' ' B' ' 149' ' ' LEU . 42.3 p90 -82.59 169.68 16.02 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.099 -0.5 . . . . 75.0 109.952 -178.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 28.4 ttmt -106.39 125.34 50.87 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.214 -0.448 . . . . 65.34 110.581 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 153' ' ' CYS . . . . . . . . . . . . . 35.4 t -124.96 105.2 9.03 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.279 -0.637 . . . . 61.4 109.279 177.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 34.7 t70 67.19 28.6 8.09 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.529 0.68 . . . . 70.13 110.81 176.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 107.12 -35.76 4.83 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.552 -0.832 . . . . 73.22 112.877 175.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -92.87 145.26 24.52 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.047 0.451 . . . . 55.13 110.762 -177.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 50.0 mm -84.74 125.13 40.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.755 -0.657 . . . . 74.22 110.06 -179.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 158' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -106.17 110.77 23.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.141 0.496 . . . . 75.02 110.063 -178.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -98.34 107.49 19.97 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.924 -0.58 . . . . 72.11 112.119 -175.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -131.53 151.97 51.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.54 -0.755 . . . . 75.44 109.928 176.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 64.3 m -131.29 5.63 4.45 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.346 0.594 . . . . 64.45 109.89 173.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -125.4 145.13 50.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.541 -0.754 . . . . 73.32 109.894 -179.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.58 -35.11 70.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.098 0.475 . . . . 61.21 109.776 178.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 164' ' ' GLN . . . . . 0.455 ' O ' ' HG2' ' B' ' 168' ' ' LYS . 50.5 tp60 -66.72 -42.73 85.86 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.934 -0.575 . . . . 73.4 111.414 -176.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 10.3 p -69.6 -39.22 77.38 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.846 0.355 . . . . 64.13 110.925 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 54.0 tp -65.53 -36.24 83.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.964 0.412 . . . . 72.42 109.973 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . 0.423 ' HB3' ' O ' ' B' ' 164' ' ' GLN . 61.4 ttt180 -57.29 -39.84 76.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.711 -0.677 . . . . 74.4 110.57 174.176 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 168' ' ' LYS . . . . . 0.794 ' HZ1' ' HB3' ' B' ' 168' ' ' LYS . 2.8 mmmp? -60.39 -39.24 86.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.717 -0.674 . . . . 64.41 110.91 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -77.66 -45.02 26.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.081 -0.509 . . . . 73.35 110.799 -178.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 170' ' ' ALA . . . . . 0.746 ' HB1' HD12 ' B' ' 180' ' ' LEU . . . -59.19 -38.1 79.02 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.115 -0.493 . . . . 75.43 111.666 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 8.7 t -65.55 -31.68 72.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.092 -0.504 . . . . 75.22 111.157 -176.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -94.17 4.62 53.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.988 0.423 . . . . 71.44 110.718 -179.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -105.55 140.84 38.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.23 -0.441 . . . . 74.55 110.477 177.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.4 p -67.26 -54.92 16.47 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.994 -0.548 . . . . 71.22 111.166 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 175' ' ' SER . . . . . 0.431 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 25.0 p -76.55 -46.99 24.06 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.829 -0.623 . . . . 74.43 111.653 -174.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 69.8 mtp -66.49 -21.59 66.18 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.127 0.417 . . . . 74.23 112.127 -174.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 177' ' ' LYS . . . . . 0.473 ' HB2' ' HZ1' ' B' ' 177' ' ' LYS . 4.2 ttmp? -64.94 -29.26 70.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.21 0.528 . . . . 74.04 109.828 176.132 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . 0.465 ' CD ' ' HZ2' ' B' ' 181' ' ' LYS . 6.8 mm-40 -94.7 -13.77 25.45 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 115.578 -0.737 . . . . 72.3 110.084 -176.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 179' ' ' LEU . . . . . 0.587 ' HB3' HG23 ' A' ' 33' ' ' ILE . 81.6 mt -86.71 -47.94 8.7 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.389 -0.823 . . . . 63.33 109.823 178.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 180' ' ' LEU . . . . . 0.746 HD12 ' HB1' ' B' ' 170' ' ' ALA . 8.9 mt -89.81 -2.17 58.16 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.759 -0.655 . . . . 64.45 111.339 -173.212 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 181' ' ' LYS . . . . . 0.465 ' HZ2' ' CD ' ' B' ' 178' ' ' GLU . 64.1 pttt -64.92 -9.07 18.41 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.298 0.571 . . . . 74.42 110.518 173.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -61.71 -33.88 74.81 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.571 -0.741 . . . . 75.01 109.914 175.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 14.3 p -113.15 -29.4 2.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 115.845 -0.616 . . . . 71.14 110.99 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 184' ' ' LEU . . . . . . . . . . . . . 91.8 mt . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 116.431 -0.35 . . . . 75.03 110.975 -176.796 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 13.4 p90 . . . . . 0 C--O 1.233 0.186 0 CA-C-O 121.145 0.497 . . . . 72.2 110.292 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -65.38 -43.04 92.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.548 -0.751 . . . . 75.51 111.074 -176.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.833 HG21 ' HB3' ' B' ' 179' ' ' LEU . 38.5 mm -60.41 -40.27 83.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-O 121.478 0.656 . . . . 72.4 110.594 177.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.677 HD13 HD23 ' B' ' 149' ' ' LEU . 82.9 mt -69.23 -25.84 64.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.489 -0.778 . . . . 73.1 110.71 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 54.1 ttt180 -67.47 -47.49 69.95 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.117 -0.492 . . . . 74.13 110.085 175.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -64.11 -39.3 93.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.499 -0.773 . . . . 63.14 111.777 -177.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -97.43 8.37 44.74 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.348 -0.387 . . . . 74.04 111.036 -175.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 14.3 t70 53.32 64.38 1.87 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.213 -0.903 . . . . 70.4 111.949 177.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.65 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 16.8 m-85 -92.82 -6.24 49.29 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.307 -0.627 . . . . 73.3 109.307 167.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 69.43 88.43 0.1 Allowed Pre-proline 0 CA--C 1.53 0.182 0 CA-C-N 114.789 -1.096 . . . . 71.2 111.233 -178.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.432 ' HA ' HD13 ' B' ' 149' ' ' LEU . 16.8 Cg_exo -67.23 135.03 35.63 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.633 2.222 . . . . 71.42 110.505 174.119 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.633 ' H ' HD12 ' B' ' 149' ' ' LEU . 33.4 tptt . . . . . 0 C--N 1.329 -0.322 0 C-N-CA 120.284 -0.566 . . . . 73.12 111.565 -171.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.451 -0.396 0 N-CA-C 109.637 -0.505 . . . . 74.24 109.637 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.714 ' HB3' ' HD1' ' A' ' 51' ' ' PHE . 7.1 mp -57.74 -44.77 86.29 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.334 0.494 . . . . 75.51 112.334 -173.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.857 ' HB1' ' HD2' ' B' ' 142' ' ' LYS . . . 39.49 49.48 1.94 Allowed 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.806 0.691 . . . . 74.34 111.85 -179.422 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.714 ' HD1' ' HB3' ' A' ' 49' ' ' LEU . 48.4 p90 -88.48 167.92 13.05 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.889 -0.596 . . . . 74.42 110.415 -175.467 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.419 ' HE3' ' HB2' ' A' ' 52' ' ' LYS . 29.3 ttmt -99.68 115.0 28.46 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.223 0.535 . . . . 74.52 110.809 -178.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.555 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 34.9 t -110.47 95.23 5.44 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.668 -0.696 . . . . 74.34 110.018 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 69.08 12.45 8.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.998 -1.001 . . . . 54.02 112.3 176.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 138.78 -40.87 1.41 Allowed Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.523 -0.846 . . . . 73.41 112.675 176.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.464 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 9.8 pt-20 -96.42 150.91 20.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.106 0.479 . . . . 73.02 111.157 -175.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.6 mm -83.44 120.57 34.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.585 -0.734 . . . . 75.51 110.533 178.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.544 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 29.1 mmmt -106.25 106.92 17.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.02 -0.536 . . . . 73.15 110.124 -179.574 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -81.44 98.49 8.26 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.952 0.406 . . . . 74.14 111.256 178.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.544 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 41.3 m-85 -117.74 138.26 52.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.228 -0.442 . . . . 74.42 110.953 179.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 4.3 p -136.78 3.96 2.76 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.565 -0.743 . . . . 71.42 109.979 175.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.458 ' OD2' ' HB3' ' A' ' 64' ' ' GLN . 29.9 t70 -125.18 122.44 37.07 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.416 -0.811 . . . . 65.31 109.965 -178.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.1 tt -66.98 -42.82 84.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 72.43 110.032 -176.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.458 ' HB3' ' OD2' ' A' ' 62' ' ' ASP . 6.8 tt0 -51.77 -50.69 60.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.815 -0.629 . . . . 74.23 111.376 -179.719 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 10.5 m -69.21 -38.02 78.36 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.855 -0.611 . . . . 60.23 110.934 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.5 tp -68.79 -38.68 80.16 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.234 -0.439 . . . . 72.43 111.001 -178.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -57.28 -43.15 82.85 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.076 -0.511 . . . . 75.34 111.135 179.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -63.48 -40.43 97.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 72.42 110.429 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.484 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 81.3 t80 -67.55 -42.41 82.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.757 -0.656 . . . . 75.43 110.598 179.124 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.98 -32.52 73.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.998 -0.547 . . . . 72.34 111.293 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.4 m -71.61 -31.81 67.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.401 -0.363 . . . . 64.33 111.377 -179.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 20.6 pt20 -85.21 -9.5 57.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.229 0.538 . . . . 72.42 110.394 179.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.555 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 28.3 mmmt -93.42 111.24 22.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.713 -0.676 . . . . 75.33 109.651 174.46 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.6 m -55.55 -37.11 67.56 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.669 0.271 . . . . 74.31 111.137 -178.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.543 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 21.6 m -75.33 -42.92 53.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.569 -0.287 . . . . 72.53 111.325 -178.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.439 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 80.8 mtp -77.87 -24.16 48.6 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.659 0.266 . . . . 72.22 111.614 -174.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -60.13 -36.7 78.08 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.853 0.359 . . . . 73.41 111.31 -179.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.453 ' CD ' ' HZ3' ' A' ' 81' ' ' LYS . 9.5 mm-40 -84.42 -16.11 43.81 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.953 0.883 . . . . 72.31 109.473 -174.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 75' ' ' SER . 59.6 mt -81.1 -51.78 8.09 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 114.312 -1.313 . . . . 74.51 109.697 178.366 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.436 HD12 ' HA ' ' A' ' 80' ' ' LEU . 4.2 mm? -78.49 -30.45 47.24 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.374 -0.83 . . . . 72.2 112.638 -174.001 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.453 ' HZ3' ' CD ' ' A' ' 78' ' ' GLU . 59.6 pttt -64.53 -10.18 24.09 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 118.367 0.531 . . . . 72.04 112.003 -173.097 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -75.55 -39.66 57.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.912 0.387 . . . . 73.31 110.98 -177.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 27.7 m -114.59 -5.92 11.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.091 -0.504 . . . . 70.32 110.92 -178.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 67.9 tp . . . . . 0 C--N 1.321 -0.649 0 CA-C-N 115.777 -0.647 . . . . 75.34 109.841 -178.849 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 48.3 p90 . . . . . 0 N--CA 1.456 -0.164 0 N-CA-C 111.775 0.287 . . . . 73.12 111.775 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 132' ' ' ASN . . . . . 0.532 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 63.7 t30 -59.75 -50.25 74.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.096 0.474 . . . . 72.14 110.201 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 133' ' ' ILE . . . . . 0.531 ' CG2' ' HB3' ' A' ' 79' ' ' LEU . 46.8 mm -59.38 -48.19 87.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.679 -0.691 . . . . 73.24 110.966 -179.033 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 80.9 mt -57.86 -36.58 72.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.022 -0.535 . . . . 73.14 111.263 177.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 36.9 ttt180 -67.17 -44.21 80.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.231 -0.44 . . . . 75.4 110.532 179.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 136' ' ' GLU . . . . . 0.532 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 10.6 mm-40 -68.3 -39.67 81.98 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.923 -0.581 . . . . 74.42 111.562 -178.046 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 52.4 m-80 -90.0 5.16 47.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.996 0.427 . . . . 74.52 110.695 -179.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 11.8 t70 56.53 57.03 5.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.112 -0.949 . . . . 74.4 112.19 173.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -90.61 8.9 31.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.791 -0.64 . . . . 74.13 109.996 173.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 60.61 80.93 0.25 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 114.926 -1.034 . . . . 73.42 111.488 -176.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -71.15 156.12 60.02 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 121.732 1.622 . . . . 73.11 109.831 171.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 142' ' ' LYS . . . . . 0.857 ' HD2' ' HB1' ' A' ' 50' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.551 0 C-N-CA 120.239 -0.585 . . . . 70.23 111.739 -176.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.59 0 N-CA-C 108.14 -1.059 . . . . 74.21 108.14 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.677 HD23 HD13 ' A' ' 34' ' ' LEU . 63.0 tp -73.68 85.79 1.64 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.101 -0.5 . . . . 75.21 110.173 -176.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -90.71 86.51 6.37 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.366 -0.833 . . . . 73.22 110.485 178.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 151' ' ' PHE . . . . . 0.592 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 51.6 p90 -103.24 171.23 7.49 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.934 -0.575 . . . . 65.43 109.785 178.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -106.5 125.76 51.41 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.088 0.47 . . . . 73.31 111.009 -179.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 153' ' ' CYS . . . . . 0.42 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 48.6 t -122.09 104.29 9.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.74 -0.663 . . . . 72.23 109.746 176.647 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 65.38 26.48 12.0 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.809 -0.632 . . . . 65.13 111.504 176.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 114.94 -35.95 4.15 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.719 -0.753 . . . . 53.21 113.148 176.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -92.64 145.13 24.66 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.971 0.415 . . . . 73.4 110.909 -176.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.2 mm -83.0 131.31 34.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.893 -0.594 . . . . 75.42 109.669 175.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 158' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -117.05 100.7 7.92 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.319 -0.401 . . . . 74.44 110.468 -177.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.09 103.45 10.91 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.127 0.489 . . . . 44.31 111.318 178.313 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -116.6 113.87 23.31 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.962 -0.563 . . . . 74.31 110.84 177.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 14.5 m -103.79 -0.14 29.66 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.454 0.645 . . . . 74.31 109.753 174.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 162' ' ' ASP . . . . . 0.413 ' OD2' ' HB3' ' B' ' 164' ' ' GLN . 0.3 OUTLIER -133.65 141.78 47.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.3 -0.864 . . . . 73.14 110.612 -175.936 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 44.8 tp -71.6 -34.33 69.8 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.952 -0.567 . . . . 75.11 111.341 -177.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 164' ' ' GLN . . . . . 0.463 ' O ' ' HG3' ' B' ' 168' ' ' LYS . 6.4 tt0 -60.09 -49.19 78.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.071 0.462 . . . . 73.11 110.238 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 20.9 m -58.43 -42.5 87.43 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.559 -0.746 . . . . 63.42 111.21 178.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 67.4 tp -68.66 -40.34 80.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.451 -0.341 . . . . 74.41 110.756 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . 1.089 ' HG3' HD21 ' B' ' 184' ' ' LEU . 15.1 ttp180 -61.11 -44.64 97.03 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.357 -0.383 . . . . 74.14 110.38 -178.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 168' ' ' LYS . . . . . 0.463 ' HG3' ' O ' ' B' ' 164' ' ' GLN . 48.9 mtmt -60.32 -29.77 69.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.978 -0.555 . . . . 72.12 111.317 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -84.7 -50.19 7.84 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.337 -0.392 . . . . 61.41 110.762 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.53 -32.82 74.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.084 -0.507 . . . . 75.52 111.968 -176.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 17.6 t -69.6 -19.0 63.66 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.886 0.328 . . . . 75.02 111.886 -176.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -104.88 2.34 29.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.912 0.387 . . . . 74.42 110.485 177.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 173' ' ' LYS . . . . . 0.42 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 29.6 mmmt -103.04 111.48 23.84 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.767 -0.651 . . . . 73.4 110.056 179.003 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 69.5 m -55.41 -34.38 64.34 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.8 0.333 . . . . 75.12 111.775 -178.152 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 175' ' ' SER . . . . . 0.455 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 6.8 m -77.03 -46.49 23.56 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.899 0.38 . . . . 75.14 110.975 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 73.9 mtp -78.31 -21.97 48.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.588 -0.278 . . . . 75.51 111.471 -173.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 177' ' ' LYS . . . . . 0.483 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 79.2 tttt -58.65 -37.46 76.01 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.164 0.507 . . . . 74.1 110.393 178.283 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -85.36 -13.95 47.9 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.6 0.714 . . . . 72.12 109.916 -175.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 179' ' ' LEU . . . . . 0.833 ' HB3' HG21 ' A' ' 33' ' ' ILE . 59.3 mt -84.28 -50.03 8.23 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 114.674 -1.148 . . . . 75.14 110.351 -179.296 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -88.84 -20.09 25.08 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.594 0.59 . . . . 75.33 112.594 -173.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 181' ' ' LYS . . . . . 0.483 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 62.7 pttt -59.95 -18.41 45.09 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.2 0.445 . . . . 75.21 112.2 -174.287 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -55.76 -49.42 73.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.004 0.43 . . . . 64.33 110.879 -177.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 18.4 m -109.71 3.66 9.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.768 -0.651 . . . . 75.55 110.48 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 184' ' ' LEU . . . . . 1.089 HD21 ' HG3' ' B' ' 167' ' ' ARG . 46.1 tp . . . . . 0 N--CA 1.447 -0.614 0 CA-C-N 115.956 -0.565 . . . . 73.3 110.352 -175.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 44.3 p90 . . . . . 0 N--CA 1.474 0.735 0 N-CA-C 112.887 0.699 . . . . 73.45 112.887 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -61.72 -53.33 57.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 73.2 111.108 -174.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.496 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 48.9 mm -59.3 -43.65 90.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.924 -0.58 . . . . 74.24 110.832 -177.597 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 86.5 mt -63.26 -35.13 79.33 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.759 -0.655 . . . . 74.41 111.012 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.427 HH11 ' HD3' ' A' ' 35' ' ' ARG . 35.0 ttt180 -70.58 -46.6 63.17 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.92 0.391 . . . . 73.42 110.322 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -59.21 -46.4 88.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.903 -0.59 . . . . 74.24 111.308 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -86.89 1.34 52.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.983 -0.553 . . . . 73.15 111.227 -177.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.6 t70 60.64 71.26 0.57 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.33 -0.85 . . . . 74.0 112.455 175.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -96.41 -6.8 36.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.508 -0.769 . . . . 74.43 110.105 167.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 57.84 73.69 0.72 Allowed Pre-proline 0 CA--C 1.53 0.199 0 CA-C-N 115.263 -0.881 . . . . 75.55 110.582 -176.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -78.44 150.35 25.05 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 122.918 2.412 . . . . 74.45 112.629 -177.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.494 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 5.5 mptp? . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 115.859 -0.61 . . . . 74.12 109.681 177.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.483 ' HB3' ' OG ' ' A' ' 61' ' ' SER . 0.1 OUTLIER . . . . . 0 CA--C 1.51 -0.568 0 N-CA-C 110.092 -0.336 . . . . 74.22 110.092 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.556 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.0 mp -69.64 82.06 0.42 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.155 -0.475 . . . . 73.1 109.957 175.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -82.56 67.38 8.59 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.259 0.552 . . . . 74.31 110.365 178.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.556 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 49.2 p90 -97.85 164.51 12.35 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.883 -0.599 . . . . 75.14 110.672 -177.714 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.2 tppt? -88.41 123.97 33.49 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.636 -0.711 . . . . 73.34 110.57 -178.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 17.6 t -141.72 119.84 12.12 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.326 -0.397 . . . . 63.33 109.954 176.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 69.99 13.9 7.87 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.711 -0.677 . . . . 73.54 112.194 177.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 104.64 -18.53 43.95 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.33 -0.938 . . . . 63.35 112.351 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -110.37 153.04 25.5 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.86 0.362 . . . . 65.3 110.08 179.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 47.6 mm -81.31 115.48 23.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.739 -0.467 . . . . 73.04 109.739 177.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -101.19 103.17 14.19 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.403 -0.362 . . . . 73.45 110.223 -177.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.58 124.82 28.57 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.391 -0.368 . . . . 72.12 111.526 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.423 ' CE2' ' HA ' ' A' ' 66' ' ' LEU . 74.6 m-85 -124.38 104.04 8.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.144 0.497 . . . . 70.31 111.44 176.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.483 ' OG ' ' HB3' ' A' ' 48' ' ' LYS . 5.8 m -95.2 -2.81 48.92 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.389 -0.823 . . . . 73.14 109.407 173.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -130.86 136.94 49.1 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.225 -0.898 . . . . 72.34 110.783 -177.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.6 tp -81.95 -27.24 33.37 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.909 -0.587 . . . . 75.51 110.801 -177.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -65.91 -44.2 85.93 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.244 0.545 . . . . 75.32 110.112 -178.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 45.5 m -65.66 -41.16 92.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.665 -0.698 . . . . 73.01 110.567 175.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.423 ' HA ' ' CE2' ' A' ' 60' ' ' PHE . 45.8 tp -61.1 -46.8 89.14 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 70.43 111.05 -178.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 50.3 ttt-85 -55.31 -48.34 74.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.135 -0.484 . . . . 74.41 111.063 178.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.41 ' HB2' ' HZ1' ' A' ' 68' ' ' LYS . 9.9 mtmp? -70.52 -30.39 67.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.199 -0.455 . . . . 73.53 111.333 -177.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.491 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 81.7 t80 -70.22 -45.86 65.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.309 -0.405 . . . . 73.02 110.149 176.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.21 -30.48 71.62 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.095 0.474 . . . . 73.12 110.465 178.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.5 t -71.02 -29.61 65.58 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.721 -0.672 . . . . 73.31 111.226 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 9.7 pt20 -86.66 -9.48 55.9 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.215 0.531 . . . . 71.32 110.01 177.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.895 ' HE2' ' HA ' ' A' ' 73' ' ' LYS . 9.0 mmpt? -81.79 164.03 21.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.653 -0.703 . . . . 74.11 109.945 176.073 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.2 t -100.45 -42.82 6.44 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.239 -0.652 . . . . 71.23 109.239 173.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.482 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 15.1 p -73.16 -58.8 3.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.648 -0.706 . . . . 71.4 110.778 179.018 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.452 ' HA ' HD11 ' A' ' 79' ' ' LEU . 86.9 mtp -65.09 -17.2 64.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.68 -0.691 . . . . 75.13 111.746 -176.564 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.521 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 24.8 ttpp -59.02 -38.32 78.99 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.272 -0.422 . . . . 75.42 110.825 -178.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -106.8 5.05 28.2 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.164 0.507 . . . . 72.01 110.816 -178.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.766 ' HB3' HG22 ' B' ' 133' ' ' ILE . 31.2 mt -81.41 -54.0 5.83 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.819 -0.628 . . . . 72.23 110.301 176.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.53 -5.59 50.61 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.095 -0.502 . . . . 75.34 111.98 -174.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 62.7 pttt -65.93 -9.07 26.29 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.958 0.408 . . . . 75.35 111.19 -178.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -61.02 -37.53 82.89 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.774 -0.648 . . . . 75.13 110.406 176.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 14.8 p -115.54 -23.18 4.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.801 -0.636 . . . . 75.22 110.453 178.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' A' ' 81' ' ' LYS . 58.8 tp . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 115.975 -0.557 . . . . 75.13 110.315 -179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 39.0 p90 . . . . . 0 N--CA 1.478 0.928 0 N-CA-C 113.27 0.841 . . . . 74.35 113.27 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 132' ' ' ASN . . . . . 0.464 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 27.3 p-10 -58.55 -48.49 80.7 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.77 0.319 . . . . 74.51 111.431 -174.272 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 133' ' ' ILE . . . . . 0.766 HG22 ' HB3' ' A' ' 79' ' ' LEU . 43.0 mm -64.73 -41.21 91.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.101 0.477 . . . . 73.41 111.156 -177.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.432 HD22 HD21 ' A' ' 49' ' ' LEU . 9.8 mp -65.45 -35.87 82.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.737 -0.665 . . . . 75.44 110.613 179.535 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -69.92 -41.65 74.36 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.79 -0.641 . . . . 73.41 110.264 177.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 136' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 5.8 mm-40 -64.25 -42.2 96.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.964 -0.562 . . . . 75.44 111.456 178.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -94.17 7.43 45.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.328 -0.396 . . . . 73.15 111.672 -175.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 10.4 t70 60.97 43.32 11.69 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.794 -0.639 . . . . 74.21 112.233 172.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -74.05 -10.56 59.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.877 0.37 . . . . 73.22 110.66 172.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 58.09 78.26 0.37 Allowed Pre-proline 0 C--O 1.232 0.182 0 CA-C-N 115.325 -0.852 . . . . 71.12 110.313 -174.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . 0.407 ' HG3' ' HB3' ' B' ' 134' ' ' LEU . 10.9 Cg_endo -86.17 145.71 8.58 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 122.887 2.391 . . . . 55.22 112.418 -178.77 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? . . . . . 0 C--N 1.323 -0.555 0 CA-C-N 116.097 -0.502 . . . . 70.54 110.028 178.587 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.507 -0.707 0 N-CA-C 109.553 -0.536 . . . . 73.42 109.553 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.473 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.8 mp -68.42 75.76 0.26 Allowed 'General case' 0 C--O 1.219 -0.535 0 O-C-N 123.91 0.756 . . . . 72.22 109.558 174.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.494 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -81.98 59.25 4.26 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.202 0.525 . . . . 70.24 110.451 -179.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 151' ' ' PHE . . . . . 0.473 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 44.2 p90 -86.84 162.78 17.58 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.662 -0.699 . . . . 71.32 110.588 -177.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 152' ' ' LYS . . . . . 0.416 ' HD3' ' CD1' ' B' ' 157' ' ' ILE . 21.6 tptt -92.76 113.47 25.75 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.518 -0.765 . . . . 75.21 109.659 -177.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 153' ' ' CYS . . . . . 0.536 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 29.9 t -123.29 96.12 4.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.01 0.433 . . . . 62.43 110.44 -176.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 57.91 55.05 5.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.174 -0.921 . . . . 70.45 111.628 179.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 95.17 -35.85 4.08 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.596 -0.729 . . . . 73.14 113.054 172.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -107.31 141.13 39.13 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.22 0.533 . . . . 74.32 111.277 -175.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . 0.416 ' CD1' ' HD3' ' B' ' 152' ' ' LYS . 43.3 mm -76.01 119.51 24.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.522 -0.763 . . . . 74.41 109.525 174.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 158' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -106.28 97.79 7.55 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.909 -0.316 . . . . 75.44 110.386 -177.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 2.6 p -76.47 124.24 27.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.221 -0.445 . . . . 73.42 111.815 -177.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 86.9 m-85 -125.37 107.32 10.57 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.27 -0.423 . . . . 73.21 111.206 176.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 39.6 m -97.21 -0.67 46.39 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.748 -0.66 . . . . 75.21 109.448 172.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -129.56 131.84 46.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.198 -0.91 . . . . 75.01 109.797 -179.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 51.0 tp -76.49 -35.35 58.44 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.354 -0.385 . . . . 73.13 110.79 -175.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -62.27 -44.64 96.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.936 0.398 . . . . 72.24 110.491 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 165' ' ' SER . . . . . 0.644 ' HA ' ' HE2' ' B' ' 168' ' ' LYS . 32.0 m -61.55 -32.14 72.2 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.976 -0.557 . . . . 72.53 110.932 178.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 49.5 tp -68.09 -40.16 82.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 75.42 110.414 179.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . 0.547 ' HG3' HD23 ' B' ' 184' ' ' LEU . 24.2 ttt180 -57.22 -45.65 83.67 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.047 0.451 . . . . 74.41 110.543 175.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 168' ' ' LYS . . . . . 0.644 ' HE2' ' HA ' ' B' ' 165' ' ' SER . 52.0 mtmt -63.34 -36.46 83.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.519 -0.764 . . . . 73.43 111.195 -179.086 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -71.26 -44.95 64.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.092 -0.504 . . . . 74.5 110.736 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.08 -28.65 69.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.212 -0.449 . . . . 72.51 110.972 -179.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 33.2 t -66.29 -30.92 71.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.96 -0.564 . . . . 64.31 111.29 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -100.53 10.93 40.52 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.098 0.475 . . . . 74.21 110.695 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 173' ' ' LYS . . . . . 0.536 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 30.7 mmmt -108.05 117.88 35.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.939 -0.573 . . . . 75.25 110.738 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 39.8 t -64.27 -37.13 86.38 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.956 -0.565 . . . . 73.03 110.456 -178.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 16.9 p -78.25 -35.75 47.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.748 -0.66 . . . . 75.13 111.778 -177.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 76.9 mtp -90.7 -16.64 28.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.317 -0.401 . . . . 74.23 111.824 -172.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -56.68 -37.73 71.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.495 -0.321 . . . . 72.44 111.558 -177.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -96.73 0.15 49.13 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.305 0.574 . . . . 74.53 110.529 -174.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 179' ' ' LEU . . . . . 0.496 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 59.6 mt -88.72 -51.97 5.38 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.245 -0.889 . . . . 64.34 109.408 176.076 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.0 -19.64 59.99 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.368 -0.833 . . . . 74.22 111.797 -176.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -60.34 -15.08 22.25 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.057 0.391 . . . . 63.22 112.057 -177.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -75.05 -32.54 61.56 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.086 0.47 . . . . 70.04 110.659 -173.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 27.0 m -117.05 -15.39 9.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.811 -0.631 . . . . 71.45 110.997 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 184' ' ' LEU . . . . . 0.547 HD23 ' HG3' ' B' ' 167' ' ' ARG . 42.5 tp . . . . . 0 C--N 1.325 -0.467 0 CA-C-N 116.024 -0.534 . . . . 71.15 109.969 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.447 ' HB2' ' HB2' ' A' ' 41' ' ' PRO . 14.0 p90 . . . . . 0 N--CA 1.456 -0.17 0 CA-C-O 120.491 0.186 . . . . 74.35 110.991 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.409 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 12.1 t30 -61.58 -53.68 53.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.454 -0.339 . . . . 73.42 111.114 -173.387 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.428 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 3.6 mp -62.77 -39.73 85.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.134 0.493 . . . . 72.4 110.378 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.483 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 88.8 mt -62.49 -34.79 77.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.014 -0.539 . . . . 73.51 110.736 178.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -69.88 -38.67 76.46 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.141 -0.481 . . . . 75.1 110.441 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 34.1 mm-40 -65.93 -31.3 72.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.052 -0.522 . . . . 73.13 111.08 178.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -100.39 4.35 43.82 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.13 -0.486 . . . . 74.44 111.281 -177.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.5 t0 67.69 47.09 1.21 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.617 -0.719 . . . . 74.02 112.054 171.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.483 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 28.7 m-85 -81.21 -7.63 59.6 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.525 -0.307 . . . . 73.0 111.608 173.215 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.93 69.53 1.35 Allowed Pre-proline 0 CA--C 1.538 0.515 0 CA-C-O 121.321 0.581 . . . . 71.14 110.076 -175.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.577 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 87.2 Cg_endo -89.07 175.75 3.38 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 123.017 2.478 . . . . 75.55 112.637 -177.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.41 ' HD2' ' C ' ' A' ' 41' ' ' PRO . 12.7 mptt . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 116.276 -0.42 . . . . 75.1 111.125 -178.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.479 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.727 0.298 . . . . 74.53 111.022 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.646 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.9 mp -73.67 92.18 1.95 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.904 -0.589 . . . . 72.02 110.889 -177.859 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -94.11 68.18 3.7 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.272 -0.64 . . . . 73.2 109.272 171.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.646 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 44.9 p90 -91.68 165.12 13.47 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.994 -0.548 . . . . 75.41 111.132 -173.288 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.2 tptm -92.24 116.61 29.11 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.568 -0.742 . . . . 65.5 110.338 -176.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.509 ' HB3' ' HG2' ' A' ' 58' ' ' LYS . 47.3 t -120.06 100.49 7.24 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.993 0.425 . . . . 65.31 110.362 178.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 64.41 15.9 9.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.265 -0.88 . . . . 64.22 112.317 174.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.63 -32.26 3.92 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.297 -0.954 . . . . 74.14 112.638 177.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -100.66 153.74 19.17 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 110.117 -0.327 . . . . 75.53 110.117 -179.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 48.1 mm -83.9 116.48 27.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.401 -0.363 . . . . 72.33 110.166 177.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.722 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 31.8 mmmt -101.01 115.9 31.56 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.381 -0.6 . . . . 73.23 109.381 177.006 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.504 ' HA ' ' O ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -97.8 112.06 24.11 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.864 -0.607 . . . . 73.11 111.16 -174.716 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.722 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 23.8 m-85 -121.6 140.72 51.89 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.839 -0.619 . . . . 64.22 111.228 -178.239 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.479 ' HB3' ' HB3' ' A' ' 48' ' ' LYS . 17.1 p -137.08 15.55 3.04 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.811 -0.631 . . . . 74.22 109.75 175.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.459 ' OD2' ' HB3' ' A' ' 64' ' ' GLN . 4.9 t70 -148.1 127.55 13.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.488 -0.778 . . . . 73.32 110.692 -177.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 56.1 tp -68.25 -29.61 68.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.915 -0.584 . . . . 74.45 111.144 -177.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.459 ' HB3' ' OD2' ' A' ' 62' ' ' ASP . 44.3 tt0 -62.1 -47.92 82.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.26 0.552 . . . . 70.32 109.674 178.339 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 42.6 m -58.03 -45.05 87.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.389 -0.823 . . . . 75.04 111.109 177.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 37.1 tp -68.71 -34.63 75.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.285 -0.416 . . . . 73.41 110.977 -177.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 46.4 ttp180 -61.96 -31.91 72.29 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.143 0.497 . . . . 71.45 110.463 177.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.8 mtmp? -75.71 -42.62 50.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.988 -0.551 . . . . 74.32 110.343 176.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.446 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 63.7 t80 -65.98 -41.98 90.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.652 -0.703 . . . . 74.34 111.011 -176.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.38 -26.89 64.88 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.524 -0.307 . . . . 74.22 111.009 177.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.7 t -75.58 -28.6 59.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.915 0.388 . . . . 74.13 110.522 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.446 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 19.9 pt20 -87.69 -10.53 50.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.383 0.611 . . . . 72.3 109.847 176.059 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.445 ' O ' ' HE3' ' A' ' 77' ' ' LYS . 26.9 mmmt -94.03 163.33 13.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.334 -0.848 . . . . 72.2 109.431 173.016 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.1 t -105.42 -44.86 4.61 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.645 -0.502 . . . . 65.41 109.645 176.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.58 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 17.7 p -65.91 -53.35 40.57 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.969 -0.56 . . . . 70.51 110.891 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 81.3 mtp -64.87 -26.63 68.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.786 -0.643 . . . . 74.12 111.383 -177.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.445 ' HE3' ' O ' ' A' ' 73' ' ' LYS . 37.1 ttmt -61.12 -34.12 74.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.268 0.556 . . . . 74.01 110.47 178.468 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -102.88 8.08 39.25 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.631 0.729 . . . . 72.31 109.799 -176.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 75' ' ' SER . 45.6 mt -94.14 -52.87 4.19 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.063 -0.971 . . . . 75.03 108.912 172.041 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.467 ' HA ' HG13 ' B' ' 133' ' ' ILE . 9.1 mt -80.25 6.67 11.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.427 -0.806 . . . . 75.31 111.306 -173.319 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -54.36 -20.81 8.0 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.628 0.58 . . . . 74.45 112.481 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.558 ' HB3' HD11 ' B' ' 133' ' ' ILE . 27.6 t70 -67.69 -41.99 82.78 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.972 0.415 . . . . 72.4 110.365 175.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 35.6 t -91.33 -42.55 13.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.069 -0.514 . . . . 74.25 110.405 -178.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.1 mp . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 116.107 -0.497 . . . . 74.32 110.495 -179.247 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 26.0 p90 . . . . . 0 N--CA 1.463 0.191 0 N-CA-C 112.219 0.451 . . . . 74.52 112.219 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 132' ' ' ASN . . . . . 0.458 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 54.7 t30 -55.52 -60.14 3.84 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.142 0.276 . . . . 75.51 111.661 -171.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 133' ' ' ILE . . . . . 0.558 HD11 ' HB3' ' A' ' 82' ' ' ASP . 39.5 mm -59.52 -46.52 92.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.27 0.557 . . . . 75.42 111.482 -176.007 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.412 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 88.0 mt -58.22 -30.71 66.71 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.587 -0.733 . . . . 63.43 111.613 -179.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -77.73 -33.61 52.91 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.751 0.31 . . . . 71.52 110.599 -178.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 136' ' ' GLU . . . . . 0.465 ' OE1' ' HA ' ' B' ' 133' ' ' ILE . 33.5 mt-10 -64.72 -46.56 81.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.406 0.622 . . . . 71.22 110.296 177.609 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 39.3 m-80 -90.83 5.25 49.19 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.363 -0.835 . . . . 75.0 110.796 -175.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 31.5 t70 60.2 65.13 1.12 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.982 -1.008 . . . . 70.2 112.754 173.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 139' ' ' PHE . . . . . 0.412 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 9.7 m-85 -95.92 1.29 52.82 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.667 -0.697 . . . . 65.21 109.938 169.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 60.34 76.5 0.42 Allowed Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.647 -0.706 . . . . 73.13 110.796 -178.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -79.86 157.19 24.15 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.814 2.342 . . . . 75.21 112.087 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 11.8 mptt . . . . . 0 C--N 1.325 -0.481 0 CA-C-O 120.925 0.393 . . . . 75.21 111.766 -176.134 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.516 -0.344 0 CA-C-O 120.502 0.191 . . . . 65.02 110.504 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.563 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.9 mp -73.04 88.2 1.39 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.294 -0.412 . . . . 72.01 110.576 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -91.69 72.06 5.82 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.424 -0.584 . . . . 74.14 109.424 174.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 151' ' ' PHE . . . . . 0.577 ' HB3' ' HA ' ' A' ' 41' ' ' PRO . 50.3 p90 -102.09 166.08 10.8 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.04 -0.527 . . . . 74.32 110.584 -176.102 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.8 tppp? -94.69 124.36 38.68 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.014 -0.539 . . . . 73.23 110.212 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 153' ' ' CYS . . . . . 0.521 ' HB3' ' CG ' ' B' ' 158' ' ' LYS . 32.5 t -138.64 117.09 12.02 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.321 -0.399 . . . . 73.21 110.194 178.158 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 73.2 4.51 4.91 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.235 -0.893 . . . . 63.13 112.087 174.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 119.6 -19.46 9.75 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.439 -0.886 . . . . 55.13 112.822 178.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -114.51 156.1 25.22 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.984 -0.376 . . . . 75.41 109.984 177.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 46.4 mm -78.35 117.55 23.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 110.039 -0.356 . . . . 74.32 110.039 177.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 158' ' ' LYS . . . . . 0.687 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 29.0 mmmt -100.34 103.62 15.03 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.192 -0.67 . . . . 72.34 109.192 178.622 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 159' ' ' THR . . . . . 0.445 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.2 OUTLIER -89.51 113.39 24.77 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.048 -0.523 . . . . 75.53 111.165 -176.228 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 160' ' ' PHE . . . . . 0.687 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 34.3 m-85 -115.17 134.3 55.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.115 0.484 . . . . 75.22 110.989 -179.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 16.6 p -114.38 1.68 14.47 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.692 -0.686 . . . . 74.41 110.616 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 162' ' ' ASP . . . . . 0.563 ' HB2' ' CB ' ' B' ' 165' ' ' SER . 4.1 m-20 -134.65 150.17 50.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.891 -0.595 . . . . 74.01 110.077 -174.475 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 5.6 tt -79.12 -51.03 10.08 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.006 -0.739 . . . . 72.22 109.006 177.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 61.4 tt0 -60.82 -35.78 77.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.515 -0.766 . . . . 74.34 110.771 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 165' ' ' SER . . . . . 0.645 ' HA ' ' HE3' ' B' ' 168' ' ' LYS . 13.4 t -65.02 -36.27 83.85 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.732 -0.667 . . . . 72.55 110.624 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . 0.506 ' HA ' ' CE2' ' B' ' 160' ' ' PHE . 52.4 tp -71.25 -31.8 67.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.797 0.332 . . . . 72.51 110.408 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . 0.416 ' HG3' HD12 ' B' ' 184' ' ' LEU . 56.5 ttp180 -61.54 -36.12 79.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.964 -0.562 . . . . 75.52 110.124 177.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 168' ' ' LYS . . . . . 0.645 ' HE3' ' HA ' ' B' ' 165' ' ' SER . 9.8 mtmp? -59.63 -43.62 93.76 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.903 -0.59 . . . . 74.0 110.558 176.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 169' ' ' PHE . . . . . 0.459 ' O ' ' HG2' ' B' ' 172' ' ' GLN . 40.4 t80 -70.7 -40.76 72.69 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.453 -0.794 . . . . 65.23 110.007 -178.34 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 170' ' ' ALA . . . . . 0.476 ' HB3' HD11 ' B' ' 180' ' ' LEU . . . -61.88 -31.44 71.72 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.995 -0.548 . . . . 73.43 111.179 177.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 9.1 t -78.33 -28.95 47.42 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 121.062 -0.255 . . . . 72.44 111.233 -176.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . 0.459 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 21.0 pt20 -85.82 -5.94 59.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.468 0.651 . . . . 71.24 109.937 177.563 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 10.7 mmmm -118.41 98.09 6.09 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.232 -0.894 . . . . 74.52 110.101 -179.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 16.8 t -51.35 -34.85 35.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.083 0.468 . . . . 74.22 110.454 -179.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 175' ' ' SER . . . . . 0.568 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 3.9 m -62.06 -47.29 85.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.799 -0.637 . . . . 65.44 111.059 178.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 86.3 mtp -82.89 -21.65 34.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.929 -0.578 . . . . 71.11 111.224 -175.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 20.5 ttmm -66.57 -23.73 66.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.678 0.752 . . . . 75.34 109.296 175.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -100.15 4.28 44.36 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.947 -1.024 . . . . 72.34 109.655 -177.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 179' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' B' ' 175' ' ' SER . 57.7 mt -103.16 -49.96 3.61 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.293 -0.867 . . . . 75.03 109.325 175.525 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 180' ' ' LEU . . . . . 0.476 HD11 ' HB3' ' B' ' 170' ' ' ALA . 9.8 mt -86.91 5.74 35.45 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.821 -0.627 . . . . 74.13 110.477 -176.461 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -59.7 -11.84 5.85 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.474 -0.784 . . . . 73.23 111.673 178.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -63.54 -35.02 79.09 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.368 0.604 . . . . 73.15 109.683 175.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 23.9 t -102.76 -37.74 5.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.048 -0.978 . . . . 74.22 110.098 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 184' ' ' LEU . . . . . 0.416 HD12 ' HG3' ' B' ' 167' ' ' ARG . 10.7 mp . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 115.617 -0.72 . . . . 72.43 110.497 -178.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.429 ' HB3' HD22 ' B' ' 149' ' ' LEU . 32.4 p90 . . . . . 0 C--O 1.233 0.225 0 N-CA-C 111.895 0.332 . . . . 74.3 111.895 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.542 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 50.1 t30 -54.62 -54.91 35.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.052 0.453 . . . . 73.34 111.046 -176.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.735 HG22 ' HB3' ' B' ' 179' ' ' LEU . 36.1 mm -58.55 -38.47 70.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.678 -0.692 . . . . 75.12 111.489 -176.324 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.6 mt -62.66 -34.51 77.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.84 -0.618 . . . . 74.14 111.771 -177.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 74.8 ttt180 -81.02 -36.72 30.25 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.492 -0.483 . . . . 73.21 110.366 178.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 8.5 mm-40 -67.04 -31.4 71.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.76 0.314 . . . . 71.23 111.139 -178.486 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -98.33 -1.15 42.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.9 0.381 . . . . 65.11 111.003 178.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 19.5 t70 59.84 74.95 0.42 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.926 0.87 . . . . 73.04 111.749 176.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.466 ' HB3' ' HB2' ' B' ' 151' ' ' PHE . 3.7 m-85 -94.54 -4.21 48.42 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.986 -1.007 . . . . 72.21 109.865 169.002 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 59.39 74.7 0.56 Allowed Pre-proline 0 N--CA 1.463 0.22 0 O-C-N 124.178 0.924 . . . . 74.01 110.252 -174.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -80.32 -165.2 0.32 Allowed 'Trans proline' 0 N--CA 1.458 -0.599 0 C-N-CA 123.277 2.651 . . . . 74.41 112.221 -177.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.928 ' HD3' ' HB3' ' B' ' 150' ' ' ALA . 6.9 tptp . . . . . 0 C--N 1.327 -0.399 0 CA-C-N 116.134 -0.485 . . . . 73.13 110.327 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.51 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.399 0 CA-C-O 121.398 0.618 . . . . 72.21 109.802 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.517 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 9.3 mp -67.33 91.15 0.24 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.997 -1.001 . . . . 74.24 111.171 -176.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.843 ' HB3' ' HD3' ' B' ' 142' ' ' LYS . . . -90.38 96.72 10.79 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.911 -0.774 . . . . 73.41 108.911 170.281 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.677 ' HB3' ' HA ' ' B' ' 141' ' ' PRO . 49.5 p90 -129.93 170.01 14.49 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.71 -0.677 . . . . 71.41 110.34 -176.185 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.7 tppp? -85.08 131.22 34.48 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.257 -0.429 . . . . 73.4 110.65 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 39.4 t -146.89 119.31 8.42 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.646 -0.502 . . . . 62.43 109.646 174.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 31.4 t70 71.39 2.74 4.38 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.668 -0.696 . . . . 54.14 112.404 175.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 117.76 -20.06 11.04 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.415 -0.898 . . . . 74.42 112.15 -179.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -107.77 163.83 12.76 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.819 -0.437 . . . . 64.13 109.819 178.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.7 mm -93.03 125.41 45.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.734 -0.469 . . . . 74.34 109.734 177.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.562 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 30.6 mmmt -107.46 141.13 39.36 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.337 -0.392 . . . . 74.42 110.023 -179.295 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -112.63 115.67 28.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.0 0.428 . . . . 74.32 111.169 176.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -120.75 106.28 11.55 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.162 -0.472 . . . . 73.44 110.834 178.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.51 ' HB3' ' HB3' ' A' ' 48' ' ' LYS . 5.4 p -96.96 -2.42 43.67 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.102 -0.499 . . . . 53.31 110.944 178.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -131.14 138.69 49.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.033 -0.53 . . . . 72.3 110.775 179.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 46.4 tp -70.36 -31.03 68.13 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.282 -0.636 . . . . 74.34 109.282 175.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -56.94 -47.17 81.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.782 -0.644 . . . . 74.52 110.389 174.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.6 m -63.77 -43.18 97.15 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.928 -0.578 . . . . 74.23 110.952 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.44 HD12 ' HE2' ' A' ' 76' ' ' MET . 33.6 tp -72.94 -32.08 65.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.414 . . . . 72.24 110.862 -177.135 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 55.4 ttp180 -59.29 -44.45 92.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.055 -0.52 . . . . 75.1 110.19 178.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -62.79 -46.82 86.23 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.728 -0.669 . . . . 74.53 110.827 178.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.443 ' CE2' ' HE3' ' A' ' 73' ' ' LYS . 46.5 t80 -63.72 -45.42 90.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.249 -0.887 . . . . 73.05 110.883 -176.388 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.73 -24.98 64.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.134 -0.484 . . . . 73.32 112.018 -176.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.1 m -65.05 -38.11 89.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.813 0.34 . . . . 75.2 111.231 -179.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -92.27 0.11 57.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.09 0.472 . . . . 74.03 111.217 -178.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.484 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 66.4 mmtt -97.5 116.91 30.61 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.909 -0.587 . . . . 75.0 110.247 177.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.2 m -64.61 -35.0 79.59 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.093 0.473 . . . . 75.55 110.561 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 23.3 t -78.78 -34.05 45.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.689 -0.687 . . . . 64.03 110.916 -179.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.484 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 82.4 mtp -92.15 -12.47 32.77 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.652 0.263 . . . . 63.22 111.64 -175.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.574 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 40.4 tttp -52.27 -43.11 64.24 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.04 -0.527 . . . . 61.11 110.972 174.406 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.457 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 28.7 mm-40 -90.88 -2.53 57.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.485 0.66 . . . . 63.1 110.444 -172.037 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.524 ' HB2' HD23 ' A' ' 80' ' ' LEU . 36.1 mt -90.48 -53.7 4.32 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.162 -0.926 . . . . 73.14 109.872 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.524 HD23 ' HB2' ' A' ' 79' ' ' LEU . 3.0 mm? -94.93 3.45 54.95 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.768 -0.651 . . . . 75.22 111.515 -176.15 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.574 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 65.3 pttt -55.98 -16.41 4.81 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.274 0.472 . . . . 70.24 112.274 178.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -58.63 -30.56 67.38 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.935 0.398 . . . . 74.13 111.228 177.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 19.7 m -123.18 10.34 5.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.215 0.531 . . . . 75.35 111.01 178.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.41 ' HB2' ' HA ' ' A' ' 81' ' ' LYS . 3.1 mt . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 115.903 -0.59 . . . . 64.43 110.602 -177.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 43.4 p90 . . . . . 0 CA--C 1.535 0.386 0 N-CA-C 111.76 0.281 . . . . 74.22 111.76 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -54.92 -48.47 73.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.082 -0.508 . . . . 75.53 110.959 179.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 133' ' ' ILE . . . . . 0.499 HG23 ' HB3' ' A' ' 79' ' ' LEU . 43.2 mm -61.99 -42.54 95.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.339 0.59 . . . . 74.31 110.777 -179.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.51 HD11 HD22 ' A' ' 49' ' ' LEU . 98.9 mt -70.29 -26.31 63.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.613 -0.722 . . . . 74.42 111.784 -174.267 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -76.37 -35.18 58.81 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.336 -0.546 . . . . 75.13 109.875 176.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -63.83 -30.24 71.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.838 -0.619 . . . . 72.23 110.723 176.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -102.62 5.74 39.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.045 -0.525 . . . . 63.13 111.263 -179.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 57.41 51.3 10.05 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.708 -0.678 . . . . 73.43 112.317 174.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 139' ' ' PHE . . . . . 0.469 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 7.6 m-85 -82.72 -8.0 59.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.109 -0.496 . . . . 74.44 110.221 172.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 58.42 75.89 0.5 Allowed Pre-proline 0 N--CA 1.464 0.232 0 CA-C-N 115.487 -0.779 . . . . 71.2 110.785 -176.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . 0.677 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 78.1 Cg_endo -80.2 173.61 12.36 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.669 2.246 . . . . 75.25 112.491 -178.39 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 142' ' ' LYS . . . . . 0.843 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 11.5 tptp . . . . . 0 C--N 1.324 -0.539 0 CA-C-N 116.091 -0.504 . . . . 70.03 109.795 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . 0.744 ' HB3' ' HB3' ' B' ' 161' ' ' SER . 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.368 0 N-CA-C 108.911 -0.774 . . . . 74.05 108.911 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.59 ' O ' ' HA ' ' B' ' 159' ' ' THR . 1.5 mm? -60.72 107.92 0.77 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.316 -0.857 . . . . 73.44 111.298 -171.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.928 ' HB3' ' HD3' ' A' ' 42' ' ' LYS . . . -97.08 87.47 4.22 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.835 -0.802 . . . . 74.41 108.835 171.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 151' ' ' PHE . . . . . 0.507 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 45.4 p90 -119.85 167.05 12.5 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.704 -0.68 . . . . 71.53 110.593 -175.544 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -93.65 122.25 35.91 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.997 -0.547 . . . . 74.32 110.079 177.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 153' ' ' CYS . . . . . 0.429 ' HB2' ' HE1' ' B' ' 151' ' ' PHE . 20.8 t -137.13 121.61 18.31 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.067 -0.515 . . . . 75.32 110.097 177.686 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 20.9 t70 73.54 1.8 4.07 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.874 -0.603 . . . . 61.32 111.545 171.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 116.3 -11.59 16.79 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.782 -0.723 . . . . 72.12 112.495 -179.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 156' ' ' GLU . . . . . 0.824 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 10.4 pt-20 -117.31 145.32 44.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.838 0.351 . . . . 71.32 110.667 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 46.2 mm -77.28 127.03 38.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 109.361 -0.607 . . . . 73.12 109.361 175.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 158' ' ' LYS . . . . . 0.824 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 30.6 mmmt -120.57 126.94 51.59 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.005 -0.543 . . . . 73.21 110.279 -176.379 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 159' ' ' THR . . . . . 0.59 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.9 OUTLIER -103.01 115.42 30.57 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 123.249 0.343 . . . . 72.0 110.169 172.749 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 160' ' ' PHE . . . . . 0.404 ' CE2' ' HB3' ' B' ' 158' ' ' LYS . 59.9 m-85 -115.28 102.84 10.24 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.349 0.595 . . . . 63.14 111.758 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 161' ' ' SER . . . . . 0.744 ' HB3' ' HB3' ' B' ' 148' ' ' LYS . 34.1 p -108.12 12.35 26.83 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.174 -0.921 . . . . 65.43 108.714 168.717 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -132.0 108.12 9.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.766 -1.106 . . . . 72.53 110.243 -179.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 50.9 tp -66.25 -26.33 67.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.656 -0.702 . . . . 73.34 110.66 -178.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.09 -52.1 65.26 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.093 -0.503 . . . . 73.3 110.67 -179.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 30.9 m -72.32 -28.71 63.24 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.645 -0.252 . . . . 73.51 110.743 178.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 60.6 tp -64.98 -39.88 94.14 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.054 -0.351 . . . . 73.03 110.054 178.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . 0.537 ' HG3' ' HG ' ' B' ' 184' ' ' LEU . 29.1 ttp180 -61.73 -36.56 81.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.12 0.486 . . . . 74.53 110.3 177.747 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -66.08 -51.45 57.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.856 -0.611 . . . . 74.21 110.882 175.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -68.56 -46.06 70.45 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.787 -0.642 . . . . 75.33 111.651 -174.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -60.9 -37.43 82.19 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.147 0.425 . . . . 73.22 112.147 -176.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 171' ' ' SER . . . . . 0.456 ' HB3' HD22 ' B' ' 184' ' ' LEU . 22.8 p -73.02 -23.51 60.62 Favored 'General case' 0 C--N 1.323 -0.543 0 N-CA-C 112.054 0.391 . . . . 72.21 112.054 -174.649 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -95.89 -8.71 33.3 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.839 0.352 . . . . 75.21 111.138 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 173' ' ' LYS . . . . . 1.085 ' HE2' ' HA ' ' B' ' 173' ' ' LYS . 7.2 mmpt? -86.61 129.88 34.7 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 110.049 -0.352 . . . . 74.02 110.049 177.188 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 19.2 m -58.31 -43.17 88.01 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.841 0.353 . . . . 75.55 111.541 -176.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 175' ' ' SER . . . . . 0.581 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 47.1 t -77.21 -49.29 15.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.049 0.452 . . . . 74.44 110.143 -179.484 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 176' ' ' MET . . . . . 0.786 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 73.0 mtp -66.11 -23.94 66.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.757 -0.656 . . . . 72.21 111.789 -175.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 177' ' ' LYS . . . . . 0.642 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 28.5 tttp -59.26 -35.94 74.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 65.53 110.788 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -88.86 -21.38 23.71 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 121.519 0.676 . . . . 72.12 110.314 -176.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 179' ' ' LEU . . . . . 0.735 ' HB3' HG22 ' A' ' 33' ' ' ILE . 35.8 mt -75.88 -46.24 31.24 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.845 -1.07 . . . . 74.5 110.466 -178.093 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 180' ' ' LEU . . . . . 0.814 ' HB3' HD12 ' B' ' 184' ' ' LEU . 3.7 mm? -98.57 -3.35 36.5 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.532 -0.758 . . . . 75.51 112.027 -174.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 181' ' ' LYS . . . . . 0.642 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 64.9 pttt -56.12 -18.24 9.35 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.904 0.705 . . . . 75.44 112.904 -177.459 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -70.04 -38.62 75.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.002 0.43 . . . . 63.45 110.937 179.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 18.7 m -108.63 -9.01 11.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.996 -0.547 . . . . 75.14 111.605 -175.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 184' ' ' LEU . . . . . 0.814 HD12 ' HB3' ' B' ' 180' ' ' LEU . 8.6 mp . . . . . 0 C--N 1.325 -0.488 0 N-CA-C 110.221 -0.289 . . . . 73.33 110.221 177.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 35.3 p90 . . . . . 0 N--CA 1.478 0.925 0 N-CA-C 113.095 0.776 . . . . 74.12 113.095 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -65.11 -46.11 82.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.013 0.435 . . . . 74.21 110.437 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.407 HG22 ' O ' ' B' ' 179' ' ' LEU . 40.6 mm -58.97 -34.35 52.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.718 -0.674 . . . . 74.13 110.769 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.47 ' CD1' HD22 ' B' ' 149' ' ' LEU . 80.2 mt -72.14 -28.41 63.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.795 -0.639 . . . . 74.13 110.524 -178.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.99 -44.3 63.7 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.497 -0.557 . . . . 74.25 109.497 174.381 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -60.32 -45.95 91.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.558 -0.746 . . . . 74.33 111.355 -179.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -85.36 0.54 51.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.445 -0.343 . . . . 75.41 111.16 -178.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 21.4 t70 58.1 69.09 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.475 -0.784 . . . . 75.24 111.609 178.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.6 m-30 -101.63 -2.21 30.93 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.906 -0.588 . . . . 72.22 110.861 174.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.623 ' HG3' ' HE2' ' A' ' 42' ' ' LYS . 7.5 tp10 62.59 80.87 0.24 Allowed Pre-proline 0 N--CA 1.466 0.35 0 O-C-N 123.68 0.613 . . . . 75.15 110.624 -174.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -88.92 138.0 3.4 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.048 2.499 . . . . 72.42 113.352 -176.398 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.684 ' O ' ' HA ' ' B' ' 149' ' ' LEU . 5.6 mptp? . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 73.13 109.758 177.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.418 ' HD3' ' CG2' ' A' ' 59' ' ' THR . 0.2 OUTLIER . . . . . 0 CA--C 1.513 -0.463 0 N-CA-C 110.028 -0.36 . . . . 73.21 110.028 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.56 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.9 mp -71.52 82.41 0.81 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.001 0.429 . . . . 74.32 110.765 -178.55 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.09 58.19 4.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.792 -0.64 . . . . 75.14 109.343 173.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.56 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 52.3 p90 -89.24 169.42 11.46 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.674 -0.694 . . . . 72.41 110.723 -175.132 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.541 ' HE3' HD13 ' A' ' 57' ' ' ILE . 3.8 tppp? -100.95 124.27 46.4 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.86 -0.609 . . . . 72.44 111.035 -177.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.453 ' HB3' ' CG ' ' A' ' 58' ' ' LYS . 45.2 t -143.04 132.12 23.05 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.947 -0.57 . . . . 64.32 109.535 175.676 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 65.15 11.71 7.4 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.043 -0.526 . . . . 73.42 112.399 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 102.32 -6.35 53.13 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.74 -0.743 . . . . 61.13 112.734 177.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -123.72 159.05 30.25 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.841 0.353 . . . . 72.32 110.293 177.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.541 HD13 ' HE3' ' A' ' 52' ' ' LYS . 41.3 mm -78.43 123.97 36.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 109.787 -0.449 . . . . 75.14 109.787 176.406 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.453 ' CG ' ' HB3' ' A' ' 53' ' ' CYS . 27.7 mmmt -104.48 85.26 2.31 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.429 -0.582 . . . . 75.32 109.429 178.605 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.418 ' CG2' ' HD3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -74.07 112.08 9.86 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.021 -0.536 . . . . 73.51 111.525 -174.744 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -123.45 116.01 22.53 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.901 0.381 . . . . 74.42 110.992 178.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.5 m -91.1 -12.66 34.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.431 0.634 . . . . 63.44 109.451 172.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.45 ' OD2' ' HB3' ' A' ' 64' ' ' GLN . 33.4 t70 -115.6 118.87 34.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.34 -0.845 . . . . 72.42 109.923 -179.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -74.11 -25.61 59.88 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.018 0.437 . . . . 73.45 110.511 -176.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.455 ' O ' ' HB3' ' A' ' 67' ' ' ARG . 28.5 tt0 -63.23 -39.72 95.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.962 -0.563 . . . . 72.53 109.963 176.267 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.7 m -70.98 -29.05 64.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.641 -0.709 . . . . 75.11 110.77 177.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 69.4 tp -64.74 -38.75 92.06 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.768 -0.456 . . . . 74.02 109.768 175.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.455 ' HB3' ' O ' ' A' ' 64' ' ' GLN . 16.5 ttt-85 -56.34 -40.95 75.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.706 -0.679 . . . . 74.0 110.647 174.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 60.4 mmtt -60.94 -48.83 79.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.164 -0.471 . . . . 75.31 110.913 177.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.491 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 63.3 t80 -67.23 -46.65 73.18 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.673 -0.694 . . . . 75.34 111.194 -177.489 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.5 -29.76 70.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.338 -0.392 . . . . 73.53 111.818 -177.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.4 m -69.21 -25.82 64.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.518 -0.31 . . . . 74.11 111.608 -178.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 11.6 pt20 -99.37 -0.68 40.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.141 0.496 . . . . 74.24 110.524 -179.335 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.753 ' HE2' ' HA ' ' A' ' 73' ' ' LYS . 9.1 mmpt? -95.96 120.02 35.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.776 -0.647 . . . . 72.24 109.984 177.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.6 m -57.0 -42.96 81.25 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.933 0.396 . . . . 62.01 110.813 179.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.464 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 4.7 m -78.35 -42.61 30.03 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.034 -0.53 . . . . 74.41 111.212 -176.374 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.713 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 86.9 mtp -74.28 -19.9 60.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.401 -0.363 . . . . 75.12 111.339 -175.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.43 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 1.8 tmtm? -56.23 -41.91 76.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.181 -0.463 . . . . 74.05 110.024 177.329 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.44 ' CD ' ' HZ1' ' A' ' 81' ' ' LYS . 12.8 mm-40 -85.13 -20.72 29.86 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.621 0.724 . . . . 61.44 110.041 -174.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.691 ' HB3' HG22 ' B' ' 133' ' ' ILE . 83.6 mt -75.3 -53.04 9.44 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.734 -1.121 . . . . 73.03 110.235 179.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.489 ' HB3' HD13 ' A' ' 84' ' ' LEU . 4.1 mm? -82.62 -16.07 49.74 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.564 -0.744 . . . . 74.55 112.516 -173.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.44 ' HZ1' ' CD ' ' A' ' 78' ' ' GLU . 63.7 pttt -62.79 -14.69 48.31 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 120.755 0.312 . . . . 73.24 111.636 -178.102 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -68.51 -42.94 77.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.128 0.49 . . . . 65.42 110.37 179.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . 0.499 HG11 ' HG ' ' A' ' 84' ' ' LEU . 7.7 p -99.09 -37.1 5.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.94 -0.573 . . . . 74.01 111.102 -178.492 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.499 ' HG ' HG11 ' A' ' 83' ' ' VAL . 90.7 mt . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 116.473 -0.33 . . . . 75.42 110.946 -177.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 52.3 p90 . . . . . 0 C--O 1.233 0.215 0 CA-C-O 120.793 0.33 . . . . 72.31 110.533 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 132' ' ' ASN . . . . . 0.438 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 7.3 t30 -55.41 -55.08 35.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.761 -0.654 . . . . 73.3 111.226 -179.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 133' ' ' ILE . . . . . 0.691 HG22 ' HB3' ' A' ' 79' ' ' LEU . 49.0 mm -54.75 -46.89 74.42 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.155 -0.475 . . . . 74.42 111.201 -178.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.529 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 84.7 mt -62.82 -37.22 85.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.71 -0.677 . . . . 73.43 111.021 -177.503 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . 0.417 HH11 ' HG2' ' B' ' 136' ' ' GLU . 0.1 OUTLIER -65.61 -41.6 92.55 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.673 0.273 . . . . 75.33 110.53 177.944 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 136' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' B' ' 132' ' ' ASN . 16.6 mt-10 -69.75 -28.13 65.53 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.399 -0.364 . . . . 71.14 111.2 -176.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -101.48 8.13 42.17 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.157 0.503 . . . . 73.32 110.439 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 60.27 45.93 10.82 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.11 -0.95 . . . . 65.53 112.395 173.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 139' ' ' PHE . . . . . 0.529 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 8.1 m-85 -79.83 -8.92 59.56 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.12 -0.491 . . . . 74.25 109.926 172.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 140' ' ' GLU . . . . . 0.426 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 10.5 tp10 63.21 70.69 0.71 Allowed Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 115.306 -0.861 . . . . 74.1 110.679 179.386 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -87.93 151.11 7.15 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.792 2.328 . . . . 75.31 112.348 -179.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? . . . . . 0 C--N 1.323 -0.548 0 N-CA-C 109.562 -0.533 . . . . 72.33 109.562 179.354 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.508 -0.649 0 N-CA-C 110.041 -0.355 . . . . 74.42 110.041 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.684 ' HA ' ' O ' ' A' ' 42' ' ' LYS . 61.7 tp -71.81 79.32 0.87 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.672 -0.694 . . . . 65.2 109.488 176.682 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.576 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -83.81 74.93 10.14 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.941 -0.572 . . . . 73.41 110.997 -177.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 151' ' ' PHE . . . . . 0.584 ' CD1' ' HG ' ' B' ' 149' ' ' LEU . 15.0 p90 -107.09 161.63 14.58 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.986 -0.552 . . . . 73.23 110.229 179.131 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 152' ' ' LYS . . . . . 0.406 ' HE3' ' CD1' ' B' ' 157' ' ' ILE . 4.8 tppp? -90.94 117.36 29.48 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.413 -0.812 . . . . 73.23 110.325 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 153' ' ' CYS . . . . . 0.55 ' HB2' ' CE2' ' B' ' 151' ' ' PHE . 42.6 t -135.83 122.65 21.15 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.657 -0.701 . . . . 71.55 110.035 179.013 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.7 t70 73.64 4.27 4.7 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.757 -0.656 . . . . 72.01 111.182 172.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 109.12 -4.02 31.63 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.826 -0.702 . . . . 74.34 112.351 179.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -125.45 155.82 39.86 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 110.017 -0.364 . . . . 73.14 110.017 176.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . 0.406 ' CD1' ' HE3' ' B' ' 152' ' ' LYS . 44.5 mm -84.76 115.52 26.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 109.358 -0.608 . . . . 75.34 109.358 177.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 158' ' ' LYS . . . . . 0.483 ' HE2' ' CE1' ' B' ' 169' ' ' PHE . 31.9 mmmt -100.24 94.63 6.31 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.555 0.217 . . . . 74.13 111.025 -175.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 1.2 p -78.09 111.88 14.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.007 0.432 . . . . 72.03 111.941 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 160' ' ' PHE . . . . . 0.42 ' CD2' HD12 ' B' ' 166' ' ' LEU . 64.1 m-85 -121.16 126.66 50.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.899 -0.591 . . . . 72.12 110.623 175.3 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 54.1 m -99.92 9.86 42.26 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.025 0.44 . . . . 73.52 110.453 174.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -143.51 138.75 29.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.93 -0.577 . . . . 71.4 110.943 -175.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . 0.471 ' O ' HD11 ' B' ' 163' ' ' LEU . 2.0 tm? -81.35 -33.41 32.44 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.781 -0.452 . . . . 74.01 109.781 -176.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 164' ' ' GLN . . . . . 0.436 ' O ' ' HB3' ' B' ' 167' ' ' ARG . 22.1 tt0 -57.97 -47.33 83.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.823 -0.626 . . . . 75.15 110.838 179.516 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 165' ' ' SER . . . . . 0.475 ' O ' ' HB2' ' B' ' 168' ' ' LYS . 18.5 m -70.02 -31.73 69.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.933 -0.576 . . . . 74.42 111.193 179.426 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . 0.42 HD12 ' CD2' ' B' ' 160' ' ' PHE . 54.9 tp -67.53 -33.64 75.47 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.709 -0.478 . . . . 73.32 109.709 175.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . 0.436 ' HB3' ' O ' ' B' ' 164' ' ' GLN . 50.5 ttp180 -59.87 -36.76 77.58 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.693 -0.685 . . . . 75.53 109.879 173.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 168' ' ' LYS . . . . . 0.475 ' HB2' ' O ' ' B' ' 165' ' ' SER . 67.2 mmtt -63.76 -51.69 63.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.761 -0.654 . . . . 75.02 110.522 176.287 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 169' ' ' PHE . . . . . 0.483 ' CE1' ' HE2' ' B' ' 158' ' ' LYS . 41.0 t80 -59.47 -41.6 90.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.797 -0.638 . . . . 74.32 110.509 -178.14 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 170' ' ' ALA . . . . . 0.506 ' HB3' HD11 ' B' ' 180' ' ' LEU . . . -62.79 -42.56 99.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.214 -0.448 . . . . 74.11 111.591 178.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 49.3 m -67.22 -28.81 68.38 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.492 -0.322 . . . . 73.34 111.598 -176.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -95.51 9.57 39.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.091 0.472 . . . . 75.03 110.731 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 55.6 mmtt -118.21 156.68 28.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.84 -0.618 . . . . 74.23 110.757 179.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.2 p -87.13 -56.18 3.49 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.17 0.509 . . . . 72.03 109.681 172.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 175' ' ' SER . . . . . 0.525 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 3.4 m -55.95 -53.74 53.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.449 -0.796 . . . . 73.02 111.427 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 19.0 mtp -74.7 -20.04 60.01 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.041 -0.527 . . . . 73.55 112.163 -172.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -64.36 -36.38 83.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.09 0.472 . . . . 74.23 110.671 178.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -94.21 -11.52 30.15 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 115.792 -0.64 . . . . 73.43 109.905 -173.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 179' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' B' ' 175' ' ' SER . 62.8 mt -76.03 -51.4 12.4 Favored 'General case' 0 N--CA 1.437 -1.101 0 N-CA-C 108.971 -0.752 . . . . 74.21 108.971 174.575 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 180' ' ' LEU . . . . . 0.506 HD11 ' HB3' ' B' ' 170' ' ' ALA . 8.5 mt -92.42 -1.48 56.98 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.524 -0.762 . . . . 71.42 111.574 -171.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -60.18 -13.22 11.15 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.769 0.319 . . . . 70.55 111.729 178.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -70.21 -29.44 66.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.991 0.424 . . . . 53.4 110.782 178.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 28.5 m -114.66 -19.9 6.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.185 -0.461 . . . . 73.1 111.355 179.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 184' ' ' LEU . . . . . . . . . . . . . 83.5 mt . . . . . 0 C--N 1.325 -0.489 0 N-CA-C 109.877 -0.416 . . . . 74.1 109.877 178.398 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.594 0 N-CA-C 112.029 -0.428 . . . . 71.22 112.029 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.9 p -105.0 147.35 10.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 109.114 -0.699 . . . . 74.5 109.114 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.41 ' HB3' ' H ' ' A' ' 4' ' ' MET . 18.7 tp -143.58 -113.26 0.11 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.13 0.491 . . . . 75.13 111.658 -174.314 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.41 ' H ' ' HB3' ' A' ' 3' ' ' LEU . 69.9 mtp -144.36 101.05 3.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.615 -0.721 . . . . 71.21 110.168 -173.038 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -83.2 163.38 20.82 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 110.12 -0.326 . . . . 71.32 110.12 173.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -125.99 -177.98 4.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.402 -0.363 . . . . 54.11 110.362 177.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -88.52 -139.8 6.93 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.748 -0.739 . . . . 72.33 112.143 179.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -115.49 113.39 23.61 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.782 0.325 . . . . 74.44 110.571 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.6 p -108.84 136.85 43.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.076 0.465 . . . . 73.34 110.539 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.619 HD21 ' H ' ' A' ' 10' ' ' LEU . 2.5 pt? -115.84 176.08 5.25 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.939 -0.573 . . . . 74.52 109.68 179.547 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 15.2 t -115.72 176.84 4.9 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.783 0.325 . . . . 62.2 110.273 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 51.4 tp -113.85 142.54 45.97 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.286 -0.416 . . . . 73.22 110.017 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.596 ' HB2' ' HB3' ' A' ' 16' ' ' LEU . . . -69.88 117.95 12.11 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.43 -0.35 . . . . 65.54 110.589 176.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.476 ' HB2' ' HD2' ' B' ' 125' ' ' LYS . . . -69.55 94.11 0.74 Allowed 'General case' 0 C--N 1.321 -0.641 0 O-C-N 123.392 0.433 . . . . 72.21 111.213 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.419 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.0 OUTLIER 78.57 -16.48 0.66 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.834 -1.075 . . . . 74.33 111.668 172.251 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.596 ' HB3' ' HB2' ' A' ' 13' ' ' ALA . 6.9 tt -71.0 -43.0 68.87 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.274 -0.421 . . . . 71.22 110.062 178.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 34.8 t -101.25 -46.79 4.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.277 0.56 . . . . 72.03 109.974 179.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 69.4 m -146.36 149.11 33.14 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.971 -0.559 . . . . 74.44 109.549 176.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.35 124.4 21.17 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.949 0.404 . . . . 61.44 111.199 -177.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.451 ' OG1' ' HA ' ' A' ' 14' ' ' ALA . 35.0 m -92.86 115.02 27.73 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.061 -0.518 . . . . 72.31 109.79 179.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 8.2 tt -134.83 136.95 42.87 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.086 -0.506 . . . . 75.43 110.155 -174.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.51 ' O ' ' HE3' ' A' ' 48' ' ' LYS . 23.4 t70 -90.55 137.72 32.13 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.045 -0.525 . . . . 61.54 111.39 -177.099 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 6.0 tt -141.55 122.73 12.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.016 -0.538 . . . . 70.22 109.738 176.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.662 ' HA ' ' CD ' ' B' ' 146' ' ' GLU . 37.7 m -81.0 115.77 20.63 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.554 0.692 . . . . 74.45 112.355 -171.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.4 ' HD3' ' OE2' ' B' ' 146' ' ' GLU . 0.0 OUTLIER -123.92 5.19 8.7 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.946 -1.024 . . . . 75.44 109.496 173.242 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.41 ' HB2' ' OE2' ' B' ' 146' ' ' GLU . 0.0 OUTLIER -83.54 174.87 10.21 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 115.456 -0.793 . . . . 74.55 110.8 176.962 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.489 ' HB3' ' H ' ' A' ' 28' ' ' SER . 93.6 m95 -121.7 -151.62 0.48 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.037 -0.529 . . . . 75.23 111.848 -177.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.489 ' H ' ' HB3' ' A' ' 27' ' ' TRP . 9.5 m -66.53 -51.16 59.56 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 113.625 0.972 . . . . 72.13 113.625 -169.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -70.52 99.09 1.56 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.983 0.421 . . . . 72.42 110.792 -174.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.8 m -100.74 93.44 2.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.065 -0.516 . . . . 75.12 111.355 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.449 ' CD2' HD12 ' B' ' 149' ' ' LEU . 41.3 p90 44.82 28.92 0.39 Allowed 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.227 1.011 . . . . 75.43 113.518 175.285 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.502 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 54.0 t30 -59.53 -51.94 67.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.924 0.392 . . . . 73.24 111.334 -175.485 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.507 HG22 ' HB3' ' B' ' 179' ' ' LEU . 3.4 mp -61.1 -39.51 82.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.822 -0.627 . . . . 74.31 111.25 -175.036 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.3 mt -62.19 -35.44 78.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.808 0.337 . . . . 74.14 110.964 179.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 47.8 ttt180 -69.46 -44.01 72.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.219 -0.446 . . . . 65.34 110.454 177.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 36.9 mt-10 -66.02 -26.19 67.42 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.136 -0.484 . . . . 65.22 111.263 -178.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -100.01 1.06 42.14 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.275 -0.421 . . . . 74.55 111.079 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 62.29 45.61 6.61 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 113.044 0.757 . . . . 72.13 113.044 173.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.439 ' HB3' ' HB2' ' B' ' 151' ' ' PHE . 13.5 m-85 -78.16 -8.01 57.77 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.287 -0.635 . . . . 75.04 109.287 169.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 54.24 79.4 0.34 Allowed Pre-proline 0 C--O 1.233 0.211 0 CA-C-N 114.706 -1.134 . . . . 73.32 111.286 -173.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.44 ' HB3' HD11 ' B' ' 149' ' ' LEU . 7.7 Cg_exo -72.45 165.72 31.86 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.48 2.12 . . . . 74.44 110.771 175.082 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.918 ' HD2' ' HB2' ' B' ' 150' ' ' ALA . 0.1 OUTLIER -92.57 -162.18 0.91 Allowed 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.313 -0.555 . . . . 75.43 110.315 -179.511 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 42.9 t80 177.24 -30.71 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.808 0.814 . . . . 74.11 109.25 -171.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 48.6 tp -74.81 102.42 4.69 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.719 -1.128 . . . . 74.02 109.914 177.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.592 ' SG ' ' HA ' ' B' ' 147' ' ' VAL . 51.7 m -145.7 175.34 10.46 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.57 -0.741 . . . . 65.41 110.037 -179.055 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.567 ' OE2' ' HA ' ' B' ' 124' ' ' SER . 9.8 mm-40 -78.88 85.35 4.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.467 0.651 . . . . 63.2 110.299 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.826 HG13 ' HA ' ' B' ' 143' ' ' PHE . 24.7 t -78.04 154.38 5.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.515 -0.766 . . . . 75.13 110.714 -178.166 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.569 ' HA ' ' HA ' ' A' ' 61' ' ' SER . 0.3 OUTLIER -93.86 123.71 37.39 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 108.884 -0.784 . . . . 74.54 108.884 174.892 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.545 ' HB3' ' CD1' ' A' ' 51' ' ' PHE . 8.5 mp -74.2 88.9 1.99 Allowed 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 109.705 -0.479 . . . . 74.1 109.705 172.327 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.955 ' HB1' ' HD2' ' B' ' 142' ' ' LYS . . . -90.62 86.66 6.45 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.709 -0.678 . . . . 71.14 109.337 173.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.545 ' CD1' ' HB3' ' A' ' 49' ' ' LEU . 44.9 p90 -124.03 167.23 14.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.343 -0.844 . . . . 71.32 110.741 -173.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.7 tppt? -90.85 112.36 24.16 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.934 -0.575 . . . . 73.34 110.448 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.521 ' HB2' ' CE2' ' A' ' 51' ' ' PHE . 46.1 t -124.76 113.71 18.31 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.032 -0.531 . . . . 73.21 110.162 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 t70 64.7 24.49 12.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.736 -0.666 . . . . 74.2 111.487 173.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 105.94 -19.3 38.45 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.239 -0.982 . . . . 72.13 113.381 177.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.423 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 10.3 pt-20 -115.68 147.48 40.8 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 117.262 0.531 . . . . 72.32 111.127 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 43.6 mm -81.31 120.48 33.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.057 -0.52 . . . . 74.51 110.033 176.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.738 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 28.9 mmmt -101.78 148.9 24.74 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.992 -0.549 . . . . 75.03 109.537 179.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -121.29 109.23 14.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.97 0.414 . . . . 74.54 110.927 173.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.41 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 69.0 m-85 -117.16 101.53 8.54 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.122 0.487 . . . . 72.54 111.027 177.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.569 ' HA ' ' HA ' ' A' ' 48' ' ' LYS . 3.2 p -85.58 -12.99 50.2 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.448 -0.797 . . . . 75.1 110.241 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.662 ' OD2' ' HB3' ' A' ' 64' ' ' GLN . 33.6 t70 -127.68 113.38 15.96 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.349 -0.841 . . . . 72.33 109.396 177.312 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.91 -23.01 62.19 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.088 -0.505 . . . . 74.32 111.113 -175.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.662 ' HB3' ' OD2' ' A' ' 62' ' ' ASP . 0.7 OUTLIER -58.27 -50.25 74.25 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.814 -0.81 . . . . 74.44 108.814 172.172 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.1 m -64.74 -27.8 69.15 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.335 -0.848 . . . . 75.31 110.855 177.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 64.1 tp -69.05 -32.47 71.99 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.78 0.324 . . . . 74.32 110.63 177.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 62.9 ttt180 -61.55 -34.61 75.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.938 0.399 . . . . 75.42 110.177 175.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.58 ' HE2' ' OE1' ' A' ' 64' ' ' GLN . 62.8 mttm -68.63 -26.09 65.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.204 0.526 . . . . 74.12 110.607 178.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.446 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 78.1 t80 -85.83 -52.9 5.45 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.691 -0.686 . . . . 71.14 111.257 -177.233 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.418 ' HA ' ' HB2' ' A' ' 73' ' ' LYS . . . -68.04 -14.56 63.06 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.282 0.475 . . . . 70.41 112.282 -175.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.0 p -78.55 -32.04 47.67 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.758 0.313 . . . . 62.34 110.723 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.446 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 10.5 pt20 -91.65 -21.62 20.7 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.092 0.473 . . . . 65.32 109.945 177.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.418 ' HB2' ' HA ' ' A' ' 70' ' ' ALA . 29.6 mmmt -79.97 106.3 11.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.784 -0.644 . . . . 75.21 110.375 175.189 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.8 t -58.22 -37.74 75.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.964 0.411 . . . . 74.23 110.351 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.4 m -58.8 -52.41 65.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.105 -0.498 . . . . 73.32 111.141 178.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 84.1 mtp -80.5 -17.07 52.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.197 -0.456 . . . . 74.01 111.11 -175.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.628 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 25.1 ttmm -62.66 -24.6 67.7 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-N 116.279 -0.419 . . . . 75.15 110.152 175.188 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -92.48 -9.23 42.2 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.301 0.572 . . . . 73.5 110.132 -177.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.588 ' HB3' HG21 ' B' ' 133' ' ' ILE . 78.5 mt -95.62 -50.87 4.77 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.857 -1.065 . . . . 72.51 109.978 178.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.9 mt -90.71 -5.52 55.63 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.967 -0.56 . . . . 74.53 111.94 -172.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.628 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 64.5 pttt -58.34 -19.01 31.73 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.228 0.455 . . . . 75.21 112.228 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -76.89 -29.54 55.81 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.784 0.326 . . . . 73.3 110.865 -178.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.453 HG23 ' HG ' ' A' ' 84' ' ' LEU . 27.6 m -108.35 -27.21 3.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.403 -0.362 . . . . 62.31 111.716 -178.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.453 ' HG ' HG23 ' A' ' 83' ' ' VAL . 93.9 mt -104.16 141.62 22.91 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.658 -0.246 . . . . 74.51 110.418 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -63.32 112.68 1.8 Allowed 'Trans proline' 0 C--O 1.231 0.155 0 C-N-CA 122.67 2.247 . . . . 74.5 112.213 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -127.11 123.62 37.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.046 -0.524 . . . . 73.32 109.979 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.481 ' HB3' ' HZ3' ' A' ' 87' ' ' LYS . 8.7 mtpm? -97.03 -12.1 23.66 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.29 0.566 . . . . 64.43 110.254 178.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 . . . . . 0 C--N 1.321 -0.646 0 CA-C-N 115.371 -0.832 . . . . 70.45 110.674 -178.945 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.491 0 N-CA-C 111.839 -0.504 . . . . 63.31 111.839 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 7.7 p -118.49 110.67 31.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.63 0.729 . . . . 75.13 110.601 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 50.2 tp -159.94 142.49 13.49 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.425 -0.807 . . . . 73.41 110.16 178.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 80.8 mtp -90.89 93.69 9.33 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.667 -0.864 . . . . 70.43 108.667 174.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -100.22 141.04 33.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.716 -0.675 . . . . 73.34 111.668 -170.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -105.07 159.89 15.48 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.149 -0.932 . . . . 64.33 109.476 176.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -89.88 -142.0 9.12 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.494 -0.86 . . . . 63.24 112.733 -177.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -122.35 112.12 17.72 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.816 0.341 . . . . 72.43 111.143 -176.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 7.2 p -101.02 129.9 51.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.173 -0.467 . . . . 70.34 110.704 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -72.83 159.4 33.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.823 -0.626 . . . . 74.12 111.08 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 33.2 m -106.27 138.35 42.61 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.051 -0.522 . . . . 63.33 110.642 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 53.8 tp -89.89 136.94 32.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.367 -0.378 . . . . 73.14 110.362 178.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -90.63 124.59 35.18 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.025 -0.534 . . . . 71.42 110.809 178.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . 0.579 ' O ' ' HA ' ' B' ' 119' ' ' ALA . . . -78.53 -22.94 46.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.933 -0.576 . . . . 72.42 112.426 -174.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -115.24 -34.01 5.14 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.839 -0.344 . . . . 70.12 110.928 -178.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 91.9 mt -76.32 -51.44 11.95 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.431 -0.35 . . . . 64.23 111.549 -178.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 14.1 m -87.72 -67.72 0.81 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.504 -0.317 . . . . 71.21 111.156 -175.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 52.0 m -146.9 136.32 22.8 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.488 -0.324 . . . . 75.12 110.533 -177.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.579 ' HA ' ' O ' ' B' ' 114' ' ' ALA . . . -60.01 114.43 2.83 Favored 'General case' 0 C--N 1.331 -0.228 0 O-C-N 123.464 0.478 . . . . 71.14 110.95 -178.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 26.4 m -125.11 135.1 52.34 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.753 -0.658 . . . . 73.35 110.427 -177.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . 0.427 HD22 ' H ' ' B' ' 121' ' ' LEU . 2.6 pt? -130.35 -177.31 4.27 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.702 -0.481 . . . . 71.52 109.702 178.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 122' ' ' ASP . . . . . 0.452 ' OD1' ' HG3' ' B' ' 148' ' ' LYS . 0.0 OUTLIER -108.03 149.62 28.19 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.288 0.566 . . . . 74.41 111.062 -178.808 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . 0.471 HG23 ' HB1' ' A' ' 14' ' ' ALA . 9.3 tt -153.01 127.6 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.345 -0.843 . . . . 73.33 108.774 174.13 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 124' ' ' SER . . . . . 0.567 ' HA ' ' OE2' ' A' ' 46' ' ' GLU . 53.0 m -63.85 115.13 4.54 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.801 0.667 . . . . 74.5 112.801 -170.212 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . 0.476 ' HD2' ' HB2' ' A' ' 14' ' ' ALA . 0.6 OUTLIER -120.22 2.89 10.89 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.826 -0.625 . . . . 65.42 109.375 173.167 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.73 -173.37 2.84 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.59 -0.732 . . . . 71.05 111.109 -178.336 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -123.04 -153.3 0.55 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.359 -0.382 . . . . 70.33 111.385 -174.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 15.1 p -86.52 -33.31 20.34 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.778 0.659 . . . . 73.42 112.778 -171.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -78.08 96.6 5.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.924 0.393 . . . . 71.3 110.217 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.615 HG11 ' CD2' ' B' ' 131' ' ' PHE . 14.4 t -120.57 114.13 42.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.205 -0.452 . . . . 62.12 110.285 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 131' ' ' PHE . . . . . 0.615 ' CD2' HG11 ' B' ' 130' ' ' VAL . 20.2 p90 47.75 21.99 0.31 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.808 1.243 . . . . 74.34 114.024 178.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.455 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 53.3 t30 -59.86 -55.23 36.78 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.713 0.292 . . . . 73.21 111.096 -176.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 133' ' ' ILE . . . . . 0.588 HG21 ' HB3' ' A' ' 79' ' ' LEU . 39.3 mm -58.84 -38.38 72.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.484 0.659 . . . . 73.52 110.771 -179.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.49 HD22 HD22 ' A' ' 49' ' ' LEU . 10.2 mp -66.3 -34.36 77.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.304 -0.862 . . . . 74.21 111.094 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -67.47 -40.38 85.31 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.036 -0.529 . . . . 72.12 110.152 178.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 136' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' B' ' 132' ' ' ASN . 27.2 mt-10 -69.16 -42.74 75.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.883 -0.599 . . . . 74.12 111.086 -178.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -87.1 1.18 53.79 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.324 -0.398 . . . . 72.13 111.396 -178.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 37.5 t70 53.78 66.99 1.08 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.681 0.753 . . . . 63.4 111.581 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -90.38 -1.35 57.9 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.281 -0.872 . . . . 73.5 109.838 171.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 57.34 67.33 2.52 Favored Pre-proline 0 C--O 1.234 0.283 0 CA-C-N 114.855 -1.066 . . . . 72.54 110.902 -176.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . 0.427 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 68.4 Cg_endo -74.94 161.14 39.42 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.244 1.963 . . . . 74.43 111.299 179.181 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 142' ' ' LYS . . . . . 0.955 ' HD2' ' HB1' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -97.41 179.68 4.79 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.447 -0.501 . . . . 74.33 110.256 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 143' ' ' PHE . . . . . 0.826 ' HA ' HG13 ' A' ' 47' ' ' VAL . 0.2 OUTLIER -169.34 22.36 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.554 0.692 . . . . 61.4 109.347 -172.592 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 59.0 tp -118.14 120.47 37.83 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.296 -0.865 . . . . 73.44 109.868 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 145' ' ' CYS . . . . . 0.596 ' SG ' HG23 ' A' ' 47' ' ' VAL . 24.5 p -148.31 175.0 11.45 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.949 -0.568 . . . . 74.42 109.551 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . 0.662 ' CD ' ' HA ' ' A' ' 24' ' ' SER . 5.4 mm-40 -83.28 71.98 10.2 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.624 0.726 . . . . 72.04 109.337 179.286 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 147' ' ' VAL . . . . . 0.592 ' HA ' ' SG ' ' A' ' 45' ' ' CYS . 91.3 t -58.1 131.78 22.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 114.578 -1.192 . . . . 74.24 111.416 -176.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . 0.452 ' HG3' ' OD1' ' B' ' 122' ' ' ASP . 0.0 OUTLIER -84.64 112.93 20.9 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 109.33 -0.618 . . . . 72.3 109.33 176.278 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.617 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 1.8 mm? -67.49 92.73 0.31 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.463 -0.79 . . . . 75.43 110.99 -178.264 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.918 ' HB2' ' HD2' ' A' ' 42' ' ' LYS . . . -88.89 78.76 7.5 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.116 -0.947 . . . . 62.25 109.368 173.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 151' ' ' PHE . . . . . 0.617 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 49.5 p90 -111.22 164.45 12.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.557 -0.747 . . . . 73.04 110.802 -176.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 152' ' ' LYS . . . . . 0.401 ' HD3' HD13 ' B' ' 157' ' ' ILE . 6.8 tppt? -90.22 116.4 28.18 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.861 -0.609 . . . . 72.0 110.85 -177.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 153' ' ' CYS . . . . . . . . . . . . . 44.6 t -130.69 114.07 14.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.291 -0.413 . . . . 65.42 110.328 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 64.26 22.8 12.92 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.578 -0.737 . . . . 73.41 112.56 173.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 109.75 -24.52 19.32 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.143 -1.027 . . . . 72.34 112.988 176.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -112.73 149.89 32.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 117.163 0.482 . . . . 73.12 110.889 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . 0.401 HD13 ' HD3' ' B' ' 152' ' ' LYS . 46.9 mm -79.81 130.91 35.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.074 -0.512 . . . . 74.11 109.953 176.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 158' ' ' LYS . . . . . 0.842 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 26.5 mmmt -100.71 157.3 16.79 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.068 -0.716 . . . . 72.1 109.068 178.212 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -132.58 109.32 9.67 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.94 0.4 . . . . 73.22 110.919 174.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 160' ' ' PHE . . . . . 0.427 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 80.2 m-85 -120.73 115.41 23.26 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.115 -0.493 . . . . 74.13 111.149 -179.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 33.9 m -98.03 4.6 49.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.187 0.518 . . . . 72.2 110.603 178.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -147.14 126.55 13.16 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.065 -0.516 . . . . 74.11 109.751 -177.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 92.5 mt -71.82 -21.27 61.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.515 -0.311 . . . . 73.34 110.859 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 164' ' ' GLN . . . . . 0.519 ' OE1' ' HE3' ' B' ' 168' ' ' LYS . 0.6 OUTLIER -69.73 -41.77 74.86 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.779 -0.822 . . . . 74.31 108.779 176.103 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 32.6 t -67.69 -42.38 82.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.295 -0.866 . . . . 63.22 109.895 175.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 64.9 tp -63.66 -31.52 72.72 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.041 -0.527 . . . . 75.22 110.489 178.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . 0.521 ' HD2' HD23 ' B' ' 184' ' ' LEU . 56.3 ttt180 -56.8 -45.86 81.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.226 -0.443 . . . . 74.15 110.868 176.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 168' ' ' LYS . . . . . 0.519 ' HE3' ' OE1' ' B' ' 164' ' ' GLN . 93.1 mttt -63.8 -30.56 71.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.123 -0.489 . . . . 74.05 110.864 -178.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -80.46 -47.88 13.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.947 -0.57 . . . . 73.43 110.61 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -66.18 -29.6 69.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.948 -0.569 . . . . 65.52 111.619 -175.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 34.2 p -68.68 -45.4 71.76 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 121.124 -0.23 . . . . 75.34 110.914 -179.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -82.88 -3.87 57.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.191 0.52 . . . . 73.03 110.858 -178.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 173' ' ' LYS . . . . . 0.43 ' HB3' ' HE3' ' B' ' 173' ' ' LYS . 24.2 mmmt -86.74 111.02 20.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.078 -0.51 . . . . 75.42 110.035 173.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 48.3 t -55.82 -37.48 68.72 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.797 0.332 . . . . 75.3 111.711 -177.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 8.6 p -78.26 -46.64 19.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.845 0.355 . . . . 75.01 111.602 -178.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 81.6 mtp -76.29 -12.79 60.14 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.352 -0.385 . . . . 73.14 111.688 -175.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . 0.54 ' O ' ' HG3' ' B' ' 186' ' ' GLN . 19.0 ttmm -57.24 -30.09 64.34 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.869 -0.605 . . . . 74.31 111.15 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -100.58 5.02 43.85 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.356 0.598 . . . . 75.44 110.716 -175.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 179' ' ' LEU . . . . . 0.507 ' HB3' HG22 ' A' ' 33' ' ' ILE . 63.4 mt -97.51 -53.59 3.4 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.578 -0.737 . . . . 74.43 110.217 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 180' ' ' LEU . . . . . 0.473 ' HB3' HD12 ' B' ' 184' ' ' LEU . 3.5 mm? -86.39 1.39 51.42 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.807 -0.633 . . . . 64.51 111.322 -176.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -49.33 -29.14 5.65 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.111 0.782 . . . . 75.31 113.111 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -73.12 -28.51 62.3 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.413 0.523 . . . . 64.14 112.413 -174.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 183' ' ' VAL . . . . . 0.742 HG21 ' HG ' ' B' ' 184' ' ' LEU . 31.5 m -112.01 -14.32 10.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.864 0.364 . . . . 73.3 111.122 179.437 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 184' ' ' LEU . . . . . 0.742 ' HG ' HG21 ' B' ' 183' ' ' VAL . 42.5 mt -128.54 119.63 20.49 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.12 -0.491 . . . . 75.54 110.133 -178.477 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.66 122.14 10.99 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 122.919 2.413 . . . . 74.22 112.52 -178.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 186' ' ' GLN . . . . . 0.54 ' HG3' ' O ' ' B' ' 177' ' ' LYS . 81.5 mm-40 -113.94 -149.0 0.44 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.913 -0.585 . . . . 74.25 110.948 -178.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 187' ' ' LYS . . . . . 0.438 ' HE2' ' HB3' ' B' ' 187' ' ' LYS . 29.5 mtpt 70.27 96.43 0.07 Allowed 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 124.109 0.964 . . . . 75.52 111.198 -175.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 . . . . . 0 C--N 1.306 -1.297 0 CA-C-N 114.376 -1.284 . . . . 64.42 109.399 176.898 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.659 0 N-CA-C 111.526 -0.63 . . . . 74.11 111.526 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.1 m -98.28 164.32 2.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.754 0.311 . . . . 73.54 110.716 -178.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -90.37 146.06 24.47 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.951 0.405 . . . . 73.31 110.434 -177.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 87.8 mtp -89.95 101.53 14.24 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.955 -0.566 . . . . 74.03 110.097 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -73.11 114.68 11.55 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.907 -0.588 . . . . 73.02 110.31 178.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -74.38 123.21 24.23 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.458 -0.792 . . . . 74.11 110.902 -178.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.99 51.09 3.16 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.043 -0.598 . . . . 72.4 112.101 -178.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -132.25 123.29 26.67 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.802 0.334 . . . . 75.12 110.696 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 49.1 t -79.11 129.6 37.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 109.567 -0.531 . . . . 74.43 109.567 176.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.411 HD23 ' HB3' ' B' ' 110' ' ' LEU . 85.8 mt -74.33 132.75 42.33 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.924 0.392 . . . . 73.13 111.446 -176.221 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.7 m -70.78 105.32 3.17 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.84 -0.618 . . . . 74.34 110.136 174.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 28.8 tp -74.4 116.92 15.62 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.085 0.469 . . . . 74.32 110.596 -178.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -83.01 -6.38 59.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.805 -0.634 . . . . 74.42 111.223 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 70.58 -53.84 0.65 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.637 0.775 . . . . 72.41 112.972 175.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -78.59 48.5 0.8 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.899 0.38 . . . . 64.33 111.778 -173.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.4 mp 49.3 32.76 4.64 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.842 0.682 . . . . 72.2 112.842 174.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.0 t -71.67 -27.01 62.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.141 0.496 . . . . 51.45 110.054 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.9 t -154.76 138.57 16.21 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.616 -0.883 . . . . 63.31 108.616 174.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -84.46 120.88 26.82 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.105 0.479 . . . . 61.21 112.151 -174.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.1 m -88.65 143.26 27.05 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.383 -0.826 . . . . 73.41 109.697 174.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.456 ' HG ' ' HG ' ' B' ' 112' ' ' LEU . 66.9 mt -82.26 162.54 22.28 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.069 0.462 . . . . 74.51 111.327 -179.088 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -131.13 151.0 51.9 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.382 -0.826 . . . . 73.43 109.927 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.6 tp -119.43 125.48 74.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 121.321 0.581 . . . . 74.23 110.805 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.8 p -140.66 104.88 4.82 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.753 -0.658 . . . . 64.43 110.343 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.504 ' C ' ' HG3' ' A' ' 26' ' ' GLN . 0.0 OUTLIER -114.61 89.53 3.12 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.501 -0.318 . . . . 73.25 111.323 176.719 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.504 ' HG3' ' C ' ' A' ' 25' ' ' LYS . 0.1 OUTLIER 40.99 92.94 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 114.435 1.272 . . . . 74.23 114.435 174.755 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -87.7 -29.19 21.3 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.656 -0.702 . . . . 73.22 109.984 177.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.2 m -90.19 15.9 9.49 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.495 -0.775 . . . . 73.34 111.914 -174.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.484 ' OD1' ' HB3' ' A' ' 32' ' ' ASN . 47.0 t30 -77.52 74.04 4.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.603 0.716 . . . . 74.44 109.899 177.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 42.3 t -120.95 -59.29 2.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.209 -0.905 . . . . 73.54 109.849 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -74.46 -18.98 60.56 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.673 -0.694 . . . . 75.14 110.838 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.51 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 6.8 t30 -62.42 -44.15 97.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.319 -0.4 . . . . 71.21 111.124 -178.217 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 39.5 mm -55.39 -46.22 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-O 121.332 0.587 . . . . 63.35 110.705 177.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.507 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 68.7 mt -65.46 -32.59 74.29 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.684 -0.689 . . . . 73.41 111.178 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -70.0 -38.99 76.15 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.798 0.332 . . . . 75.53 110.219 177.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.51 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 6.0 mm-40 -70.21 -23.08 62.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.172 -0.467 . . . . 75.43 110.819 179.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 28.9 m-80 -99.59 1.95 44.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.227 -0.442 . . . . 73.32 110.927 177.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 60.85 43.47 11.9 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.543 -0.753 . . . . 74.2 112.185 176.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.507 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 3.4 m-85 -80.06 -11.66 59.75 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.875 -0.602 . . . . 75.43 109.451 171.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 57.32 73.93 0.72 Allowed Pre-proline 0 C--O 1.231 0.108 0 CA-C-N 114.806 -1.088 . . . . 71.23 111.054 -175.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.547 ' C ' ' HE2' ' A' ' 42' ' ' LYS . 83.3 Cg_endo -86.42 147.27 8.66 Favored 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.735 2.29 . . . . 72.32 111.685 177.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.547 ' HE2' ' C ' ' A' ' 41' ' ' PRO . 1.4 mpmm? -95.19 159.07 15.18 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.326 0.584 . . . . 72.04 111.072 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -157.21 31.34 0.29 Allowed 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 107.754 -1.202 . . . . 74.42 107.754 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 59.7 tp -69.2 105.12 2.39 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.47 -1.241 . . . . 74.31 111.017 -175.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.475 ' C ' ' H ' ' A' ' 47' ' ' VAL . 78.2 m -86.08 99.9 11.8 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.781 -0.645 . . . . 74.3 110.023 176.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -76.57 23.78 0.15 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.834 -0.621 . . . . 73.53 110.653 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.475 ' H ' ' C ' ' A' ' 45' ' ' CYS . 43.4 t -82.81 99.07 5.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.378 0.609 . . . . 64.14 111.237 -174.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.0 112.35 5.26 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.145 -0.934 . . . . 75.4 108.867 172.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.796 ' H ' HD23 ' A' ' 49' ' ' LEU . 0.3 OUTLIER -76.15 91.47 3.16 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.32 0.581 . . . . 55.11 110.891 -175.404 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.557 ' HB2' HG21 ' A' ' 59' ' ' THR . . . -84.54 78.32 9.86 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.177 -0.92 . . . . 72.24 109.638 173.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.503 ' HB3' ' HA ' ' B' ' 141' ' ' PRO . 52.1 p90 -97.98 162.57 13.16 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.012 -0.54 . . . . 63.4 110.791 -174.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -93.17 119.73 32.69 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.118 -0.492 . . . . 73.35 110.078 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.475 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 45.4 t -128.7 108.96 10.9 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.372 -0.376 . . . . 61.23 110.621 178.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.5 t70 72.88 2.15 4.27 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.581 -0.736 . . . . 72.01 111.97 171.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 129.39 -25.87 4.46 Favored Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.184 -1.008 . . . . 71.23 112.587 179.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.47 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 11.2 pt-20 -106.07 149.18 26.96 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.643 -0.423 . . . . 71.44 110.788 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 44.6 mm -84.39 117.14 29.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.032 -0.531 . . . . 71.14 109.778 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.568 ' HB3' ' CE1' ' A' ' 60' ' ' PHE . 30.1 mmmt -99.2 102.43 14.08 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.328 -0.396 . . . . 64.44 110.362 -177.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.557 HG21 ' HB2' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -82.86 101.91 11.3 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.242 -0.435 . . . . 75.51 110.588 178.186 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.568 ' CE1' ' HB3' ' A' ' 58' ' ' LYS . 4.8 m-85 -108.25 136.1 48.47 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.43 -0.35 . . . . 71.14 111.576 -177.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.4 p -118.73 -0.46 11.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.996 -0.547 . . . . 71.33 111.006 174.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.462 ' HB2' ' HG ' ' A' ' 65' ' ' SER . 35.7 m-20 -130.43 135.58 48.14 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 120.853 0.359 . . . . 74.52 111.841 -177.269 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.9 tp -70.69 -34.96 72.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.713 -0.676 . . . . 75.31 109.594 174.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -57.45 -44.98 85.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.607 -0.724 . . . . 75.15 110.615 176.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.462 ' HG ' ' HB2' ' A' ' 62' ' ' ASP . 50.9 m -69.75 -33.12 72.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.842 -0.617 . . . . 75.35 110.829 179.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 46.6 tp -68.22 -37.79 81.21 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.993 -0.373 . . . . 74.31 109.993 177.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 51.6 ttp180 -58.6 -50.16 74.82 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.874 -0.603 . . . . 73.42 111.0 178.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.529 ' HD3' ' N ' ' A' ' 69' ' ' PHE . 0.0 OUTLIER -67.7 -39.59 84.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.799 0.333 . . . . 72.13 111.396 -178.202 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.529 ' N ' ' HD3' ' A' ' 68' ' ' LYS . 74.0 t80 -67.11 -44.83 78.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.897 -0.592 . . . . 75.35 110.933 -178.58 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.74 -30.01 70.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.347 -0.388 . . . . 73.34 111.134 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.8 t -72.72 -35.16 67.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.34 -0.391 . . . . 53.03 110.818 -178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -86.81 -11.9 49.57 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.035 0.445 . . . . 74.55 110.729 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.475 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 27.3 mmmt -89.82 122.77 33.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.095 -0.502 . . . . 74.02 110.2 175.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.5 m -63.99 -38.65 91.85 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.585 0.231 . . . . 65.14 111.344 -178.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.406 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 10.7 p -72.98 -40.23 65.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.882 0.372 . . . . 55.41 111.367 -179.544 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.446 ' HA ' HD13 ' A' ' 79' ' ' LEU . 74.3 mtp -85.18 -15.21 44.46 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.935 0.346 . . . . 64.22 111.935 -174.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 81.0 tttt -59.84 -37.47 79.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.217 -0.447 . . . . 72.45 111.79 -174.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.621 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 28.2 mt-10 -102.51 7.74 40.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.644 0.735 . . . . 73.12 110.651 -176.221 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.636 ' HB3' HG23 ' B' ' 133' ' ' ILE . 70.0 mt -87.3 -41.18 13.85 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.138 -0.937 . . . . 75.34 109.549 174.037 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -101.02 6.44 43.46 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.609 -0.723 . . . . 64.03 110.509 -178.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.621 ' HB3' ' HA ' ' A' ' 78' ' ' GLU . 18.8 ptmt -61.27 -12.83 14.86 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.447 -0.797 . . . . 74.33 112.124 -178.147 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -81.57 -46.08 14.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.751 0.31 . . . . 73.33 110.931 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 24.6 m -84.62 -18.83 9.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.1 0.476 . . . . 73.55 110.66 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 55.3 mt -107.61 98.24 23.41 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 108.448 -0.945 . . . . 72.43 108.448 171.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -46.57 91.02 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 123.983 3.122 . . . . 51.45 114.849 -168.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -144.75 104.57 4.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.372 -0.831 . . . . 75.11 108.988 174.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -83.32 -32.46 26.29 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.969 0.414 . . . . 75.51 110.373 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.451 -0.418 0 CA-C-N 115.91 -0.586 . . . . 74.12 110.55 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.239 0 N-CA-C 112.288 -0.325 . . . . 73.12 112.288 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 31.2 m -131.46 157.0 43.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.972 -0.381 . . . . 63.52 109.972 177.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 80.8 mt -74.81 118.84 18.22 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.404 -0.362 . . . . 75.35 110.809 178.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 24.5 ptp -71.95 114.35 9.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.236 0.541 . . . . 75.1 109.695 175.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -80.56 92.8 5.97 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 122.033 0.921 . . . . 73.13 110.48 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -73.25 118.52 16.3 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.341 -1.3 . . . . 71.14 110.445 178.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -77.56 61.01 3.63 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 121.121 -0.562 . . . . 73.02 112.014 178.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -96.38 106.38 18.6 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.707 0.289 . . . . 72.32 110.318 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 39.3 t -71.99 110.53 5.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.473 -0.565 . . . . 75.03 109.473 177.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 110' ' ' LEU . . . . . 0.411 ' HB3' HD23 ' A' ' 10' ' ' LEU . 92.0 mt -92.66 134.42 35.04 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.17 0.509 . . . . 74.53 110.98 -175.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 91.3 m -81.87 119.33 23.78 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.683 -0.69 . . . . 74.13 110.207 177.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . 0.456 ' HG ' ' HG ' ' A' ' 21' ' ' LEU . 0.2 OUTLIER -62.65 130.74 46.37 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.229 -0.656 . . . . 74.13 109.229 177.546 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 113' ' ' ALA . . . . . 0.428 ' HB3' ' HB3' ' B' ' 117' ' ' SER . . . -68.61 4.15 1.54 Allowed 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.518 0.562 . . . . 73.5 112.518 -177.407 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . 68.96 -74.08 0.08 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.68 0.792 . . . . 70.42 112.933 174.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -81.73 63.65 6.09 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.454 0.539 . . . . 74.34 112.454 -166.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 94.3 mt 59.51 8.73 1.29 Allowed 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.51 0.929 . . . . 73.22 113.51 170.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.428 ' HB3' ' HB3' ' B' ' 113' ' ' ALA . 22.4 t -68.78 -44.8 72.88 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.065 0.459 . . . . 62.4 110.85 -176.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 26.6 t -134.71 89.92 2.59 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.859 0.361 . . . . 60.21 110.165 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -138.67 90.72 2.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.146 -0.479 . . . . 73.01 110.448 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 89.7 m -156.76 125.54 5.87 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.988 -0.551 . . . . 71.45 109.608 179.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . 0.71 HD21 HG23 ' B' ' 123' ' ' ILE . 8.8 tt -154.41 139.16 17.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.489 -0.323 . . . . 74.44 110.508 -176.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -143.2 101.38 3.8 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.167 0.508 . . . . 74.41 110.288 173.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . 0.71 HG23 HD21 ' B' ' 121' ' ' LEU . 7.1 tp -146.71 114.03 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 109.023 -0.732 . . . . 74.22 109.023 173.032 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 19.9 p -170.02 165.65 9.37 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.918 -0.583 . . . . 73.03 109.863 -172.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -128.77 -60.19 1.11 Allowed 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 116.35 -0.386 . . . . 75.14 111.021 -178.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -143.39 122.27 12.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.157 -0.474 . . . . 74.12 110.968 -173.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -109.76 -34.61 6.41 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.293 -0.412 . . . . 74.35 110.886 177.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 5.4 m -90.08 13.32 15.25 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.216 -0.447 . . . . 74.44 112.026 -173.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -81.56 81.29 7.7 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.334 0.588 . . . . 75.11 111.259 -175.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.551 HG12 ' HD1' ' B' ' 131' ' ' PHE . 3.2 p -134.74 -44.44 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.383 -0.826 . . . . 73.22 109.018 170.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 131' ' ' PHE . . . . . 0.551 ' HD1' HG12 ' B' ' 130' ' ' VAL . 40.5 p90 -104.2 -1.03 27.75 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.865 -0.607 . . . . 74.12 109.604 174.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -63.02 -63.54 1.17 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.136 -0.938 . . . . 65.13 111.72 -173.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 133' ' ' ILE . . . . . 0.636 HG23 ' HB3' ' A' ' 79' ' ' LEU . 48.6 mm -60.45 -37.58 75.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.399 0.618 . . . . 74.41 110.609 -178.326 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.524 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 79.0 mt -60.94 -40.03 91.71 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.473 -0.785 . . . . 75.44 111.143 179.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' B' ' 135' ' ' ARG . 28.4 ttt180 -65.61 -42.93 91.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.733 0.301 . . . . 74.43 110.359 177.408 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -61.33 -35.62 77.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.867 -0.606 . . . . 64.24 111.317 -179.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -98.09 9.21 43.42 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.186 -0.461 . . . . 74.34 110.841 -179.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 63.1 41.09 8.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.422 -0.808 . . . . 74.22 112.619 171.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 139' ' ' PHE . . . . . 0.524 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 26.3 m-85 -74.01 -15.39 61.09 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.541 -0.54 . . . . 75.01 109.541 170.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 52.5 74.62 0.75 Allowed Pre-proline 0 C--O 1.234 0.262 0 CA-C-N 114.89 -1.05 . . . . 71.11 110.952 -176.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . 0.503 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 95.8 Cg_endo -88.22 178.42 3.04 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.875 2.383 . . . . 74.44 111.904 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -127.07 141.54 51.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.33 0.586 . . . . 75.3 111.211 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -141.31 50.37 1.61 Allowed 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 107.267 -1.383 . . . . 70.34 107.267 177.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.55 86.71 1.59 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.702 -1.135 . . . . 75.34 111.301 -171.723 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 71.3 m -83.06 69.97 9.95 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.229 0.538 . . . . 75.51 110.051 175.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.34 44.67 1.16 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.455 0.645 . . . . 74.23 109.609 177.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 85.8 t -76.72 101.9 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 115.26 -0.882 . . . . 63.42 109.825 178.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -131.93 111.27 11.41 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.276 -0.874 . . . . 74.14 109.756 178.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.716 HD22 ' H ' ' B' ' 149' ' ' LEU . 0.3 OUTLIER -76.96 90.11 3.54 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.273 -0.421 . . . . 74.44 110.692 -178.34 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.582 ' HA ' ' O ' ' B' ' 158' ' ' LYS . . . -80.15 85.0 5.76 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.531 -0.759 . . . . 74.52 109.831 174.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 151' ' ' PHE . . . . . 0.434 ' HB3' ' HA ' ' A' ' 41' ' ' PRO . 52.1 p90 -104.67 165.5 11.02 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.924 -0.58 . . . . 75.12 110.319 -177.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 2.4 tppp? -93.65 116.11 28.59 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.006 -0.543 . . . . 65.32 110.032 176.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 153' ' ' CYS . . . . . 0.42 ' C ' ' H ' ' B' ' 155' ' ' GLY . 23.1 t -88.85 -131.61 0.08 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.322 -0.854 . . . . 75.41 110.028 178.229 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . 0.46 ' CG ' ' HZ1' ' B' ' 173' ' ' LYS . 0.2 OUTLIER -74.06 35.98 0.09 Allowed 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 123.962 0.905 . . . . 71.44 111.556 -179.068 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 155' ' ' GLY . . . . . 0.42 ' H ' ' C ' ' B' ' 153' ' ' CYS . . . 110.59 -17.18 28.39 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.676 -0.773 . . . . 60.41 111.541 -177.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 156' ' ' GLU . . . . . 0.423 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 13.1 pt-20 -106.06 140.85 38.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.879 0.371 . . . . 74.45 110.631 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 41.3 mm -82.93 120.65 34.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 109.494 -0.558 . . . . 75.52 109.494 176.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 158' ' ' LYS . . . . . 0.582 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 31.6 mmmt -103.99 132.75 49.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.682 0.277 . . . . 74.15 111.084 -176.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -112.58 103.7 11.76 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.212 -0.449 . . . . 74.43 111.377 177.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 160' ' ' PHE . . . . . 0.454 ' CD2' HD12 ' B' ' 166' ' ' LEU . 64.6 m-85 -120.01 143.69 47.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.135 -0.484 . . . . 73.05 110.722 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 18.9 p -118.57 -18.37 9.08 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.49 0.662 . . . . 64.24 109.481 173.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -111.16 138.66 47.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.293 -0.867 . . . . 63.33 109.206 178.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.9 pp -81.69 -10.96 59.25 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.858 -0.423 . . . . 72.35 109.858 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -65.49 -51.98 56.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.364 0.602 . . . . 73.0 109.83 175.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 165' ' ' SER . . . . . 0.506 ' O ' ' HG3' ' B' ' 168' ' ' LYS . 0.3 OUTLIER -70.42 -31.64 68.91 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.363 -0.835 . . . . 64.11 110.623 179.287 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . 0.454 HD12 ' CD2' ' B' ' 160' ' ' PHE . 68.7 tp -69.99 -41.36 74.51 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.179 -0.464 . . . . 75.14 110.593 177.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . 0.673 ' HG3' HD12 ' B' ' 184' ' ' LEU . 50.6 ttp180 -61.88 -47.63 84.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.364 -0.38 . . . . 74.31 110.772 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 168' ' ' LYS . . . . . 0.506 ' HG3' ' O ' ' B' ' 165' ' ' SER . 0.0 OUTLIER -65.22 -36.54 84.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.925 0.393 . . . . 73.11 110.879 -179.711 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -65.52 -48.62 71.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.738 -0.665 . . . . 74.34 110.606 175.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.02 -37.04 83.41 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.403 -0.362 . . . . 60.13 111.446 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 10.9 t -68.43 -22.31 64.61 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.401 -0.363 . . . . 73.22 111.26 -177.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -102.05 3.53 38.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.955 0.407 . . . . 74.44 110.633 178.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 173' ' ' LYS . . . . . 0.46 ' HZ1' ' CG ' ' B' ' 154' ' ' ASP . 27.4 mmmt -104.27 111.81 24.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.181 -0.463 . . . . 75.03 110.747 -179.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 25.2 m -52.8 -31.75 40.38 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 123.241 0.338 . . . . 61.33 111.898 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 11.0 p -81.84 -49.49 10.3 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.757 0.313 . . . . 74.44 111.622 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 176' ' ' MET . . . . . 0.415 ' HA ' HD13 ' B' ' 179' ' ' LEU . 82.1 mtp -80.78 -18.61 47.04 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.201 0.445 . . . . 72.4 112.201 -172.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . 0.432 ' HB2' ' O ' ' B' ' 173' ' ' LYS . 79.8 tttt -60.88 -31.31 70.79 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.183 -0.462 . . . . 74.43 110.936 -176.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . 0.898 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 44.4 mt-10 -99.15 3.28 46.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.457 0.646 . . . . 65.54 110.641 -174.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 179' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' B' ' 176' ' ' MET . 86.3 mt -93.38 -56.44 2.94 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.464 -0.789 . . . . 72.51 110.378 178.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -76.54 -10.98 59.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.665 -0.698 . . . . 75.32 111.666 -176.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 181' ' ' LYS . . . . . 0.898 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 17.5 ptmt -61.37 -9.43 5.36 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.851 0.686 . . . . 74.43 112.851 -174.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -76.09 -31.91 58.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.998 0.428 . . . . 73.02 110.585 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 20.8 m -113.24 -10.77 12.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.016 -0.538 . . . . 75.42 110.806 178.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 184' ' ' LEU . . . . . 0.673 HD12 ' HG3' ' B' ' 167' ' ' ARG . 95.7 mt -110.62 109.43 57.95 Favored Pre-proline 0 C--N 1.327 -0.388 0 N-CA-C 108.977 -0.749 . . . . 74.44 108.977 173.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -45.04 96.47 0.03 OUTLIER 'Trans proline' 0 C--O 1.238 0.477 0 C-N-CA 124.201 3.267 . . . . 72.22 114.57 -170.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 186' ' ' GLN . . . . . 0.718 ' HB2' ' HB2' ' B' ' 181' ' ' LYS . 79.2 mt-30 -139.63 104.76 5.0 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.717 -0.846 . . . . 74.21 108.717 172.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -72.46 -47.71 46.72 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.233 -0.439 . . . . 61.44 111.735 -173.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 . . . . . 0 C--O 1.245 0.83 0 CA-C-O 118.529 -0.748 . . . . 73.45 110.269 -177.98 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.71 0 N-CA-C 111.623 -0.591 . . . . 64.44 111.623 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 42.6 t -91.43 -55.4 6.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.734 -0.469 . . . . 74.03 109.734 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 19.8 tp -90.6 151.48 21.29 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.766 -0.652 . . . . 72.11 109.696 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -76.84 104.55 7.4 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.412 0.625 . . . . 74.32 110.435 178.617 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -107.73 156.09 19.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.797 -0.638 . . . . 75.44 110.033 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -133.8 135.73 44.03 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.156 -0.474 . . . . 73.22 110.199 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -96.64 -95.65 1.85 Allowed Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.613 -0.803 . . . . 64.23 112.201 -179.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -147.89 168.31 22.55 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.667 0.27 . . . . 74.11 111.115 -177.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 24.3 m -98.97 153.67 4.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.118 -0.492 . . . . 75.53 110.549 177.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.1 pp -91.32 173.03 8.13 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.244 -0.435 . . . . 62.44 110.356 177.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.3 m -124.61 120.73 32.74 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.289 0.566 . . . . 75.25 111.388 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.519 HD21 ' N ' ' A' ' 13' ' ' ALA . 4.4 tt -114.33 142.4 46.37 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.213 -1.032 . . . . 74.14 108.213 176.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.831 ' HB2' ' HB3' ' A' ' 16' ' ' LEU . . . -104.57 102.79 12.39 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.836 0.351 . . . . 63.12 111.281 -176.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.29 -34.22 76.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.179 -0.464 . . . . 72.12 111.707 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -100.48 -41.79 6.85 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.867 0.365 . . . . 72.55 111.304 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.831 ' HB3' ' HB2' ' A' ' 13' ' ' ALA . 57.0 tp -72.85 -27.2 61.79 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.18 -0.464 . . . . 74.14 111.804 -175.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 31.4 t -119.34 -47.81 2.44 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.886 -0.326 . . . . 74.22 111.087 -177.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.8 m -84.56 52.67 2.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.893 0.378 . . . . 71.32 111.648 -178.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -94.16 174.41 7.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.355 -0.384 . . . . 71.45 110.048 177.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.9 t -91.72 158.64 16.26 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.74 -0.384 . . . . 74.02 110.561 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.437 HD22 ' N ' ' A' ' 21' ' ' LEU . 2.2 pt? -139.74 20.15 2.51 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.321 -0.4 . . . . 74.42 111.171 -177.454 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -95.1 173.44 7.57 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.216 -0.29 . . . . 74.03 110.216 -179.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 10.7 tt -126.7 -43.77 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 C-N-CA 120.953 -0.299 . . . . 74.34 111.709 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.4 m -153.65 157.03 38.98 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.057 -0.402 . . . . 73.4 111.872 -176.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.815 ' HD3' ' HA ' ' B' ' 164' ' ' GLN . 0.0 OUTLIER -168.07 21.2 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.733 -0.667 . . . . 75.24 109.333 175.325 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -68.13 122.78 19.01 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.586 -0.734 . . . . 75.41 111.399 -171.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 8.1 t-105 -150.32 -174.2 4.67 Favored 'General case' 0 N--CA 1.442 -0.831 0 N-CA-C 108.329 -0.989 . . . . 72.32 108.329 178.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 15.2 m -96.83 -1.59 45.81 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.315 0.579 . . . . 65.41 110.762 -172.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -84.17 14.22 4.47 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.836 -0.62 . . . . 73.53 111.392 -175.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.586 HG11 HD12 ' B' ' 163' ' ' LEU . 17.4 m -60.82 -47.67 92.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 112.346 0.499 . . . . 74.43 112.346 -176.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -104.99 2.34 29.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.637 0.256 . . . . 75.23 111.062 -176.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.583 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 6.5 t30 -65.69 -42.5 91.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.27 -0.423 . . . . 72.12 110.922 -173.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.619 HG22 ' HB3' ' B' ' 179' ' ' LEU . 30.2 mm -74.26 -32.8 32.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.643 0.735 . . . . 72.23 110.479 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.483 HD12 HD21 ' B' ' 149' ' ' LEU . 76.6 mt -70.75 -34.48 71.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.387 -0.824 . . . . 73.0 111.749 -175.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.55 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 7.9 ptm180 -69.62 -37.24 76.76 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.969 0.414 . . . . 74.44 110.536 178.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.583 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 38.2 mt-10 -63.33 -44.68 94.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.61 -0.723 . . . . 75.14 111.387 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 -95.41 5.99 50.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.255 -0.43 . . . . 75.2 110.973 -175.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 55.48 65.77 1.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.355 -0.839 . . . . 74.01 112.685 177.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -90.53 -3.61 57.48 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.461 -0.791 . . . . 73.31 109.397 170.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 56.98 71.17 1.18 Allowed Pre-proline 0 CA--C 1.53 0.186 0 CA-C-N 114.958 -1.019 . . . . 64.42 111.565 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.461 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 85.1 Cg_endo -85.18 170.11 9.69 Favored 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 122.456 2.104 . . . . 73.41 111.693 177.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.684 ' HD3' ' HB2' ' B' ' 150' ' ' ALA . 5.1 mptp? -93.46 -178.58 4.77 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 121.07 -0.252 . . . . 73.43 110.359 179.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 73.8 t80 172.93 -40.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.426 0.631 . . . . 74.41 110.469 -169.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -78.16 98.15 5.73 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.104 -0.953 . . . . 73.44 110.667 -177.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 37.1 t -130.63 157.71 42.0 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.953 -0.567 . . . . 73.43 109.561 179.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.5 mp0 -73.22 92.47 1.76 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.178 0.513 . . . . 73.42 110.488 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.622 HG21 ' SG ' ' B' ' 145' ' ' CYS . 3.0 t -81.37 163.04 3.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.818 -0.628 . . . . 75.25 109.927 179.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.74 118.77 36.52 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.475 0.655 . . . . 74.42 109.79 174.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.776 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.9 mp -75.55 94.8 3.22 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.353 -0.84 . . . . 74.31 110.949 -175.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -87.25 59.33 5.5 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.637 -0.505 . . . . 63.34 109.637 172.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.776 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 54.9 p90 -88.08 166.94 14.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.097 -0.501 . . . . 74.24 110.713 -176.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.4 tppp? -96.15 131.51 42.52 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.524 -0.762 . . . . 73.44 110.415 179.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.473 ' SG ' ' HE2' ' A' ' 69' ' ' PHE . 49.7 t -139.35 107.73 5.82 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.869 0.366 . . . . 73.22 110.478 175.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 t70 70.54 13.56 7.36 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.429 -0.805 . . . . 74.04 111.56 172.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 120.17 -29.6 5.92 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.291 -0.957 . . . . 64.51 112.702 177.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.435 ' CD ' ' HD3' ' A' ' 58' ' ' LYS . 12.7 pt-20 -102.17 155.2 18.36 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 110.064 -0.347 . . . . 75.3 110.064 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 47.8 mm -86.86 129.2 38.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.494 -0.558 . . . . 74.32 109.494 176.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.544 ' HB3' ' CE2' ' A' ' 60' ' ' PHE . 31.7 mmmt -117.56 97.01 5.65 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 121.266 -0.174 . . . . 64.15 110.767 -176.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.559 ' HA ' ' O ' ' A' ' 49' ' ' LEU . 0.6 OUTLIER -79.09 110.31 14.22 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.872 0.323 . . . . 74.1 111.872 -179.855 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.544 ' CE2' ' HB3' ' A' ' 58' ' ' LYS . 82.6 m-85 -129.47 140.1 51.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.803 0.335 . . . . 65.5 110.369 176.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.7 p -124.01 13.32 9.09 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.234 0.54 . . . . 62.43 110.557 176.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -140.01 -177.74 5.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.849 -0.614 . . . . 72.21 110.738 -176.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.456 HD11 HG23 ' B' ' 130' ' ' VAL . 26.6 tp -127.91 32.6 4.91 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.746 -0.661 . . . . 73.32 109.972 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -120.82 -42.66 2.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.171 0.51 . . . . 73.45 109.871 177.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.6 m -81.14 -43.05 19.96 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.641 -0.503 . . . . 73.34 109.641 174.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.527 HD13 ' HB2' ' A' ' 60' ' ' PHE . 5.9 tt -63.4 -41.52 98.76 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.447 -0.575 . . . . 74.52 109.447 177.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.6 ttt180 -60.0 -38.66 83.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.808 -0.633 . . . . 74.24 110.996 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.1 mtmm -64.71 -43.24 94.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.935 0.397 . . . . 75.02 110.673 175.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.473 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 64.1 t80 -63.44 -44.91 93.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.002 -0.545 . . . . 74.42 110.541 179.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.46 -25.58 66.79 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.855 -0.612 . . . . 72.25 111.95 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.1 t -80.71 -28.48 36.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.506 0.193 . . . . 73.41 111.21 -177.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -88.38 -19.32 26.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.209 0.528 . . . . 75.44 110.16 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -86.68 118.8 26.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.586 -0.733 . . . . 72.12 110.67 176.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.4 m -62.21 -40.33 95.75 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.004 0.43 . . . . 74.04 110.303 178.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 36.4 t -63.67 -49.11 74.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.679 -0.691 . . . . 73.42 110.787 -179.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 68.9 mtp -78.62 -14.99 59.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.295 -0.411 . . . . 71.3 111.183 -175.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.426 ' HB2' ' HE3' ' A' ' 77' ' ' LYS . 38.8 ttmt -64.3 -32.65 74.34 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.082 -0.508 . . . . 75.42 110.549 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.459 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 20.6 mm-40 -88.99 -4.26 58.48 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 121.639 0.733 . . . . 71.41 110.127 -178.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.595 ' HB3' HG22 ' B' ' 133' ' ' ILE . 49.0 mt -95.19 -52.96 3.97 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.835 -1.075 . . . . 73.03 109.583 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.66 ' HB3' HD12 ' A' ' 84' ' ' LEU . 4.1 mm? -84.8 -0.75 54.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.298 -0.864 . . . . 71.33 111.412 -176.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.459 ' HD3' ' HA ' ' A' ' 78' ' ' GLU . 64.7 pttt -56.74 -14.44 3.34 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 111.895 0.331 . . . . 73.05 111.895 176.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -63.4 -42.11 98.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.995 0.426 . . . . 75.23 110.862 176.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 7.5 p -111.52 -15.64 9.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.308 0.575 . . . . 64.12 111.009 -176.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.66 HD12 ' HB3' ' A' ' 80' ' ' LEU . 11.2 mp -90.33 129.45 45.37 Favored Pre-proline 0 C--N 1.327 -0.412 0 N-CA-C 109.882 -0.414 . . . . 54.52 109.882 173.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' A' ' 84' ' ' LEU . 27.4 Cg_exo -61.45 102.15 0.22 Allowed 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 123.024 2.483 . . . . 73.34 112.527 -177.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -141.79 145.46 34.79 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.147 -0.478 . . . . 64.53 109.72 -178.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt 52.32 37.58 22.67 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 123.861 0.726 . . . . 75.12 111.66 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 . . . . . 0 C--N 1.317 -0.821 0 CA-C-N 115.404 -0.816 . . . . 64.23 111.103 -179.358 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.301 0 N-CA-C 112.023 -0.431 . . . . 64.23 112.023 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 48.7 t -87.76 -45.51 16.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 109.513 -0.551 . . . . 72.35 109.513 178.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 3.5 pp -140.64 153.12 45.9 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.373 -0.831 . . . . 73.41 109.914 175.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 89.6 mmm -115.29 108.35 16.45 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.906 0.384 . . . . 73.24 111.16 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -75.17 119.04 18.77 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.107 -0.701 . . . . 62.25 109.107 171.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -138.47 104.15 5.07 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.036 -0.529 . . . . 74.13 110.423 -172.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -176.27 -35.91 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.727 -0.749 . . . . 75.52 112.369 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -79.16 75.97 5.69 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.31 0.576 . . . . 74.53 111.244 -178.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 70.2 t -97.76 128.36 49.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.718 -0.674 . . . . 75.03 110.324 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 110' ' ' LEU . . . . . 0.754 ' H ' HD11 ' B' ' 110' ' ' LEU . 0.0 OUTLIER -92.31 178.41 5.85 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.331 -0.395 . . . . 72.22 110.616 178.455 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 11.2 t -147.92 163.54 36.51 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.877 -0.416 . . . . 71.35 109.877 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . 0.403 HD22 ' N ' ' B' ' 113' ' ' ALA . 5.1 tt -143.09 127.21 17.48 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.136 -0.691 . . . . 73.54 109.136 179.141 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 113' ' ' ALA . . . . . 0.503 ' HB3' ' HB2' ' B' ' 117' ' ' SER . . . -84.35 103.87 13.89 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.768 0.318 . . . . 74.51 110.157 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -60.7 -45.29 94.78 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.601 -0.727 . . . . 74.3 112.159 -172.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -91.57 -36.48 13.67 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.758 0.313 . . . . 65.42 111.492 -177.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.489 ' HB3' ' HB2' ' B' ' 113' ' ' ALA . 47.9 tp -82.22 -59.88 2.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 74.54 111.941 -172.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.503 ' HB2' ' HB3' ' B' ' 113' ' ' ALA . 5.6 t -71.01 -41.29 71.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.015 0.436 . . . . 75.42 109.872 -176.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 24.4 m -92.65 87.07 5.77 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.588 -0.523 . . . . 64.31 109.588 174.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -81.53 111.01 17.45 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.02 -0.537 . . . . 73.11 110.796 -175.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 21.4 m -60.71 111.93 1.82 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.0 -0.546 . . . . 74.22 111.31 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . 0.738 HD21 ' H ' ' B' ' 121' ' ' LEU . 2.5 pt? -99.82 22.23 11.38 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.931 -0.577 . . . . 75.13 110.407 -179.187 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 122' ' ' ASP . . . . . 0.413 ' CG ' ' HZ1' ' B' ' 125' ' ' LYS . 18.4 t70 -64.4 117.52 7.4 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.829 -0.623 . . . . 74.14 110.169 -177.174 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . 0.86 HG12 ' H ' ' B' ' 124' ' ' SER . 13.0 tt -86.09 -168.93 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-N 115.5 -0.773 . . . . 74.24 111.379 -170.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 124' ' ' SER . . . . . 0.86 ' H ' HG12 ' B' ' 123' ' ' ILE . 7.8 m -80.24 141.64 35.38 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 120.917 0.389 . . . . 73.04 111.628 -178.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . 0.425 ' HE3' ' HB3' ' B' ' 125' ' ' LYS . 0.0 OUTLIER -162.68 32.2 0.1 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.318 0.58 . . . . 71.1 109.743 176.148 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -64.67 113.76 3.97 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.404 -0.816 . . . . 72.13 110.612 -174.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 9.8 t-105 -132.91 -162.86 1.28 Allowed 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.172 -0.922 . . . . 75.51 108.904 -173.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 15.6 m -105.49 -0.55 25.81 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.202 0.525 . . . . 73.35 110.739 -178.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -83.44 56.25 3.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.799 -0.637 . . . . 73.41 110.994 -176.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.456 HG23 HD11 ' A' ' 63' ' ' LEU . 32.3 t -119.18 -68.54 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.114 -0.494 . . . . 74.54 110.644 -178.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -70.85 -19.44 62.64 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.044 -0.526 . . . . 75.54 111.291 -177.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.467 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 50.4 t30 -59.2 -51.1 71.44 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 116.117 -0.492 . . . . 74.32 110.965 -178.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 133' ' ' ILE . . . . . 0.595 HG22 ' HB3' ' A' ' 79' ' ' LEU . 4.0 mp -67.88 -34.09 65.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.367 0.603 . . . . 73.03 110.563 -177.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.607 HD13 HD22 ' A' ' 49' ' ' LEU . 92.4 mt -73.47 -25.24 60.39 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.834 -0.621 . . . . 74.43 111.985 -175.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . 0.586 ' HG3' ' N ' ' B' ' 136' ' ' GLU . 3.5 ptp180 -75.96 -40.43 53.96 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.54 -0.464 . . . . 74.35 109.82 175.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 136' ' ' GLU . . . . . 0.586 ' N ' ' HG3' ' B' ' 135' ' ' ARG . 10.4 mm-40 -58.7 -45.51 89.35 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.355 -0.839 . . . . 62.03 111.142 -179.183 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -95.81 5.83 50.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.783 -0.644 . . . . 64.23 111.323 -175.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 52.54 70.11 0.61 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.512 -0.767 . . . . 73.21 112.742 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -96.09 4.88 52.21 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.55 -0.75 . . . . 74.32 109.989 172.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 55.57 67.69 2.87 Favored Pre-proline 0 C--O 1.232 0.155 0 CA-C-N 115.023 -0.989 . . . . 74.43 111.238 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . 0.527 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 90.1 Cg_endo -88.2 165.31 6.93 Favored 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 122.528 2.152 . . . . 74.2 112.415 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -93.04 172.75 8.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.816 -0.629 . . . . 73.41 109.512 175.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 143' ' ' PHE . . . . . 0.442 ' CA ' HG11 ' A' ' 47' ' ' VAL . 64.1 t80 179.24 -32.72 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.582 0.706 . . . . 75.34 110.237 -170.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . 0.412 HD22 ' N ' ' B' ' 144' ' ' LEU . 3.0 mm? -80.57 99.3 8.02 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.165 -0.925 . . . . 73.54 109.749 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 145' ' ' CYS . . . . . 0.622 ' SG ' HG21 ' A' ' 47' ' ' VAL . 13.5 p -117.47 175.8 5.46 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.791 -0.64 . . . . 71.22 110.443 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 -83.52 81.88 8.54 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.079 0.466 . . . . 75.04 110.41 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 31.1 t -84.77 152.27 3.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.445 -0.798 . . . . 75.43 109.718 178.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . 0.582 ' H ' ' HD3' ' B' ' 148' ' ' LYS . 0.3 OUTLIER -110.75 130.28 55.62 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 109.123 -0.695 . . . . 73.43 109.123 176.501 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.708 ' HB3' ' HD1' ' B' ' 151' ' ' PHE . 9.7 mp -71.65 90.61 1.05 Allowed 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.51 -0.768 . . . . 74.21 110.511 -178.233 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.684 ' HB2' ' HD3' ' A' ' 42' ' ' LYS . . . -87.7 68.29 9.43 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.621 -0.511 . . . . 70.52 109.621 174.654 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 151' ' ' PHE . . . . . 0.708 ' HD1' ' HB3' ' B' ' 149' ' ' LEU . 53.5 p90 -100.17 164.91 11.76 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.763 -0.653 . . . . 72.44 110.622 -176.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 5.3 tppp? -93.98 120.16 33.86 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.744 -0.662 . . . . 74.24 110.431 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 153' ' ' CYS . . . . . 0.476 ' SG ' ' HE2' ' B' ' 169' ' ' PHE . 43.5 t -125.77 108.77 11.82 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 116.448 -0.342 . . . . 61.55 110.528 177.316 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 2.0 t70 68.8 10.25 7.8 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.527 -0.76 . . . . 71.24 111.852 170.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 119.99 -19.94 9.35 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.314 -0.946 . . . . 75.24 112.824 179.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 156' ' ' GLU . . . . . 0.571 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 9.9 pt-20 -112.95 139.04 48.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.798 0.333 . . . . 75.43 110.284 178.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 44.0 mm -75.48 118.4 21.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.216 -0.447 . . . . 74.44 109.919 177.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 158' ' ' LYS . . . . . 0.571 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 31.7 mmmt -107.78 94.52 5.12 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.557 -0.292 . . . . 70.44 110.896 -175.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 159' ' ' THR . . . . . 0.488 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.7 OUTLIER -74.44 117.21 15.99 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.954 0.406 . . . . 63.32 110.852 177.852 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 160' ' ' PHE . . . . . 0.512 ' CD2' HD12 ' B' ' 166' ' ' LEU . 41.4 m-85 -126.29 120.09 29.07 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.139 -0.482 . . . . 74.43 110.003 176.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 25.5 p -101.1 6.7 43.37 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.378 0.609 . . . . 73.33 109.844 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -150.29 162.22 40.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.322 -0.854 . . . . 71.52 110.137 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . 0.586 HD12 HG11 ' A' ' 30' ' ' VAL . 35.3 tp -96.28 -1.61 47.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.171 0.51 . . . . 74.11 111.151 -176.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 164' ' ' GLN . . . . . 0.815 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 61.5 tt0 -81.42 -52.03 7.69 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.727 -0.472 . . . . 72.43 109.727 -178.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 3.2 m -67.25 -28.56 68.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.576 -0.738 . . . . 72.21 110.104 177.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . 0.512 HD12 ' CD2' ' B' ' 160' ' ' PHE . 43.5 tp -64.54 -39.47 93.82 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.16 -0.473 . . . . 75.21 110.258 178.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 75.2 ttt180 -65.04 -38.0 89.44 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.818 -0.438 . . . . 75.24 109.818 175.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 168' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' B' ' 164' ' ' GLN . 13.1 mmmm -56.51 -36.95 69.76 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.583 -0.735 . . . . 72.42 110.576 179.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 169' ' ' PHE . . . . . 0.518 ' O ' ' HG2' ' B' ' 173' ' ' LYS . 58.0 t80 -89.54 -47.73 7.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.463 -0.79 . . . . 74.14 110.945 -177.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.18 -33.18 74.05 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.664 0.616 . . . . 75.23 112.664 -176.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 6.5 t -67.54 -20.13 65.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.658 0.266 . . . . 50.31 111.441 -175.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -105.49 -3.2 22.75 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.913 0.387 . . . . 75.42 110.534 179.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 173' ' ' LYS . . . . . 0.579 ' HB2' ' HB2' ' B' ' 176' ' ' MET . 29.8 mmmt -87.23 129.89 34.79 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.176 -0.466 . . . . 63.34 111.017 -178.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 3.5 m -56.66 -45.6 81.56 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.701 -0.681 . . . . 61.04 110.593 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 175' ' ' SER . . . . . 0.463 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 40.1 t -82.92 -49.17 9.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.018 -0.537 . . . . 73.41 111.703 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 176' ' ' MET . . . . . 0.579 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 66.1 mtp -70.75 -20.53 62.62 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.405 0.52 . . . . 74.31 112.405 -169.324 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . 0.494 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 88.8 tttt -62.11 -35.01 77.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.982 0.42 . . . . 74.52 110.641 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . 0.454 ' HA ' ' HD3' ' B' ' 181' ' ' LYS . 25.9 mm-40 -91.22 -8.76 47.56 Favored 'General case' 0 CA--C 1.511 -0.519 0 CA-C-O 121.619 0.723 . . . . 73.53 110.213 -176.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 179' ' ' LEU . . . . . 0.619 ' HB3' HG22 ' A' ' 33' ' ' ILE . 81.2 mt -89.9 -48.41 7.24 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.883 -1.053 . . . . 75.32 109.798 178.535 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 180' ' ' LEU . . . . . 0.651 ' HB3' HD11 ' B' ' 184' ' ' LEU . 4.2 mm? -86.17 -11.05 53.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.574 -0.739 . . . . 72.44 111.778 -176.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 181' ' ' LYS . . . . . 0.494 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 64.1 pttt -55.71 -18.3 7.83 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 111.625 0.232 . . . . 73.24 111.625 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -60.16 -46.85 88.27 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.821 0.343 . . . . 75.11 110.879 177.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 17.4 m -105.98 -14.46 9.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.128 -0.487 . . . . 74.13 111.375 -176.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 184' ' ' LEU . . . . . 0.651 HD11 ' HB3' ' B' ' 180' ' ' LEU . 8.2 mp -81.95 137.09 46.87 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 109.739 -0.467 . . . . 74.0 109.739 176.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 185' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' B' ' 184' ' ' LEU . 12.6 Cg_exo -70.14 74.75 1.43 Allowed 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 122.823 2.348 . . . . 72.32 112.108 179.464 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -130.64 158.78 39.11 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.721 -0.672 . . . . 74.43 109.901 178.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp 54.77 80.87 0.12 Allowed 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.37 1.044 . . . . 74.21 112.406 175.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 . . . . . 0 C--O 1.247 0.967 0 CA-C-N 115.08 -0.964 . . . . 75.3 109.672 175.597 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.795 0 N-CA-C 111.496 -0.642 . . . . 45.3 111.496 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 3.4 p -150.4 110.7 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.512 0.672 . . . . 72.14 110.765 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -104.15 137.19 42.44 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.758 -0.656 . . . . 74.11 110.016 178.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.416 ' SD ' ' N ' ' A' ' 4' ' ' MET . 0.1 OUTLIER -94.3 25.41 3.85 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.89 -0.596 . . . . 64.0 110.572 179.969 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -96.7 150.42 20.7 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.311 -0.859 . . . . 71.43 110.704 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -115.32 83.31 1.9 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.92 -0.771 . . . . 72.34 108.92 172.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -105.13 30.17 10.41 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.474 -0.785 . . . . 74.21 112.283 -176.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -101.85 84.97 2.62 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.672 -0.492 . . . . 75.23 109.672 177.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 58.1 t -125.3 119.92 56.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.669 -0.696 . . . . 73.51 110.23 -175.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.697 HD12 HE22 ' B' ' 126' ' ' GLN . 1.6 pp -90.24 153.57 20.38 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.943 -0.571 . . . . 73.34 110.955 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 13.1 t -146.58 -173.49 4.22 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.208 -0.664 . . . . 75.12 109.208 178.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.0 pp -114.54 156.76 24.03 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.278 0.561 . . . . 75.24 111.155 177.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.622 ' HB1' ' HA ' ' A' ' 17' ' ' SER . . . -82.44 -167.15 1.48 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.146 -0.934 . . . . 75.01 111.753 -176.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.9 -39.1 2.75 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.111 -0.495 . . . . 72.25 110.751 176.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -90.18 -44.98 9.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.954 -0.566 . . . . 71.24 110.661 178.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.425 ' C ' ' HB1' ' A' ' 13' ' ' ALA . 23.0 tp -119.7 53.34 1.05 Allowed 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 107.608 -1.256 . . . . 71.54 107.608 175.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.622 ' HA ' ' HB1' ' A' ' 13' ' ' ALA . 2.5 m -43.43 -39.65 3.36 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 114.609 -1.178 . . . . 75.04 113.196 -169.363 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.3 p -170.7 158.58 6.16 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.8 -0.636 . . . . 75.34 110.677 -174.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -152.1 108.7 3.46 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.453 -0.339 . . . . 55.44 110.692 178.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 14.5 t -96.74 -5.08 39.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.633 0.73 . . . . 73.31 109.447 175.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 59.0 tp -131.79 116.56 17.41 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.16 -0.927 . . . . 65.45 109.769 178.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.418 ' OD2' ' HD2' ' A' ' 25' ' ' LYS . 2.3 p-10 -84.87 126.04 33.14 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.253 0.549 . . . . 75.32 110.628 179.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 9.0 tt -81.71 -51.17 15.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.916 -0.584 . . . . 71.21 111.483 -176.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.3 t -113.53 109.03 17.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.396 0.617 . . . . 75.4 111.901 -173.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.418 ' HD2' ' OD2' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -115.13 67.72 0.7 Allowed 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.249 -0.887 . . . . 74.4 109.346 171.473 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -73.77 -12.95 60.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.681 -0.691 . . . . 73.52 110.636 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 90.5 m95 -99.31 -156.13 0.53 Allowed 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.557 -0.747 . . . . 74.11 109.236 174.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.9 p 56.69 6.34 0.28 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.296 1.039 . . . . 73.12 113.683 178.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.63 ' HB3' HG23 ' B' ' 183' ' ' VAL . 47.0 t30 -78.6 69.26 4.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.664 0.745 . . . . 75.41 109.613 176.259 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.673 HG13 HD11 ' B' ' 180' ' ' LEU . 46.1 t -119.16 -46.27 3.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.206 -0.906 . . . . 75.1 109.748 179.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -56.35 -43.45 79.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.683 -0.689 . . . . 72.23 110.44 178.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.523 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 8.5 t30 -60.0 -51.7 68.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.629 -0.714 . . . . 75.22 110.698 178.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.471 HG22 ' OD1' ' A' ' 37' ' ' ASN . 50.1 mm -58.67 -53.59 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 116.39 -0.368 . . . . 74.24 110.718 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 88.7 mt -54.92 -32.55 61.25 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.148 -0.478 . . . . 73.34 111.759 -178.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 34.6 ttt180 -69.29 -41.28 77.0 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.854 -0.339 . . . . 74.42 110.361 176.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 30.2 mt-10 -68.69 -35.53 77.31 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.299 -0.41 . . . . 71.04 110.353 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.471 ' OD1' HG22 ' A' ' 33' ' ' ILE . 4.3 m120 -73.48 -13.62 61.09 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.122 -0.49 . . . . 72.35 109.806 177.152 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.4 t70 68.4 36.4 3.02 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.202 -0.908 . . . . 73.33 110.982 -178.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -75.67 -22.92 56.26 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.848 -0.615 . . . . 73.41 109.522 172.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 60.31 82.66 0.22 Allowed Pre-proline 0 N--CA 1.463 0.191 0 CA-C-N 114.806 -1.088 . . . . 72.33 111.046 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.749 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 60.1 Cg_endo -87.83 178.24 3.28 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.878 2.385 . . . . 75.24 111.929 177.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.25 149.19 43.23 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.744 0.307 . . . . 73.12 110.989 -177.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.456 ' HA ' HG11 ' B' ' 147' ' ' VAL . 78.4 t80 -162.33 84.53 0.56 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.62 -0.718 . . . . 71.12 109.37 -174.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -87.9 80.63 7.75 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.143 0.496 . . . . 75.03 110.391 -178.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 42.5 t -132.52 81.87 1.98 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.785 -0.643 . . . . 74.14 109.807 -179.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.88 23.3 1.56 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.537 -0.756 . . . . 64.33 109.288 178.273 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.576 HG12 ' HB2' ' B' ' 145' ' ' CYS . 4.6 m -66.75 154.93 7.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.774 -1.103 . . . . 71.33 112.047 -167.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -131.62 133.8 45.33 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 107.737 -1.209 . . . . 74.15 107.737 176.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 35.5 tp -79.96 68.42 6.07 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.497 -0.927 . . . . 74.3 108.497 173.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.592 ' HB2' HG23 ' A' ' 59' ' ' THR . . . -84.3 97.86 9.68 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 114.892 -1.049 . . . . 60.44 110.616 -176.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -111.39 165.99 11.49 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.974 -0.557 . . . . 74.2 110.376 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -90.28 124.9 35.27 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.139 -0.482 . . . . 71.54 110.275 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 14.7 t -138.54 116.88 11.94 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.777 -0.453 . . . . 71.5 109.777 178.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 64.63 16.22 10.2 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.714 0.635 . . . . 63.34 112.714 176.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 107.69 -17.5 36.0 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.068 -1.063 . . . . 74.51 112.412 177.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -111.78 146.66 37.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.777 0.323 . . . . 72.51 110.433 177.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 45.2 mm -79.84 126.9 39.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.165 -0.47 . . . . 74.11 110.14 178.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.469 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 27.6 mmmt -107.33 117.3 33.71 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.113 -0.329 . . . . 74.11 110.113 -179.134 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.592 HG23 ' HB2' ' A' ' 50' ' ' ALA . 2.6 p -93.91 123.88 37.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.166 -0.47 . . . . 74.33 111.044 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.444 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 71.9 m-85 -131.2 135.2 47.19 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.303 -0.408 . . . . 72.33 111.21 178.436 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.7 p -126.55 -5.02 6.51 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.826 -0.624 . . . . 64.24 109.983 175.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -125.32 130.57 52.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.724 -0.671 . . . . 75.33 110.181 178.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.615 HD23 ' HA ' ' B' ' 128' ' ' SER . 10.1 mp -73.72 -33.23 64.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.443 . . . . 74.55 111.665 -175.298 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -60.43 -46.04 91.47 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.32 0.581 . . . . 74.25 110.474 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.0 t -61.54 -46.89 88.01 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.717 -0.674 . . . . 64.32 110.533 177.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.644 HD21 HG11 ' B' ' 130' ' ' VAL . 48.3 tp -65.95 -36.61 83.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.015 -0.538 . . . . 74.51 111.436 -177.048 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -56.78 -41.5 77.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.079 0.466 . . . . 73.13 110.541 176.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.549 ' HZ2' ' HB2' ' A' ' 68' ' ' LYS . 10.4 mtmp? -69.94 -30.86 68.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.891 -0.595 . . . . 74.23 111.08 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.521 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 46.9 t80 -74.49 -45.75 43.93 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.94 -0.573 . . . . 74.4 110.647 -178.198 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.41 -27.53 67.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.295 -0.412 . . . . 74.23 111.364 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 43.8 t -67.29 -42.18 84.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.302 -0.408 . . . . 63.31 111.371 -178.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 13.9 pt20 -73.96 -25.04 59.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.123 0.487 . . . . 74.54 110.618 -176.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.589 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 71.1 mmtt -70.57 139.31 51.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.928 -0.578 . . . . 74.3 110.374 178.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 29.2 m -75.39 -39.87 58.59 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.993 0.425 . . . . 72.53 110.576 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.421 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 15.7 m -78.06 -50.49 11.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.212 -0.449 . . . . 64.24 111.136 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.589 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 83.4 mtp -67.78 -19.86 65.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 75.4 111.792 -174.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.635 ' HB2' ' HZ3' ' A' ' 77' ' ' LYS . 4.6 ttmp? -58.79 -35.3 72.59 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.023 0.439 . . . . 72.51 110.769 177.068 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.407 ' O ' ' HE3' ' A' ' 81' ' ' LYS . 35.6 mt-10 -100.74 2.02 40.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.135 0.493 . . . . 74.12 110.333 -176.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.435 ' HB3' ' CG2' ' B' ' 133' ' ' ILE . 68.0 mt -89.0 -48.61 7.31 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.859 -0.609 . . . . 72.54 110.094 177.163 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.768 HD13 HG12 ' B' ' 130' ' ' VAL . 3.5 mm? -90.94 7.54 39.67 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.708 -0.678 . . . . 75.25 111.218 -176.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.45 ' HA ' HE21 ' A' ' 86' ' ' GLN . 21.3 pttp -56.19 -24.48 42.0 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.532 -0.758 . . . . 74.42 112.112 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -81.06 -9.11 59.87 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 111.997 0.369 . . . . 62.14 111.997 -175.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.653 HG13 ' HB3' ' B' ' 129' ' ' ASN . 12.6 m -127.0 -33.42 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 C-N-CA 120.983 -0.287 . . . . 72.34 111.422 178.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.649 HD11 ' HB3' ' A' ' 80' ' ' LEU . 10.3 mp -83.26 130.07 58.24 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.629 -0.26 . . . . 74.14 110.402 178.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -56.97 110.48 0.6 Allowed 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.84 2.36 . . . . 75.13 111.877 178.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.45 HE21 ' HA ' ' A' ' 81' ' ' LYS . 82.5 mm-40 -90.51 -161.16 0.77 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.515 -0.766 . . . . 74.44 110.773 -178.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.415 ' H ' ' HB3' ' A' ' 86' ' ' GLN . 25.5 pttm -67.68 -23.19 65.28 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.99 -0.55 . . . . 74.53 110.952 -177.378 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 . . . . . 0 N--CA 1.442 -0.847 0 CA-C-N 116.1 -0.5 . . . . 74.31 110.575 -174.723 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 N-CA-C 112.273 -0.331 . . . . 63.45 112.273 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 49.0 t -77.34 115.89 19.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 120.797 0.332 . . . . 74.14 110.414 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 74.0 mt -99.8 112.04 24.32 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.934 0.397 . . . . 73.35 110.212 178.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.56 6.77 9.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.621 -0.718 . . . . 72.41 110.775 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -95.45 133.98 38.81 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.645 -0.707 . . . . 75.33 109.971 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -105.23 109.36 21.32 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.14 -0.318 . . . . 65.14 110.14 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -100.65 -93.01 2.13 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.441 -0.885 . . . . 72.22 113.351 -174.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -89.04 104.6 17.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.958 0.409 . . . . 73.5 111.354 -173.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 46.6 t -95.54 -56.6 5.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.012 -0.54 . . . . 74.32 110.134 178.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 3.7 pp -168.03 159.22 11.03 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.258 -0.883 . . . . 75.2 110.947 -179.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 11.8 t -154.28 -176.94 6.12 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.034 -0.728 . . . . 64.33 109.034 178.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . 0.577 HD11 ' HB3' ' B' ' 117' ' ' SER . 4.5 pp -126.44 155.82 41.61 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.914 0.387 . . . . 74.11 110.529 177.182 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 113' ' ' ALA . . . . . 0.664 ' HB1' ' HA ' ' B' ' 117' ' ' SER . . . -76.6 -170.83 1.66 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.659 -0.701 . . . . 72.52 112.396 -173.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -117.67 -49.02 2.56 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.202 -0.453 . . . . 75.1 110.94 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -73.83 -58.99 2.93 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.335 -0.617 . . . . 74.22 109.335 177.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.452 ' O ' ' HB1' ' B' ' 113' ' ' ALA . 3.4 mm? -116.29 80.6 1.48 Allowed 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.508 -0.923 . . . . 74.21 108.508 174.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.664 ' HA ' ' HB1' ' B' ' 113' ' ' ALA . 5.3 m -66.68 -9.56 37.42 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.475 -0.784 . . . . 72.15 112.801 -168.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 6.3 p -152.28 139.58 19.42 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.56 -0.291 . . . . 74.23 110.984 -178.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -107.28 134.1 50.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.29 -0.413 . . . . 71.32 110.784 178.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 64.4 m -115.7 -45.77 2.88 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.799 0.809 . . . . 74.22 110.33 178.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 45.6 tp -138.52 156.11 47.8 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 114.512 -1.222 . . . . 75.3 109.181 176.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -74.46 159.29 32.47 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.165 0.507 . . . . 64.35 110.955 -177.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 12.3 tt -96.64 -35.65 5.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.801 -0.636 . . . . 74.15 110.238 175.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 23.3 t -170.96 122.71 0.58 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.267 -0.424 . . . . 74.23 110.657 -179.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . 0.588 ' HD3' ' H ' ' B' ' 125' ' ' LYS . 0.0 OUTLIER -114.46 80.39 1.39 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.677 0.751 . . . . 74.31 109.544 172.113 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 126' ' ' GLN . . . . . 0.697 HE22 HD12 ' A' ' 10' ' ' LEU . 27.9 mm-40 -84.03 -1.99 55.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.459 -0.791 . . . . 75.54 110.703 179.511 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -98.86 -167.37 1.48 Allowed 'General case' 0 N--CA 1.441 -0.912 0 N-CA-C 109.54 -0.541 . . . . 75.35 109.54 176.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 128' ' ' SER . . . . . 0.615 ' HA ' HD23 ' A' ' 63' ' ' LEU . 23.1 t 65.06 5.86 3.18 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.378 -0.828 . . . . 72.51 111.594 -178.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . 0.653 ' HB3' HG13 ' A' ' 83' ' ' VAL . 59.9 t30 -83.38 76.94 9.88 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 121.551 0.691 . . . . 71.34 110.291 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.768 HG12 HD13 ' A' ' 80' ' ' LEU . 54.6 t -129.06 -38.04 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.018 -0.992 . . . . 74.11 109.296 176.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 131' ' ' PHE . . . . . 0.445 ' HE1' HH11 ' B' ' 135' ' ' ARG . 53.0 t80 -54.83 -45.77 74.5 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.119 -0.946 . . . . 73.12 110.126 178.118 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.607 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 6.4 t30 -57.92 -48.92 78.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.934 -0.576 . . . . 75.31 111.439 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 133' ' ' ILE . . . . . 0.435 ' CG2' ' HB3' ' A' ' 79' ' ' LEU . 2.4 mp -61.49 -47.52 93.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 CA-C-O 121.056 0.455 . . . . 72.35 110.691 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 87.1 mt -62.65 -31.32 72.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.945 -0.57 . . . . 65.4 110.543 178.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . 0.445 HH11 ' HE1' ' B' ' 131' ' ' PHE . 24.9 ttt180 -73.02 -42.07 63.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.159 -0.473 . . . . 75.43 110.762 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 136' ' ' GLU . . . . . 0.607 ' HG3' ' O ' ' B' ' 132' ' ' ASN . 41.2 mt-10 -60.07 -47.08 87.34 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.204 0.526 . . . . 75.32 110.8 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -86.83 -0.71 56.93 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.693 -0.685 . . . . 74.41 111.083 -177.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 25.6 t0 57.92 67.91 0.9 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.382 -0.826 . . . . 73.42 111.894 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -96.53 -3.91 42.3 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.193 -0.912 . . . . 73.43 109.032 169.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 55.69 78.07 0.4 Allowed Pre-proline 0 C--O 1.232 0.161 0 CA-C-N 114.566 -1.197 . . . . 72.55 111.275 -176.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . 0.413 ' C ' ' HD2' ' B' ' 142' ' ' LYS . 92.8 Cg_endo -82.99 163.41 15.65 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 123.076 2.517 . . . . 73.55 111.432 176.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 142' ' ' LYS . . . . . 0.413 ' HD2' ' C ' ' B' ' 141' ' ' PRO . 0.8 OUTLIER -122.59 148.98 44.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.096 0.474 . . . . 71.44 111.321 -175.437 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -167.79 82.07 0.19 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.408 -0.815 . . . . 74.34 109.561 -178.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -90.37 40.8 1.02 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.849 -0.614 . . . . 72.24 110.42 -177.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 145' ' ' CYS . . . . . 0.576 ' HB2' HG12 ' A' ' 47' ' ' VAL . 46.5 t -100.38 91.42 4.7 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.112 0.482 . . . . 71.32 111.277 -175.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -125.57 80.88 1.93 Allowed 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.756 -0.831 . . . . 74.41 108.756 170.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 147' ' ' VAL . . . . . 0.456 HG11 ' HA ' ' A' ' 43' ' ' PHE . 61.2 t -88.62 111.04 21.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.254 -0.884 . . . . 74.12 111.321 -171.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.16 135.29 46.27 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.544 -0.91 . . . . 74.41 108.544 172.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 5.4 mp -73.92 86.83 1.78 Allowed 'General case' 0 C--N 1.317 -0.816 0 O-C-N 123.244 0.34 . . . . 75.11 110.104 177.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.574 ' HA ' ' O ' ' B' ' 158' ' ' LYS . . . -91.58 97.61 11.15 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.414 -0.812 . . . . 75.52 109.561 174.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 151' ' ' PHE . . . . . 0.749 ' HB3' ' HA ' ' A' ' 41' ' ' PRO . 47.4 p90 -132.55 166.55 21.83 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.087 -0.506 . . . . 71.02 110.817 -176.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -94.23 114.03 26.06 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.133 -0.485 . . . . 74.11 110.053 178.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 153' ' ' CYS . . . . . 0.46 ' HB2' ' HE1' ' B' ' 151' ' ' PHE . 49.0 t -126.32 120.8 30.83 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.095 -0.502 . . . . 73.12 110.166 178.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 19.6 t70 70.48 6.0 5.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.875 -0.602 . . . . 73.5 111.789 170.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 111.19 -6.4 28.75 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.502 -0.856 . . . . 63.23 112.316 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 156' ' ' GLU . . . . . 0.499 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 12.6 pt-20 -120.91 145.74 47.36 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 110.023 -0.362 . . . . 74.31 110.023 177.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 42.5 mm -77.92 126.94 38.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 109.723 -0.473 . . . . 71.5 109.723 176.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 158' ' ' LYS . . . . . 0.574 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 29.1 mmmt -109.78 137.52 47.46 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.872 -0.418 . . . . 74.25 109.872 179.431 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.01 104.6 8.99 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 123.194 0.309 . . . . 73.34 110.791 178.443 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 160' ' ' PHE . . . . . 0.578 ' CD2' HD12 ' B' ' 166' ' ' LEU . 94.9 m-85 -117.11 122.62 44.62 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.782 -0.367 . . . . 72.44 111.017 178.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 10.5 p -92.81 -5.78 50.34 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.161 -0.472 . . . . 53.0 110.557 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -132.81 157.1 45.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.872 -0.604 . . . . 72.22 109.884 177.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -89.18 -16.84 30.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.274 -0.421 . . . . 71.13 111.055 -177.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 164' ' ' GLN . . . . . 0.404 ' O ' ' HG3' ' B' ' 168' ' ' LYS . 6.2 tp60 -67.94 -51.45 47.57 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.418 -0.355 . . . . 74.41 111.12 -176.573 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 165' ' ' SER . . . . . 0.927 ' HA ' ' HE3' ' B' ' 168' ' ' LYS . 11.5 t -69.6 -34.15 73.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.852 0.358 . . . . 71.0 110.38 -178.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . 0.578 HD12 ' CD2' ' B' ' 160' ' ' PHE . 33.5 tp -68.02 -35.13 77.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.975 0.416 . . . . 75.12 110.515 177.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -62.41 -37.07 84.37 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.11 -0.495 . . . . 74.13 110.464 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 168' ' ' LYS . . . . . 0.927 ' HE3' ' HA ' ' B' ' 165' ' ' SER . 9.2 mtmp? -67.19 -42.87 83.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.866 -0.606 . . . . 74.31 110.295 175.406 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 169' ' ' PHE . . . . . 0.424 ' HA ' ' HG2' ' B' ' 172' ' ' GLN . 63.9 t80 -64.89 -44.28 90.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.5 -0.773 . . . . 75.34 110.755 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -59.1 -31.36 68.85 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.156 -0.475 . . . . 74.53 110.93 177.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 26.3 t -72.34 -41.84 66.04 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.822 -0.626 . . . . 75.51 111.003 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . 0.424 ' HG2' ' HA ' ' B' ' 169' ' ' PHE . 19.2 pt20 -77.34 -22.64 51.54 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.952 0.406 . . . . 70.44 110.781 -176.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 173' ' ' LYS . . . . . 0.854 ' HE2' ' HA ' ' B' ' 173' ' ' LYS . 9.1 mmpt? -75.75 142.68 42.32 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.813 -0.44 . . . . 72.52 109.813 173.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 19.9 m -80.25 -42.46 23.14 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.749 -0.463 . . . . 62.4 109.749 177.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 175' ' ' SER . . . . . 0.522 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 47.4 m -69.49 -50.44 45.25 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.413 -0.358 . . . . 73.42 110.863 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 176' ' ' MET . . . . . 0.702 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 68.0 mtp -63.11 -27.66 69.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.201 -0.454 . . . . 74.35 112.064 -174.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . 0.569 ' HZ2' ' HB2' ' B' ' 177' ' ' LYS . 4.3 ttmp? -62.36 -28.66 69.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.008 0.432 . . . . 74.0 110.691 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -100.63 1.04 40.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.281 0.562 . . . . 75.21 110.616 -176.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 179' ' ' LEU . . . . . 0.678 HD11 ' HA ' ' B' ' 176' ' ' MET . 77.2 mt -95.32 -55.67 2.97 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.419 -0.81 . . . . 74.0 109.832 178.291 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 180' ' ' LEU . . . . . 0.673 HD11 HG13 ' A' ' 30' ' ' VAL . 3.2 mm? -78.98 -6.65 56.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.378 -0.828 . . . . 65.5 111.881 -176.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -55.36 -19.22 8.29 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.436 0.532 . . . . 73.45 112.436 -176.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -60.23 -36.82 78.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.967 0.413 . . . . 74.1 111.125 179.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 183' ' ' VAL . . . . . 0.63 HG23 ' HB3' ' A' ' 29' ' ' ASN . 13.2 m -123.06 -17.32 4.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.314 -0.403 . . . . 75.3 111.743 -179.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 184' ' ' LEU . . . . . . . . . . . . . 10.2 mp -99.55 109.1 54.02 Favored Pre-proline 0 C--N 1.327 -0.397 0 N-CA-C 109.723 -0.473 . . . . 73.24 109.723 177.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -63.02 104.83 0.41 Allowed 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 123.079 2.519 . . . . 75.41 112.581 -177.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 74.9 mm-40 -83.81 -143.32 0.07 Allowed 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.568 -0.901 . . . . 74.12 108.568 174.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 23.3 pttm -57.21 -32.52 66.59 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.029 -0.73 . . . . 74.44 109.029 170.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.345 -0.836 . . . . 72.23 109.269 172.296 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.689 0 N-CA-C 111.719 -0.552 . . . . 62.23 111.719 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.4 p -150.05 127.01 2.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.674 -0.491 . . . . 73.34 109.674 177.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -87.69 96.56 10.48 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.283 -0.417 . . . . 64.35 110.948 -174.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.2 mmt -88.99 101.24 13.89 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.143 -0.688 . . . . 74.4 109.143 174.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -98.94 140.4 33.16 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.941 -0.572 . . . . 74.21 111.043 -172.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -142.83 162.0 36.61 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.79 -0.641 . . . . 73.04 109.563 -176.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -85.49 -138.99 4.76 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.762 -0.733 . . . . 53.1 111.937 179.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.1 148.5 13.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.705 0.288 . . . . 75.55 110.332 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.3 t -89.87 119.11 36.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.073 -0.512 . . . . 74.22 109.981 177.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 11.2 mp -54.81 114.83 1.87 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.035 0.445 . . . . 72.25 110.923 178.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.549 ' HB ' ' HD3' ' B' ' 187' ' ' LYS . 63.5 m -140.92 134.07 29.45 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.667 -0.697 . . . . 74.33 110.187 -177.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.525 ' O ' HG23 ' A' ' 11' ' ' THR . 3.4 pp -74.79 151.87 39.05 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.619 -0.882 . . . . 74.03 108.619 170.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -51.32 126.88 18.14 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.318 0.488 . . . . 73.23 112.318 -173.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.34 -11.47 57.71 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.888 -0.597 . . . . 75.12 111.552 -177.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -88.32 12.49 13.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.375 0.607 . . . . 73.25 109.663 176.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.7 mt 62.63 35.62 14.14 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.348 -0.842 . . . . 74.04 110.649 179.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 26.5 m -95.71 33.7 1.61 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.772 -0.649 . . . . 75.11 111.593 -177.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.0 t -68.01 97.74 0.7 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.155 0.502 . . . . 71.42 110.086 176.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -86.67 -177.44 6.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.777 -0.647 . . . . 62.2 110.847 -177.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 18.4 m -126.52 120.2 29.06 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.434 -0.348 . . . . 72.41 110.682 -179.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.434 HD22 ' HA ' ' A' ' 21' ' ' LEU . 43.4 mt -75.39 102.18 5.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.33 0.586 . . . . 74.11 109.503 174.348 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.43 ' HB3' ' H ' ' A' ' 23' ' ' ILE . 10.7 t70 -90.64 -89.39 0.16 Allowed 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.264 -0.88 . . . . 73.4 111.839 -168.267 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.43 ' H ' ' HB3' ' A' ' 22' ' ' ASP . 12.8 tt -146.46 134.4 15.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.839 0.352 . . . . 73.45 111.171 -179.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.5 ' HB3' ' H ' ' B' ' 124' ' ' SER . 8.0 t -177.81 -174.78 0.47 Allowed 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.777 -0.647 . . . . 64.05 109.363 178.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.447 ' HB2' ' CZ2' ' B' ' 127' ' ' TRP . 0.6 OUTLIER -132.48 43.73 2.96 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.4 0.619 . . . . 75.4 110.452 -177.121 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 80.2 mm-40 -91.27 91.57 8.24 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.751 -0.659 . . . . 72.21 111.853 -173.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.409 ' HE3' ' C ' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -101.12 30.96 3.84 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.627 -0.715 . . . . 74.14 111.315 177.505 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.1 p -86.32 5.45 34.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.621 0.724 . . . . 75.42 110.31 -173.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.449 ' HB3' HG11 ' B' ' 183' ' ' VAL . 16.8 m120 -110.13 0.13 18.16 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.007 -0.997 . . . . 75.04 110.929 -178.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.455 ' C ' ' H ' ' A' ' 32' ' ' ASN . 46.6 t -93.83 129.49 44.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.101 -0.499 . . . . 60.44 110.563 -176.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 12.8 p90 57.28 -7.83 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 125.497 1.519 . . . . 74.2 114.461 174.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.501 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 11.8 t30 -58.12 -45.09 87.89 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 122.317 0.247 . . . . 73.1 111.578 -175.359 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.46 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 44.4 mm -60.16 -41.16 85.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.033 0.444 . . . . 72.12 111.399 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.547 HD12 HD23 ' B' ' 149' ' ' LEU . 88.3 mt -68.37 -27.57 66.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.189 -0.46 . . . . 75.32 110.691 -178.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -74.07 -34.67 64.11 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.123 -0.49 . . . . 73.54 109.95 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 5.8 mm-40 -71.52 -27.65 63.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.127 0.489 . . . . 73.05 110.736 178.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -101.55 4.37 40.97 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.15 -0.477 . . . . 73.43 111.04 -178.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 60.18 43.99 13.35 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.603 -0.726 . . . . 75.13 112.361 174.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.529 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 11.8 m-85 -77.74 -12.81 60.01 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.122 0.487 . . . . 74.21 109.995 171.182 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 58.9 73.85 0.66 Allowed Pre-proline 0 C--O 1.236 0.345 0 CA-C-N 114.99 -1.005 . . . . 71.41 110.859 -174.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -81.44 148.62 16.43 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.513 2.142 . . . . 74.25 111.304 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -104.83 138.46 41.06 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.133 0.492 . . . . 73.51 110.856 -177.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -146.05 31.24 1.03 Allowed 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.502 -0.925 . . . . 71.45 108.502 -175.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 29.5 tp -61.63 96.93 0.07 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.727 -1.124 . . . . 74.33 110.864 -177.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 41.5 t -102.04 82.87 2.28 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.736 -0.665 . . . . 71.31 110.095 -178.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -92.26 26.53 2.51 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.898 0.856 . . . . 75.23 109.293 176.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.532 HG11 ' HA ' ' B' ' 143' ' ' PHE . 61.6 t -74.41 115.78 16.05 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 CA-C-N 114.94 -1.027 . . . . 74.42 110.357 178.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.14 128.67 24.44 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.762 -0.458 . . . . 71.33 109.762 175.425 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.704 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.5 mp -67.92 88.42 0.26 Allowed 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.507 -0.769 . . . . 74.35 110.384 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.658 ' H ' ' HB2' ' B' ' 142' ' ' LYS . . . -85.17 58.05 4.81 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.851 -0.426 . . . . 73.54 109.851 176.113 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.704 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 51.5 p90 -86.02 162.55 18.43 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.982 -0.554 . . . . 75.45 110.731 -177.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.1 tptm -98.12 118.91 35.79 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.324 -0.853 . . . . 74.41 110.109 -176.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 46.5 t -120.18 99.89 6.86 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.917 0.389 . . . . 74.33 110.691 178.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 66.84 6.37 4.56 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.413 -0.812 . . . . 73.43 112.968 171.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 133.26 -27.58 3.4 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.403 -0.903 . . . . 72.23 112.636 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -107.86 139.33 42.62 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.253 0.549 . . . . 70.23 110.868 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 45.9 mm -77.37 123.41 33.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.473 -0.785 . . . . 75.11 109.939 178.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.417 ' HE2' ' CE1' ' A' ' 69' ' ' PHE . 30.9 mmmt -107.81 90.65 3.36 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 121.084 -0.246 . . . . 74.54 110.722 -177.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.58 110.09 7.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.33 -0.395 . . . . 70.24 111.572 -178.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -120.92 123.41 42.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.345 -0.388 . . . . 75.1 110.447 174.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 7.0 t -100.71 -4.31 28.48 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.396 0.617 . . . . 72.4 109.357 179.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -142.84 159.4 42.3 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.533 -0.758 . . . . 73.11 110.007 177.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 46.6 tp -87.14 -20.58 26.83 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.272 -0.422 . . . . 75.25 110.452 -175.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -61.6 -51.33 68.97 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.901 -0.591 . . . . 74.32 110.484 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.7 t -66.27 -36.82 83.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.818 -0.628 . . . . 63.21 110.429 178.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.463 HD21 ' O ' ' A' ' 66' ' ' LEU . 6.2 tt -66.1 -37.77 86.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.724 -0.671 . . . . 73.34 110.428 -178.213 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.832 ' HG3' HD21 ' A' ' 84' ' ' LEU . 55.3 ttp180 -57.65 -38.71 75.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 73.12 110.967 -179.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -63.39 -38.36 90.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 75.44 110.979 177.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.417 ' CE1' ' HE2' ' A' ' 58' ' ' LYS . 54.0 t80 -68.41 -47.86 66.17 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.082 -0.508 . . . . 73.24 110.554 -178.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.405 ' HA ' ' HB2' ' A' ' 73' ' ' LYS . . . -62.56 -28.74 70.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.828 0.347 . . . . 74.31 111.349 177.483 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 34.6 t -67.43 -31.15 71.14 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.143 -0.48 . . . . 63.23 111.084 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -100.76 6.71 43.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.353 0.597 . . . . 73.0 109.98 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.405 ' HB2' ' HA ' ' A' ' 70' ' ' ALA . 21.3 mmmt -112.54 102.9 10.96 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.369 -0.832 . . . . 64.35 110.584 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.475 ' O ' ' HB3' ' A' ' 77' ' ' LYS . 14.8 p -54.51 -38.74 66.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.331 -0.395 . . . . 62.41 111.591 -178.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.527 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 47.3 t -66.37 -49.61 66.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.796 0.331 . . . . 74.0 110.919 178.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 80.9 mtp -71.76 -22.22 61.63 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.931 0.396 . . . . 73.43 110.728 -175.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.475 ' HB3' ' O ' ' A' ' 74' ' ' SER . 29.3 tttp -53.82 -34.64 59.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.661 -0.699 . . . . 75.02 110.707 172.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.503 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 32.8 mm-40 -101.7 3.82 40.05 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.75 -0.659 . . . . 74.34 110.419 -175.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.575 HD22 ' ND2' ' B' ' 137' ' ' ASN . 53.2 mt -101.06 -47.26 4.81 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.17 -0.923 . . . . 73.41 109.168 175.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.0 mt -91.86 2.25 56.64 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.716 -0.675 . . . . 74.13 111.024 -175.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.503 ' HD2' ' HA ' ' A' ' 78' ' ' GLU . 20.8 ptmt -54.41 -20.72 8.0 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.146 -0.479 . . . . 70.3 112.278 178.125 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -82.27 -37.62 25.6 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.05 0.453 . . . . 65.31 110.945 178.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 24.3 t -79.75 -40.2 20.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.066 -0.515 . . . . 74.11 110.308 -178.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.832 HD21 ' HG3' ' A' ' 67' ' ' ARG . 10.6 mp -89.89 138.75 27.62 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 115.843 -0.617 . . . . 64.13 110.5 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -67.42 110.48 2.05 Favored 'Trans proline' 0 C--O 1.232 0.216 0 C-N-CA 122.706 2.271 . . . . 75.33 111.379 178.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 87.2 mm-40 -121.74 -176.36 3.3 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.206 0.527 . . . . 75.22 110.499 -176.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.758 ' HG3' ' HB ' ' B' ' 111' ' ' THR . 0.6 OUTLIER -143.47 39.62 1.42 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 122.133 0.968 . . . . 74.05 108.598 177.702 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 . . . . . 0 C--N 1.312 -1.038 0 CA-C-N 113.891 -1.504 . . . . 74.24 110.35 -176.983 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.423 0 N-CA-C 112.394 -0.282 . . . . 50.44 112.394 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 8.2 p -117.6 134.64 60.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 120.967 0.413 . . . . 75.21 110.715 -178.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' LEU . . . . . 0.455 ' O ' HD13 ' B' ' 103' ' ' LEU . 1.0 OUTLIER -127.56 144.72 51.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.006 0.431 . . . . 73.23 110.747 177.702 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 26.4 mmt -109.77 -30.03 8.04 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.964 -0.562 . . . . 75.11 109.968 -179.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 61.34 25.62 15.56 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.4 -0.818 . . . . 72.35 111.073 178.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -65.57 144.23 57.12 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.894 -1.048 . . . . 73.11 110.66 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -80.25 102.3 2.05 Favored Glycine 0 N--CA 1.44 -1.06 0 C-N-CA 121.228 -0.51 . . . . 65.24 112.531 -178.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -64.59 150.35 47.09 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.447 -0.376 . . . . 75.32 110.031 172.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 34.6 t -73.18 115.88 14.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.401 -0.363 . . . . 75.11 110.819 -175.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 110' ' ' LEU . . . . . 0.444 ' H ' HD12 ' B' ' 110' ' ' LEU . 6.5 mp -57.94 131.41 50.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.794 -0.639 . . . . 73.11 110.729 -179.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 111' ' ' THR . . . . . 0.758 ' HB ' ' HG3' ' A' ' 87' ' ' LYS . 34.4 m -153.13 134.66 14.4 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.241 -0.436 . . . . 71.02 110.446 -178.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . 0.423 ' O ' HG21 ' B' ' 111' ' ' THR . 3.4 pp -100.89 170.66 8.15 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.496 -0.927 . . . . 70.1 108.496 167.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 113' ' ' ALA . . . . . 0.541 ' HB1' ' H ' ' B' ' 117' ' ' SER . . . -52.87 128.84 28.29 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.753 0.311 . . . . 75.31 111.65 -177.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -94.44 -32.05 13.7 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.169 0.509 . . . . 74.43 110.486 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -91.18 -36.4 13.97 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.808 -0.633 . . . . 71.44 111.161 -177.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 82.0 mt -98.16 -49.5 4.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.022 0.439 . . . . 75.24 109.997 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.541 ' H ' ' HB1' ' B' ' 113' ' ' ALA . 9.6 m 52.41 75.41 0.23 Allowed 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 114.876 -1.056 . . . . 73.21 111.712 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 9.5 t -92.55 148.69 21.88 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.969 -0.56 . . . . 74.11 110.609 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -146.38 122.0 10.46 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.297 -0.411 . . . . 72.31 110.564 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 32.8 m -112.8 102.94 10.94 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.392 -0.367 . . . . 74.2 111.164 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 13.6 mt -158.91 143.0 15.43 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.693 -0.685 . . . . 75.23 110.438 177.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 122' ' ' ASP . . . . . 0.447 ' O ' ' HB2' ' A' ' 24' ' ' SER . 6.1 t70 -161.5 -153.59 0.3 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.514 -0.921 . . . . 74.44 108.514 -178.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 14.3 tt -107.48 130.32 59.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.707 -0.479 . . . . 72.15 109.707 173.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 124' ' ' SER . . . . . 0.5 ' H ' ' HB3' ' A' ' 24' ' ' SER . 10.7 t -178.45 -171.23 0.24 Allowed 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.538 -0.541 . . . . 74.32 109.538 -177.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . 0.564 ' HD3' ' N ' ' B' ' 125' ' ' LYS . 0.3 OUTLIER -136.84 84.3 2.06 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.676 -0.693 . . . . 75.41 110.011 -178.4 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 86.8 mm-40 -128.99 117.99 21.84 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.049 0.452 . . . . 73.42 111.833 -175.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 127' ' ' TRP . . . . . 0.447 ' CZ2' ' HB2' ' A' ' 25' ' ' LYS . 82.5 m95 -127.28 78.48 1.82 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.895 -0.78 . . . . 75.2 108.895 175.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 13.5 m -100.71 -30.37 11.77 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.269 -0.423 . . . . 71.41 111.439 -171.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 42.7 m-20 -98.92 32.2 2.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.358 -0.383 . . . . 74.24 111.961 -174.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.561 HG12 ' HD2' ' B' ' 131' ' ' PHE . 34.8 t -91.11 115.83 31.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 109.979 -0.378 . . . . 74.21 109.979 178.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 131' ' ' PHE . . . . . 0.584 ' HB3' HD21 ' A' ' 49' ' ' LEU . 26.0 p90 52.53 9.36 0.1 Allowed 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.921 1.288 . . . . 74.01 113.92 178.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -56.58 -55.12 37.88 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.85 0.357 . . . . 73.51 111.324 -177.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 133' ' ' ILE . . . . . 0.526 HG22 ' HB3' ' A' ' 79' ' ' LEU . 49.1 mm -58.11 -41.42 80.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.002 -0.544 . . . . 74.11 111.247 -178.252 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 84.5 mt -63.65 -36.97 85.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.02 -0.536 . . . . 75.12 110.906 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -72.42 -38.89 68.27 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.653 -0.249 . . . . 62.14 110.488 179.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -64.31 -43.14 95.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.241 -0.436 . . . . 64.11 111.282 179.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 137' ' ' ASN . . . . . 0.575 ' ND2' HD22 ' A' ' 79' ' ' LEU . 92.1 m-20 -92.21 7.61 41.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.161 -0.472 . . . . 73.44 111.227 -178.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 55.63 57.91 4.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.408 -0.815 . . . . 74.43 112.96 174.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -82.97 -10.1 58.96 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.595 -0.891 . . . . 70.43 108.595 165.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 59.6 71.8 0.87 Allowed Pre-proline 0 C--O 1.234 0.274 0 CA-C-N 114.204 -1.362 . . . . 75.42 110.828 -176.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . 0.529 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 89.1 Cg_endo -79.95 144.94 17.34 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.508 2.139 . . . . 75.11 111.591 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 142' ' ' LYS . . . . . 0.658 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 13.9 mptt -95.32 152.74 18.12 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.036 0.446 . . . . 70.54 110.448 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 143' ' ' PHE . . . . . 0.532 ' HA ' HG11 ' A' ' 47' ' ' VAL . 31.1 t80 -152.12 36.75 0.54 Allowed 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.205 -1.035 . . . . 73.41 108.205 -177.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 50.5 tp -62.67 100.1 0.18 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.769 -1.105 . . . . 74.25 109.846 -179.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 43.8 t -120.68 136.1 54.94 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.78 -0.645 . . . . 72.45 111.032 -172.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . 0.462 ' HB2' ' HE3' ' B' ' 148' ' ' LYS . 9.1 pt-20 -134.15 38.7 3.14 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.529 0.681 . . . . 70.33 109.259 172.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 92.3 t -75.05 96.5 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.637 -0.71 . . . . 72.02 110.005 178.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . 0.462 ' HE3' ' HB2' ' B' ' 146' ' ' GLU . 0.0 OUTLIER -141.76 131.47 24.15 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.055 -0.975 . . . . 74.41 109.758 177.179 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.754 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.5 mp -74.14 86.67 1.89 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.597 -0.729 . . . . 74.3 110.359 -178.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.485 ' HB2' HG22 ' B' ' 159' ' ' THR . . . -85.19 62.34 7.44 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.014 -0.539 . . . . 75.12 109.649 174.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 151' ' ' PHE . . . . . 0.754 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 49.6 p90 -92.09 164.01 13.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.015 -0.539 . . . . 74.21 110.737 -175.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -92.08 117.38 29.79 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.704 -0.68 . . . . 75.02 110.794 -178.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 153' ' ' CYS . . . . . 0.605 ' HB3' ' CG ' ' B' ' 158' ' ' LYS . 50.8 t -131.56 116.96 18.1 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.541 -0.3 . . . . 54.42 110.889 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 67.71 11.53 8.41 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.674 -0.694 . . . . 74.43 112.408 175.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 110.06 -16.24 30.37 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.407 -0.901 . . . . 65.15 112.572 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 156' ' ' GLU . . . . . 0.456 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 9.6 pt-20 -116.42 143.98 44.88 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.841 0.353 . . . . 75.34 110.41 177.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 43.5 mm -70.59 118.69 15.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.209 -0.451 . . . . 75.31 110.045 177.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 158' ' ' LYS . . . . . 0.605 ' CG ' ' HB3' ' B' ' 153' ' ' CYS . 31.5 mmmt -104.08 88.31 2.98 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.945 -0.391 . . . . 70.33 109.945 -179.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 159' ' ' THR . . . . . 0.485 HG22 ' HB2' ' B' ' 150' ' ' ALA . 0.2 OUTLIER -75.63 110.19 9.83 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.892 -0.595 . . . . 73.31 111.461 -175.965 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -121.8 124.41 44.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.521 -0.308 . . . . 75.23 111.009 178.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 161' ' ' SER . . . . . 0.448 ' HB2' ' HB3' ' B' ' 148' ' ' LYS . 9.5 t -106.38 0.61 25.05 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.038 -0.727 . . . . 73.53 109.038 176.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -121.28 124.18 44.0 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.499 -0.773 . . . . 71.51 110.339 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 55.2 tp -68.56 -32.77 72.93 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.149 -0.686 . . . . 72.04 109.149 175.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -59.62 -50.32 74.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.333 -0.849 . . . . 73.33 110.922 176.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 32.3 t -67.54 -39.6 85.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.203 -0.453 . . . . 72.2 110.432 -178.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . 0.418 HD21 ' O ' ' B' ' 166' ' ' LEU . 4.1 tt -65.71 -36.46 83.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.07 -0.514 . . . . 74.51 110.294 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . 0.541 ' HG3' HD11 ' B' ' 184' ' ' LEU . 43.3 ttp180 -62.78 -34.88 78.17 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.249 0.547 . . . . 72.01 110.062 179.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -66.66 -38.56 87.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.818 -0.628 . . . . 72.34 110.458 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 169' ' ' PHE . . . . . 0.493 ' CZ ' ' HE3' ' B' ' 173' ' ' LYS . 69.8 t80 -67.05 -46.38 74.54 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.424 -0.807 . . . . 72.44 110.661 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.61 -26.67 68.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.504 -0.316 . . . . 60.52 111.428 179.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 8.6 t -64.98 -27.84 69.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.241 -0.436 . . . . 72.03 110.59 -178.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -106.08 15.98 25.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.248 0.547 . . . . 74.44 110.33 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 173' ' ' LYS . . . . . 0.493 ' HE3' ' CZ ' ' B' ' 169' ' ' PHE . 64.1 mmtt -117.3 115.63 25.64 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.612 -0.722 . . . . 74.44 110.427 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.2 p -57.7 -41.44 81.68 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.909 0.385 . . . . 73.12 111.869 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 175' ' ' SER . . . . . 0.515 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 45.7 t -82.04 -47.08 13.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.827 0.346 . . . . 72.11 110.325 -178.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 176' ' ' MET . . . . . 0.465 ' HB2' ' CB ' ' B' ' 173' ' ' LYS . 70.9 mtp -67.47 -25.85 66.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.454 -0.339 . . . . 64.41 111.866 -174.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . 0.484 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 26.0 ttpp -62.11 -35.09 77.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.842 0.353 . . . . 73.03 110.558 176.152 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . 0.579 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 18.8 mm-40 -89.71 -12.11 40.39 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-O 121.661 0.743 . . . . 74.22 109.88 -175.134 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 179' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' B' ' 175' ' ' SER . 74.7 mt -82.08 -47.82 12.13 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.767 -1.106 . . . . 73.34 109.173 175.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 7.5 mt -94.27 0.92 55.95 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.764 -0.653 . . . . 72.42 111.451 -173.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 181' ' ' LYS . . . . . 0.579 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 17.8 ptmt -58.6 -8.44 1.26 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 112.083 0.401 . . . . 74.3 112.083 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -68.29 -37.01 80.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.021 0.438 . . . . 74.1 110.411 175.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 183' ' ' VAL . . . . . 0.45 HG23 HD13 ' B' ' 184' ' ' LEU . 31.2 m -104.47 -15.29 8.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.15 -0.477 . . . . 73.4 111.198 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 184' ' ' LEU . . . . . 0.541 HD11 ' HG3' ' B' ' 167' ' ' ARG . 11.1 mp -84.81 136.85 38.53 Favored Pre-proline 0 C--N 1.325 -0.488 0 N-CA-C 109.676 -0.49 . . . . 74.11 109.676 175.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_exo -61.22 114.74 2.33 Favored 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 122.697 2.265 . . . . 75.22 111.926 -179.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -114.98 170.41 8.37 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 121.21 0.528 . . . . 74.11 110.353 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 187' ' ' LYS . . . . . 0.549 ' HD3' ' HB ' ' A' ' 11' ' ' THR . 11.7 mmmm -136.17 -51.15 0.71 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.292 -0.867 . . . . 74.43 110.468 -178.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.772 -0.632 . . . . 73.21 110.388 -178.49 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.787 0 N-CA-C 111.211 -0.756 . . . . 71.5 111.211 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.8 p -130.73 143.59 40.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.318 0.58 . . . . 65.44 111.727 -174.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 47.0 tp -128.34 138.44 52.38 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.145 -1.058 . . . . 74.13 108.145 171.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 22.5 ptm -73.46 85.05 1.51 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.184 0.516 . . . . 75.52 111.472 -175.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -173.13 -172.07 0.79 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.604 -0.726 . . . . 64.42 109.133 177.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -99.62 117.02 33.09 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.942 0.401 . . . . 74.22 110.815 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 129.65 127.72 2.96 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.847 -0.615 . . . . 74.15 112.037 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -100.68 132.53 46.03 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 110.229 -0.285 . . . . 73.1 110.229 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 5.2 p -121.15 116.49 49.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.435 0.636 . . . . 72.53 111.081 -178.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 95.0 mt -94.62 151.93 18.91 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.644 -0.707 . . . . 74.53 109.813 175.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.6 t -166.95 179.62 5.16 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.485 -0.325 . . . . 63.52 110.53 -177.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.579 HD11 ' N ' ' A' ' 13' ' ' ALA . 2.4 tm? -71.89 143.16 49.46 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.312 -0.625 . . . . 72.33 109.312 177.591 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.758 ' HA ' ' HA ' ' A' ' 17' ' ' SER . . . 71.11 32.86 2.17 Favored 'General case' 0 CA--C 1.511 -0.536 0 O-C-N 123.841 0.713 . . . . 73.43 111.483 178.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.405 ' O ' ' HB2' ' A' ' 15' ' ' ASP . . . -66.59 90.53 0.16 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.937 -0.574 . . . . 62.11 110.616 176.551 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 9.4 m-20 80.52 -44.11 0.24 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.512 -1.222 . . . . 73.23 112.286 171.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.9 mp -91.06 -28.9 17.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.703 -0.226 . . . . 71.15 111.191 -175.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.758 ' HA ' ' HA ' ' A' ' 13' ' ' ALA . 23.0 t 66.5 94.33 0.07 Allowed 'General case' 0 C--O 1.233 0.189 0 CA-C-O 122.066 0.936 . . . . 45.14 110.869 -176.123 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.5 m -91.01 77.73 6.05 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.867 -1.06 . . . . 74.31 110.066 178.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -153.55 171.94 17.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.793 -0.639 . . . . 75.34 109.867 -179.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.839 ' HB ' ' HB2' ' B' ' 103' ' ' LEU . 16.8 p -92.4 158.43 16.07 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.799 0.333 . . . . 63.15 111.036 178.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -161.37 -178.35 6.6 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.045 -0.525 . . . . 74.24 110.8 -176.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -142.83 -167.66 2.58 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 107.873 -1.158 . . . . 72.34 107.873 175.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 12.2 tt -80.52 120.84 32.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.218 0.532 . . . . 75.35 110.615 -179.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.562 ' H ' HD21 ' B' ' 144' ' ' LEU . 27.7 m -81.7 173.24 12.51 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.001 -0.545 . . . . 64.23 109.777 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.473 ' HD3' ' HA ' ' A' ' 25' ' ' LYS . 31.6 mmtm -128.2 99.63 5.53 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.751 0.786 . . . . 72.35 112.116 178.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.706 ' H ' ' NE2' ' A' ' 26' ' ' GLN . 0.0 OUTLIER -81.06 123.18 28.17 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 114.191 -1.368 . . . . 73.22 107.826 172.582 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 76.8 m95 -84.93 -170.06 2.95 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 121.592 0.71 . . . . 73.43 111.297 -173.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 47.5 m -72.51 -55.58 6.74 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.832 -1.076 . . . . 55.13 110.835 -175.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.494 HD21 HG22 ' B' ' 183' ' ' VAL . 47.1 t30 -109.92 80.35 1.3 Allowed 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 121.124 0.488 . . . . 75.03 110.983 -178.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.428 HG21 ' CD2' ' A' ' 31' ' ' PHE . 9.9 m -98.35 -26.87 3.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.855 -0.611 . . . . 65.14 109.566 171.069 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.557 ' HB2' ' HB3' ' A' ' 41' ' ' PRO . 11.6 p90 -158.11 18.19 0.24 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.246 -0.888 . . . . 75.24 109.536 173.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.514 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 9.4 t30 -64.87 -54.61 28.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.22 -0.9 . . . . 74.32 111.548 -170.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.481 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 47.7 mm -57.32 -41.67 78.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 CA-C-O 121.03 0.443 . . . . 72.13 111.377 -176.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.783 HD13 HD23 ' B' ' 149' ' ' LEU . 80.0 mt -66.59 -37.38 84.79 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.0 -0.545 . . . . 75.32 110.646 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 20.5 ttt85 -64.47 -40.56 95.93 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.202 -0.454 . . . . 74.12 110.687 178.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.514 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 4.6 mm-40 -72.0 -27.59 62.84 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.991 -0.549 . . . . 74.42 111.671 -177.019 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -100.9 4.29 42.54 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.877 0.37 . . . . 70.11 111.034 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 22.2 t70 61.66 69.68 0.63 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.406 -0.815 . . . . 61.34 111.487 177.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.549 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 7.6 m-85 -107.22 -7.39 16.8 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.231 -0.895 . . . . 73.53 109.882 172.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 68.51 93.73 0.05 OUTLIER Pre-proline 0 C--O 1.232 0.173 0 CA-C-N 114.81 -1.086 . . . . 64.05 111.128 -177.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.557 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 67.5 Cg_endo -75.29 166.27 29.19 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.774 2.316 . . . . 75.42 111.444 175.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.672 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 13.9 tptt -114.61 176.57 4.99 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 119.596 -0.842 . . . . 75.4 112.63 -177.614 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 53.9 t80 165.47 107.28 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 114.478 -1.237 . . . . 75.43 107.871 -167.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.685 ' H ' HG11 ' B' ' 147' ' ' VAL . 74.4 mt -127.53 -13.23 5.45 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.761 0.282 . . . . 74.22 111.761 -172.223 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 22.3 m -95.41 109.94 22.05 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.121 -0.326 . . . . 72.03 110.121 -178.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 32.1 mp0 -72.99 95.46 2.0 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.055 0.455 . . . . 73.54 110.371 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 11.1 t -65.32 157.41 5.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.482 -0.781 . . . . 75.15 109.063 175.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.41 ' O ' ' HB3' ' B' ' 142' ' ' LYS . 0.0 OUTLIER -84.12 133.14 34.64 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.02 -0.733 . . . . 75.52 109.02 -174.562 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.829 HD21 HD12 ' B' ' 134' ' ' LEU . 41.2 tp -75.25 87.96 2.51 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.282 0.563 . . . . 73.44 110.384 -175.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.939 ' HB2' HG23 ' A' ' 59' ' ' THR . . . -97.14 96.36 8.39 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.03 -0.986 . . . . 65.22 110.216 177.324 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 53.7 p90 -111.81 167.61 10.23 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.071 -0.513 . . . . 70.11 110.289 -179.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -97.03 122.91 40.54 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.304 -0.407 . . . . 71.41 111.031 -178.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 46.0 t -132.95 107.5 8.32 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.164 -0.471 . . . . 72.22 110.0 176.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 68.07 23.61 8.03 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.284 0.476 . . . . 74.45 112.284 174.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 104.25 -19.03 44.08 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.277 -0.963 . . . . 74.42 112.428 177.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.451 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 9.7 pt-20 -108.4 138.96 43.83 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.183 0.515 . . . . 74.25 110.723 179.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.0 mm -77.31 124.22 35.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.738 -0.665 . . . . 75.5 109.6 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.451 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 26.2 mmmt -103.78 90.57 3.68 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.816 -0.438 . . . . 74.32 109.816 -179.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.939 HG23 ' HB2' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -81.39 105.64 12.73 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.927 -0.579 . . . . 72.1 111.309 -177.784 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -110.48 133.11 53.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.304 -0.407 . . . . 72.1 110.805 178.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.3 p -79.63 -18.69 50.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.946 -0.57 . . . . 75.44 111.443 -178.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -152.95 172.71 16.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.167 -0.47 . . . . 54.13 110.588 -178.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -84.88 -12.59 53.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.111 -0.495 . . . . 75.53 111.612 -176.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -74.97 -42.66 57.16 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.975 -0.75 . . . . 71.44 108.975 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.554 ' HA ' ' HE2' ' A' ' 68' ' ' LYS . 15.0 m -65.99 -37.07 85.02 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.407 -0.815 . . . . 75.14 110.137 177.159 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.498 HD11 HD13 ' B' ' 134' ' ' LEU . 6.0 tt -68.19 -38.3 81.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.82 -0.627 . . . . 74.21 109.784 178.206 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.665 ' HG3' HD21 ' A' ' 84' ' ' LEU . 54.8 ttp180 -51.41 -38.76 55.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.076 -0.965 . . . . 75.24 111.02 -179.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.554 ' HE2' ' HA ' ' A' ' 65' ' ' SER . 49.8 mtmt -64.94 -51.36 62.27 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.72 -0.673 . . . . 72.1 110.785 178.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -64.52 -42.11 95.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.353 -0.839 . . . . 63.53 111.36 -175.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.19 -33.1 75.2 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.207 -0.451 . . . . 73.21 111.234 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.1 m -74.38 -22.73 59.05 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.673 0.273 . . . . 74.13 111.374 -178.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -98.83 5.98 47.12 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.283 0.563 . . . . 74.43 110.459 177.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.7 mmmt -108.0 109.41 20.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.421 -0.809 . . . . 74.31 109.334 172.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.0 p -51.18 -35.98 38.89 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.469 0.544 . . . . 75.35 112.469 -174.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 41.2 t -78.13 -56.35 4.54 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.674 0.274 . . . . 74.55 110.807 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 78.0 mtp -64.24 -21.38 66.56 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.871 0.367 . . . . 74.13 111.513 -174.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.401 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 88.5 tttt -59.6 -25.64 64.79 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.845 -0.616 . . . . 75.22 111.106 179.253 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.52 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 32.4 mt-10 -104.93 5.49 32.85 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.233 0.54 . . . . 74.02 110.629 -178.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.523 ' HB3' HG22 ' B' ' 133' ' ' ILE . 10.6 mp -91.55 -52.09 4.94 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.42 -0.809 . . . . 75.3 109.447 173.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -81.2 -10.48 59.61 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.511 -0.768 . . . . 61.34 111.256 -176.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.52 ' HD3' ' HA ' ' A' ' 78' ' ' GLU . 64.8 pttt -59.83 -18.46 44.09 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 111.975 0.361 . . . . 75.54 111.975 -176.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -66.2 -36.51 83.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.968 0.413 . . . . 75.33 110.636 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 29.2 m -110.12 4.34 8.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.239 0.543 . . . . 74.33 110.45 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.665 HD21 ' HG3' ' A' ' 67' ' ' ARG . 45.0 tp -138.36 104.37 7.84 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.599 -0.728 . . . . 74.1 110.661 -175.155 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.44 111.22 3.16 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.79 2.327 . . . . 74.44 111.443 178.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 80.1 mm-40 -66.93 103.46 1.15 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.103 -0.499 . . . . 72.34 111.567 -176.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.411 ' HZ1' ' HB3' ' A' ' 87' ' ' LYS . 9.0 mtpm? 65.49 19.38 11.54 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.2 -0.909 . . . . 73.11 112.498 175.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 . . . . . 0 C--N 1.317 -0.816 0 CA-C-N 116.647 -0.251 . . . . 75.51 110.559 178.721 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 N-CA-C 112.135 -0.386 . . . . 64.41 112.135 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 9.8 p -160.98 154.22 3.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 110.077 -0.342 . . . . 73.33 110.077 179.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' LEU . . . . . 0.839 ' HB2' ' HB ' ' A' ' 20' ' ' THR . 29.0 tp -73.54 170.57 14.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.039 0.447 . . . . 75.25 110.961 -179.042 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' MET . . . . . 0.469 ' N ' ' HG ' ' B' ' 103' ' ' LEU . 20.2 ptm -79.36 8.23 6.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.859 -0.61 . . . . 75.25 111.056 178.459 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -77.43 139.94 39.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.968 -0.56 . . . . 64.43 109.681 178.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -69.1 122.7 19.29 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.97 0.414 . . . . 73.11 110.574 -176.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 113.28 82.66 1.16 Allowed Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 111.087 -0.805 . . . . 71.11 111.087 -174.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -99.95 90.35 4.38 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.926 0.393 . . . . 73.32 111.587 -174.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 94.0 t -103.56 128.15 56.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 116.135 -0.484 . . . . 73.33 109.753 174.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 91.2 mt -84.06 138.89 32.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.308 0.575 . . . . 74.42 111.285 -177.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 11.0 t -100.75 174.61 5.97 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.236 -0.893 . . . . 74.53 109.654 178.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . 0.487 HD12 ' N ' ' B' ' 113' ' ' ALA . 3.4 tm? -66.16 138.74 57.92 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.75 -0.833 . . . . 74.4 108.75 173.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 113' ' ' ALA . . . . . 0.557 ' HB2' ' HA ' ' B' ' 117' ' ' SER . . . 64.11 39.69 7.51 Favored 'General case' 0 CA--C 1.512 -0.496 0 O-C-N 123.604 0.565 . . . . 62.23 110.804 178.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.51 92.32 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.646 -0.707 . . . . 52.35 111.476 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 30.8 t70 82.88 -34.96 0.08 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.227 -1.351 . . . . 73.14 112.829 168.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 7.4 mp -95.98 -40.11 9.43 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.883 -0.327 . . . . 75.11 110.321 -178.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.557 ' HA ' ' HB2' ' B' ' 113' ' ' ALA . 33.1 t 63.36 94.2 0.05 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.378 -0.828 . . . . 64.44 110.602 -178.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 15.6 m -57.07 94.62 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.351 -1.295 . . . . 71.41 111.599 178.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -176.45 -174.45 0.59 Allowed 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.842 -0.617 . . . . 73.2 109.813 -178.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 37.2 m -118.99 108.15 14.4 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 110.041 -0.355 . . . . 74.53 110.041 176.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -109.08 66.72 0.64 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.295 0.569 . . . . 73.33 112.195 -176.032 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -121.37 88.39 2.93 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.419 0.628 . . . . 72.11 109.664 173.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . 0.486 HG23 ' HE3' ' B' ' 125' ' ' LYS . 8.8 tt -133.3 128.87 56.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.377 -0.829 . . . . 72.22 109.427 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 15.6 m -87.11 84.31 7.31 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.403 0.621 . . . . 60.23 110.806 -172.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . 0.486 ' HE3' HG23 ' B' ' 123' ' ' ILE . 0.0 OUTLIER -134.08 24.46 3.89 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.262 -0.881 . . . . 74.54 110.025 177.721 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -85.63 -171.57 3.67 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.183 -0.917 . . . . 74.52 110.239 179.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -133.35 142.42 48.41 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 108.987 -0.746 . . . . 73.15 108.987 178.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 45.0 m -65.1 -29.55 70.42 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.261 0.553 . . . . 55.0 109.607 170.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -77.64 104.35 8.12 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.58 -0.737 . . . . 75.31 109.583 173.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.502 ' C ' ' H ' ' B' ' 132' ' ' ASN . 11.2 m -128.5 -149.8 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 115.447 -0.797 . . . . 74.21 110.404 -179.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 10.7 p90 -72.04 26.98 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.129 -0.487 . . . . 74.14 111.93 179.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.502 ' H ' ' C ' ' B' ' 130' ' ' VAL . 64.4 t30 -57.97 -53.73 54.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.028 0.442 . . . . 71.33 110.617 -176.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 133' ' ' ILE . . . . . 0.523 HG22 ' HB3' ' A' ' 79' ' ' LEU . 49.1 mm -60.55 -43.71 95.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.787 -0.642 . . . . 73.04 111.549 -177.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.829 HD12 HD21 ' A' ' 49' ' ' LEU . 80.8 mt -67.46 -24.3 65.6 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.263 -0.426 . . . . 75.05 111.266 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -73.63 -46.05 49.19 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.122 0.486 . . . . 71.45 110.062 177.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 136' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 26.7 mm-40 -65.45 -33.24 75.49 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.472 -0.785 . . . . 75.34 110.97 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -99.04 5.56 47.02 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.546 -0.297 . . . . 72.31 111.432 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 52.37 70.59 0.55 Allowed 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.55 0.944 . . . . 64.34 113.55 175.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 139' ' ' PHE . . . . . 0.434 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 28.1 m-85 -99.77 0.99 42.78 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.832 -0.622 . . . . 74.43 109.645 169.133 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 61.75 89.94 0.1 OUTLIER Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 114.842 -1.072 . . . . 74.13 111.472 -173.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . 0.414 ' HA ' ' CD1' ' A' ' 49' ' ' LEU . 22.4 Cg_exo -65.94 143.54 73.2 Favored 'Trans proline' 0 N--CA 1.463 -0.318 0 C-N-CA 122.632 2.221 . . . . 74.02 110.695 172.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 142' ' ' LYS . . . . . 0.64 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 17.2 tptt -87.81 173.74 8.79 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 119.658 -0.817 . . . . 73.31 111.652 -176.098 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 143' ' ' PHE . . . . . 0.423 ' H ' ' HG3' ' B' ' 142' ' ' LYS . 42.7 t80 166.86 114.83 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.106 -1.072 . . . . 70.25 108.106 -166.312 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . 0.562 HD21 ' H ' ' A' ' 24' ' ' SER . 96.0 mt -136.61 -46.96 0.61 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.999 0.428 . . . . 74.12 111.324 -176.119 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 31.3 m -66.52 114.41 5.47 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.313 -0.858 . . . . 64.51 111.584 -175.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -79.09 95.2 5.49 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.299 -0.63 . . . . 71.12 109.299 175.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 147' ' ' VAL . . . . . 0.685 HG11 ' H ' ' A' ' 44' ' ' LEU . 5.1 t -69.24 169.93 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.919 -0.582 . . . . 75.44 109.962 -179.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . 0.583 ' HB3' ' HA ' ' B' ' 161' ' ' SER . 0.0 OUTLIER -85.52 129.38 34.83 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.553 -0.536 . . . . 74.24 109.553 -175.758 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.783 HD23 HD13 ' A' ' 34' ' ' LEU . 39.1 tp -76.03 98.18 4.24 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.243 -0.89 . . . . 73.43 110.743 -173.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.886 ' HB3' HG21 ' B' ' 159' ' ' THR . . . -102.25 102.45 12.85 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.112 -0.949 . . . . 73.22 110.213 177.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 151' ' ' PHE . . . . . 0.569 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 37.6 p90 -125.89 166.65 16.5 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.84 -0.618 . . . . 74.42 110.13 -178.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -87.04 115.52 24.48 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.183 0.516 . . . . 74.55 110.802 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 153' ' ' CYS . . . . . 0.48 ' HB3' ' CG ' ' B' ' 158' ' ' LYS . 45.7 t -134.13 122.86 23.48 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.845 -0.616 . . . . 75.33 110.183 177.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.1 t70 70.23 8.63 6.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.233 -0.894 . . . . 72.3 111.956 174.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 111.53 -9.11 28.32 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.267 -0.968 . . . . 61.33 112.959 176.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -124.24 160.99 26.73 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.673 -0.491 . . . . 75.23 109.673 175.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 47.2 mm -80.12 119.53 29.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.737 -0.468 . . . . 73.3 109.737 175.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 158' ' ' LYS . . . . . 0.48 ' CG ' ' HB3' ' B' ' 153' ' ' CYS . 30.7 mmmt -98.39 98.32 9.56 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.876 -0.416 . . . . 63.41 109.876 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 159' ' ' THR . . . . . 0.886 HG21 ' HB3' ' B' ' 150' ' ' ALA . 0.2 OUTLIER -84.06 102.78 12.76 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.268 -0.424 . . . . 72.32 110.997 179.83 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -99.6 114.59 27.72 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.348 -0.387 . . . . 74.51 110.85 178.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 161' ' ' SER . . . . . 0.583 ' HA ' ' HB3' ' B' ' 148' ' ' LYS . 5.3 p -76.69 -33.46 58.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.976 -0.557 . . . . 72.02 110.167 176.098 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -116.37 149.5 39.25 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.604 -0.726 . . . . 72.41 109.684 176.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -90.19 -9.21 48.96 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.13 0.49 . . . . 74.54 110.327 -178.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -63.93 -49.6 71.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.629 -0.714 . . . . 75.31 110.183 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 10.7 m -66.43 -36.1 81.96 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.88 -0.6 . . . . 75.31 110.753 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 3.9 tt -60.29 -43.36 96.34 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.069 0.461 . . . . 75.51 110.131 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 15.9 ttp180 -60.83 -23.38 65.05 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.373 -0.83 . . . . 74.41 110.899 -175.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -88.32 -43.24 11.68 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.184 0.516 . . . . 75.04 110.207 176.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 169' ' ' PHE . . . . . 0.429 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 59.1 t80 -62.81 -39.3 93.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.39 -0.823 . . . . 75.42 111.051 -178.032 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -67.1 -29.09 68.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.059 -0.519 . . . . 74.2 111.532 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 22.9 t -75.6 -32.61 60.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.758 0.314 . . . . 73.3 111.112 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -82.79 -16.09 49.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.907 0.385 . . . . 73.53 110.651 179.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 173' ' ' LYS . . . . . 0.405 ' HA ' ' HD2' ' B' ' 173' ' ' LYS . 25.7 mmmt -81.31 117.92 22.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.225 -0.443 . . . . 74.44 110.281 174.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.1 p -54.16 -44.84 71.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.129 -0.487 . . . . 73.32 111.89 -178.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 4.5 p -71.45 -50.73 28.82 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.957 -0.565 . . . . 74.44 111.658 -178.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 82.3 mtp -73.61 -16.77 61.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.321 -0.4 . . . . 71.1 112.077 -172.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . 0.442 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 47.4 tttp -62.8 -26.11 68.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.307 -0.406 . . . . 73.44 110.91 -178.197 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . 0.406 ' HA ' ' HD3' ' B' ' 181' ' ' LYS . 5.1 mm-40 -94.33 -8.19 39.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.434 0.635 . . . . 72.24 109.917 -176.295 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 179' ' ' LEU . . . . . 0.481 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 11.2 mp -87.64 -54.88 4.04 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.029 -0.987 . . . . 74.33 109.844 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -81.03 -14.25 58.06 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.207 -0.906 . . . . 73.04 112.19 -173.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 181' ' ' LYS . . . . . 0.443 ' HA ' ' O ' ' B' ' 184' ' ' LEU . 64.9 pttt -57.46 -19.2 22.63 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.347 0.499 . . . . 72.41 112.347 -176.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -58.51 -36.39 73.73 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.061 0.458 . . . . 72.01 110.783 177.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 183' ' ' VAL . . . . . 0.494 HG22 HD21 ' A' ' 29' ' ' ASN . 26.9 m -119.32 11.77 6.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.223 0.535 . . . . 74.31 110.367 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 184' ' ' LEU . . . . . 0.443 ' O ' ' HA ' ' B' ' 181' ' ' LYS . 55.6 tp -143.04 86.8 9.04 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.736 -0.666 . . . . 73.1 110.534 -175.171 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 185' ' ' PRO . . . . . 0.692 ' HB2' ' HB3' ' B' ' 188' ' ' GLU . 16.6 Cg_exo -69.08 150.41 72.31 Favored 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 122.903 2.402 . . . . 71.03 111.485 178.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 70.6 mm-40 -82.57 107.71 15.42 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.874 0.368 . . . . 74.33 111.443 -172.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? 53.73 40.72 31.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.259 -0.882 . . . . 75.35 112.047 178.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 188' ' ' GLU . . . . . 0.692 ' HB3' ' HB2' ' B' ' 185' ' ' PRO . 35.4 tt0 . . . . . 0 C--O 1.251 1.155 0 CA-C-N 114.66 -1.155 . . . . 72.14 109.039 177.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.689 0 N-CA-C 112.24 -0.344 . . . . 51.42 112.24 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 28.3 m -128.5 173.59 13.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.781 0.324 . . . . 72.35 110.349 178.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 93.4 mt -84.67 131.18 34.62 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.257 -0.429 . . . . 75.13 110.305 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.1 mmt -95.94 -7.75 35.72 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.301 0.572 . . . . 72.13 109.664 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -74.0 103.48 4.5 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.682 -0.69 . . . . 54.44 109.174 176.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -95.86 145.62 25.22 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.998 -0.547 . . . . 54.44 110.359 -175.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.62 -145.74 6.38 Favored Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.694 -0.765 . . . . 44.32 111.472 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -138.88 134.69 33.61 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 120.618 0.246 . . . . 75.24 110.445 178.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.2 p -116.93 134.27 61.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.359 -0.382 . . . . 71.05 110.335 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.8 mp -93.24 89.39 6.39 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.053 0.454 . . . . 64.22 109.972 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 60.9 m -73.01 113.64 10.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.785 -0.643 . . . . 73.12 111.033 -178.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.463 HD11 ' N ' ' A' ' 13' ' ' ALA . 1.4 tm? -99.93 134.51 42.74 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.243 -1.021 . . . . 65.02 108.243 177.046 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.859 ' HB3' ' HA ' ' A' ' 17' ' ' SER . . . -50.27 114.33 1.09 Allowed 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 112.449 0.537 . . . . 74.24 112.449 -178.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.45 ' O ' ' HB2' ' A' ' 15' ' ' ASP . . . -81.23 104.01 11.4 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.843 -0.617 . . . . 73.31 110.179 175.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 6.6 m-20 85.02 -14.28 0.61 Allowed 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 114.906 -1.043 . . . . 71.0 111.489 171.268 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.9 mp -119.13 37.24 4.19 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.851 -0.796 . . . . 72.25 108.851 176.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.859 ' HA ' ' HB3' ' A' ' 13' ' ' ALA . 19.5 m -48.35 98.77 0.02 OUTLIER 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.031 -0.986 . . . . 73.02 112.298 -172.518 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 17.9 m -70.84 78.79 0.62 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.603 -1.181 . . . . 75.23 111.289 177.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -167.17 103.13 0.53 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.64 -0.709 . . . . 75.4 109.975 175.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.6 m -132.74 147.67 52.32 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.017 -0.538 . . . . 74.33 109.976 -178.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 85.7 mt -81.39 -173.29 4.28 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.095 0.474 . . . . 71.52 111.367 -179.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.618 ' HA ' ' O ' ' B' ' 126' ' ' GLN . 8.6 p-10 -77.43 120.59 22.63 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.661 -0.7 . . . . 63.23 110.586 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.5 HG12 ' H ' ' A' ' 24' ' ' SER . 14.4 tt -162.49 172.04 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.993 -0.549 . . . . 75.34 109.865 -175.268 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.5 ' H ' HG12 ' A' ' 23' ' ' ILE . 1.9 m -56.82 144.54 32.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.207 0.527 . . . . 71.52 111.298 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.877 ' HD3' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -104.87 69.98 0.9 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.753 0.787 . . . . 74.33 110.88 -174.342 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.603 ' O ' ' HA ' ' B' ' 122' ' ' ASP . 1.8 mp0 -107.5 149.85 27.49 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.812 -0.631 . . . . 75.43 111.299 -178.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 51.4 m95 -139.69 125.62 19.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.666 -0.697 . . . . 74.54 109.412 174.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.565 ' H ' ' HB3' ' B' ' 122' ' ' ASP . 8.5 p -70.04 -32.76 71.06 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.266 0.555 . . . . 74.44 110.631 178.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -116.9 127.29 54.11 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.574 -0.739 . . . . 74.12 110.127 177.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.507 ' C ' ' H ' ' A' ' 32' ' ' ASN . 19.4 m -110.66 -156.31 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.846 -0.615 . . . . 75.2 109.771 176.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.41 ' HB3' HD13 ' B' ' 149' ' ' LEU . 22.1 p90 -73.03 31.18 0.07 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.991 0.424 . . . . 74.05 111.185 176.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.517 ' O ' ' HB3' ' A' ' 35' ' ' ARG . 48.6 t30 -60.17 -51.13 70.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.703 -0.68 . . . . 73.13 111.368 -174.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.49 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 48.5 mm -58.78 -47.54 88.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.167 -0.469 . . . . 74.13 111.469 -177.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.1 mt -60.3 -35.45 75.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.007 0.432 . . . . 74.11 110.746 177.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.517 ' HB3' ' O ' ' A' ' 32' ' ' ASN . 23.4 ttt-85 -62.38 -49.94 73.53 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.637 -0.711 . . . . 75.43 110.374 176.477 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 15.9 mm-40 -66.67 -31.95 72.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.672 -0.695 . . . . 74.35 111.898 -176.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -98.04 3.62 49.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.771 0.319 . . . . 73.22 111.159 -177.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 38.2 t70 57.73 62.06 2.22 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.592 0.711 . . . . 73.11 111.929 175.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -89.3 -3.33 58.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.816 -0.629 . . . . 75.51 110.534 170.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 61.06 67.28 1.47 Allowed Pre-proline 0 CA--C 1.534 0.333 0 CA-C-N 115.624 -0.716 . . . . 75.02 110.029 -173.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -80.65 168.88 17.4 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.535 2.157 . . . . 65.42 111.583 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.465 ' HE2' ' HB2' ' B' ' 150' ' ' ALA . 10.7 mptt -90.97 168.84 11.37 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.431 -0.508 . . . . 75.32 110.866 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 15.9 p90 -101.21 -166.91 1.36 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.817 -0.629 . . . . 75.12 111.883 -164.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -80.83 141.75 34.37 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.419 -0.586 . . . . 71.13 109.419 177.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.589 ' SG ' HG21 ' A' ' 47' ' ' VAL . 6.6 t -82.77 141.34 32.43 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.113 0.482 . . . . 74.24 111.153 -170.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -86.13 47.07 1.4 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.724 -0.671 . . . . 75.52 110.404 177.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.589 HG21 ' SG ' ' A' ' 45' ' ' CYS . 45.8 t -78.09 106.5 8.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.109 0.48 . . . . 71.5 109.875 176.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.37 141.93 16.55 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.357 -0.838 . . . . 73.13 110.073 178.637 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.66 ' HB3' ' HD1' ' A' ' 51' ' ' PHE . 10.6 mp -76.09 88.51 3.01 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.719 -0.673 . . . . 74.43 109.868 178.29 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.08 59.71 4.59 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.156 0.503 . . . . 65.35 109.683 175.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.66 ' HD1' ' HB3' ' A' ' 49' ' ' LEU . 52.5 p90 -90.5 166.96 12.94 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.993 -0.548 . . . . 71.34 110.203 -175.364 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -100.41 123.31 44.47 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 120.981 0.419 . . . . 73.44 110.697 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.632 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 52.9 t -125.77 112.32 15.92 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.726 -0.67 . . . . 71.14 109.577 176.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 68.04 21.27 8.84 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.862 -0.608 . . . . 72.22 111.39 177.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 107.8 -32.75 6.82 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.75 -0.738 . . . . 63.42 112.433 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -98.37 143.87 28.37 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.073 0.463 . . . . 71.14 110.8 -176.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.2 mm -74.5 118.32 20.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.027 -0.533 . . . . 74.31 110.289 178.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 29.9 mmmt -106.17 107.72 18.87 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.198 -0.667 . . . . 74.15 109.198 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.514 ' HA ' ' O ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -98.51 112.92 24.8 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.061 -0.518 . . . . 74.33 111.919 -171.178 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -128.56 139.18 52.43 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.246 -0.433 . . . . 75.3 110.2 177.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 65.4 p -104.21 -16.69 15.13 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.121 0.486 . . . . 62.21 110.1 176.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -127.16 150.14 49.64 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.813 -0.63 . . . . 71.22 111.237 -176.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.0 mt -67.92 -23.39 65.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.712 -0.677 . . . . 75.43 110.477 177.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -60.63 -48.8 80.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.093 0.473 . . . . 74.54 110.55 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 9.9 m -68.11 -41.92 81.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.892 -0.594 . . . . 72.14 110.705 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.4 tp -65.28 -36.11 83.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.941 -0.572 . . . . 74.15 110.648 -178.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.71 ' HG2' HD11 ' A' ' 84' ' ' LEU . 62.8 mtt180 -53.77 -49.51 68.08 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.222 -0.445 . . . . 73.15 111.806 178.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 40.7 mtmt -73.06 -28.9 62.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.994 -0.548 . . . . 74.31 111.353 -173.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.481 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 81.5 t80 -79.21 -43.48 23.77 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.869 0.366 . . . . 72.53 110.658 178.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.18 -32.28 73.89 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.416 -0.356 . . . . 72.34 111.61 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.0 p -75.88 -15.5 60.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.555 -0.293 . . . . 70.13 111.624 -178.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.481 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 19.4 pt20 -102.1 -2.12 30.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.183 0.516 . . . . 75.32 110.106 176.342 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.632 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 30.2 mmmt -98.49 120.01 38.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.842 -0.617 . . . . 74.45 110.36 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.2 p -58.85 -40.52 84.53 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.349 -0.387 . . . . 64.22 111.299 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.0 m -77.43 -31.89 54.23 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.033 -0.53 . . . . 65.23 111.74 -177.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.421 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 80.0 mtp -94.42 -10.93 30.92 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.862 0.319 . . . . 72.45 111.862 -174.344 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -59.28 -37.31 77.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.048 0.451 . . . . 73.25 111.421 -176.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.449 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 61.9 mm-40 -96.69 5.07 51.4 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.3 0.571 . . . . 74.2 110.548 -175.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.575 ' HB3' HG22 ' B' ' 133' ' ' ILE . 53.6 mt -95.63 -52.29 4.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.172 -0.922 . . . . 74.43 109.687 177.133 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -85.7 -4.81 59.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.529 -0.76 . . . . 74.22 111.808 -176.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.449 ' HD2' ' HA ' ' A' ' 78' ' ' GLU . 18.4 ptmt -54.68 -18.09 4.17 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.854 0.359 . . . . 74.42 111.63 177.491 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -69.12 -44.28 72.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.393 -0.367 . . . . 64.45 111.386 179.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.573 HG22 HD13 ' A' ' 84' ' ' LEU . 16.1 m -100.46 5.28 10.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-O 120.878 0.37 . . . . 72.22 111.865 -176.02 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.71 HD11 ' HG2' ' A' ' 67' ' ' ARG . 8.2 mp -117.5 155.23 50.49 Favored Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 108.895 -0.78 . . . . 73.24 108.895 172.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -76.83 67.86 7.32 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.099 1.866 . . . . 74.22 111.207 176.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.547 HE21 HD22 ' A' ' 84' ' ' LEU . 68.9 mt-30 -114.23 88.83 2.94 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.766 -0.652 . . . . 75.31 111.479 -177.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -110.49 -47.33 3.29 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.602 -0.888 . . . . 72.3 108.602 172.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 . . . . . 0 C--N 1.325 -0.484 0 CA-C-N 115.158 -0.928 . . . . 53.14 110.406 177.493 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.409 0 N-CA-C 112.473 -0.251 . . . . 75.25 112.473 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 34.7 m -83.39 158.06 3.73 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 CA-C-O 120.626 0.251 . . . . 65.35 110.632 179.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 89.9 mt -114.18 135.69 53.77 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.251 -0.431 . . . . 74.01 110.461 -178.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 24.6 mmt -95.32 45.45 1.1 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.092 -0.503 . . . . 64.23 110.902 -177.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -109.82 119.8 40.48 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.097 -0.501 . . . . 60.0 110.474 176.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -138.1 110.22 7.31 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.655 -0.702 . . . . 73.55 109.577 177.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -134.85 -119.9 1.99 Allowed Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.571 -0.823 . . . . 51.12 112.162 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -146.3 88.86 1.82 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.702 0.287 . . . . 62.22 110.664 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 7.1 p -69.72 127.13 31.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.145 -0.479 . . . . 64.44 109.892 177.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 84.2 mt -76.21 125.95 30.09 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.142 -0.481 . . . . 75.32 111.393 -172.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 24.2 m -88.01 110.48 20.63 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.048 -0.524 . . . . 73.14 110.033 177.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -140.4 123.02 16.23 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.11 -0.7 . . . . 64.22 109.11 -178.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.59 147.37 49.38 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.234 -0.439 . . . . 60.45 111.922 -174.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.36 -60.74 2.08 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.946 -0.57 . . . . 54.14 110.941 177.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -107.9 -19.13 13.62 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.815 0.34 . . . . 72.12 111.516 -178.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -98.72 41.6 1.13 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.129 -0.693 . . . . 75.33 109.129 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 2.8 m -77.39 67.29 3.3 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.308 -0.86 . . . . 72.41 109.975 -172.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 18.5 m -37.6 110.72 0.13 Allowed 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 113.461 -1.7 . . . . 72.15 112.594 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -158.89 111.56 2.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.27 -0.877 . . . . 74.55 109.475 176.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 28.5 m -154.7 139.88 17.52 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.817 0.341 . . . . 73.44 110.91 -175.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . 0.47 ' HB3' ' H ' ' B' ' 122' ' ' ASP . 4.1 mm? -99.34 -158.42 0.67 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.974 -0.557 . . . . 74.32 110.854 177.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 122' ' ' ASP . . . . . 0.603 ' HA ' ' O ' ' A' ' 26' ' ' GLN . 9.8 p-10 -61.41 131.75 51.25 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.95 -0.568 . . . . 75.34 111.634 -175.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . 0.571 HG12 ' H ' ' B' ' 124' ' ' SER . 14.9 tt -172.78 176.19 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 115.852 -0.613 . . . . 75.22 109.863 -179.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 124' ' ' SER . . . . . 0.571 ' H ' HG12 ' B' ' 123' ' ' ILE . 14.7 m -67.49 169.0 9.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.388 0.613 . . . . 63.1 111.122 178.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . 0.672 ' HD3' ' H ' ' B' ' 125' ' ' LYS . 0.0 OUTLIER -125.97 80.27 1.9 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.826 0.822 . . . . 75.23 110.801 -174.053 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 126' ' ' GLN . . . . . 0.618 ' O ' ' HA ' ' A' ' 22' ' ' ASP . 1.9 mp0 -115.8 129.16 56.33 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.93 -0.577 . . . . 75.21 111.302 -178.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 78.9 m95 -140.78 120.98 13.84 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 108.754 -0.832 . . . . 75.22 108.754 173.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 19.3 m -68.61 -39.85 80.65 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.897 -0.592 . . . . 73.41 111.933 -173.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -114.84 111.7 21.63 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.888 -0.325 . . . . 72.1 111.518 -175.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.577 HG12 ' HD2' ' B' ' 131' ' ' PHE . 41.8 t -131.61 120.89 46.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.042 -0.527 . . . . 74.32 109.663 175.555 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 131' ' ' PHE . . . . . 0.577 ' HD2' HG12 ' B' ' 130' ' ' VAL . 20.0 p90 51.21 12.04 0.12 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.898 1.279 . . . . 72.14 113.881 177.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.491 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 52.0 t30 -55.12 -58.04 9.3 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.746 0.308 . . . . 65.3 111.632 -173.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 133' ' ' ILE . . . . . 0.575 HG22 ' HB3' ' A' ' 79' ' ' LEU . 49.5 mm -57.36 -42.54 80.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.183 0.516 . . . . 74.52 111.108 -178.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.536 HD13 HD23 ' A' ' 49' ' ' LEU . 86.2 mt -67.63 -26.52 66.28 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.052 -0.522 . . . . 71.15 111.35 -177.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 46.1 ttt180 -71.73 -46.44 58.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.998 0.428 . . . . 75.43 109.942 175.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 136' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 16.8 mm-40 -63.05 -27.08 69.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.51 -0.768 . . . . 75.45 111.358 -177.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -106.17 3.36 27.84 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.411 -0.359 . . . . 70.0 111.305 -177.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 32.9 t70 55.37 65.61 1.44 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.562 0.696 . . . . 73.12 111.887 177.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -94.03 6.3 48.97 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.827 -0.624 . . . . 71.32 111.025 172.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 58.44 66.26 2.67 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 116.004 -0.544 . . . . 71.12 110.485 -175.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -86.76 156.82 8.89 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.772 2.314 . . . . 74.21 112.691 -176.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -120.14 140.95 50.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.942 0.401 . . . . 70.23 110.95 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 93.0 t80 -178.46 103.48 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.081 -0.963 . . . . 73.23 109.078 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . 0.461 ' HG ' ' HG2' ' B' ' 146' ' ' GLU . 50.4 tp -156.52 104.14 2.17 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.849 -0.426 . . . . 73.2 109.849 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 145' ' ' CYS . . . . . 0.459 ' HA ' ' SG ' ' A' ' 45' ' ' CYS . 26.5 t -80.41 87.16 5.66 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.322 0.582 . . . . 74.1 110.162 -179.614 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . 0.461 ' HG2' ' HG ' ' B' ' 144' ' ' LEU . 5.3 mm-40 -85.07 -4.57 59.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.421 -0.809 . . . . 75.4 110.454 177.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 22.9 t -87.63 119.03 34.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-O 121.921 0.867 . . . . 61.43 111.548 -178.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . 0.51 ' HD3' HG22 ' B' ' 159' ' ' THR . 0.1 OUTLIER -152.76 147.16 25.75 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 113.776 -1.556 . . . . 71.42 107.304 172.619 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.569 ' O ' ' HA ' ' B' ' 159' ' ' THR . 2.6 mm? -65.23 93.95 0.14 Allowed 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.49 -0.484 . . . . 75.12 110.719 -175.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.542 ' HA ' ' O ' ' B' ' 158' ' ' LYS . . . -103.27 75.92 1.39 Allowed 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.014 -0.994 . . . . 73.34 108.75 176.112 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 151' ' ' PHE . . . . . 0.545 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 46.2 p90 -110.64 164.5 12.67 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.274 -0.876 . . . . 74.44 110.575 -173.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -101.73 116.26 32.34 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.049 0.452 . . . . 75.1 111.011 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 153' ' ' CYS . . . . . 0.655 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 49.2 t -112.32 107.7 16.63 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.84 -0.618 . . . . 70.21 109.66 178.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 66.92 6.72 4.83 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 116.093 -0.503 . . . . 73.33 111.883 176.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 126.56 -29.98 4.35 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.724 -0.75 . . . . 70.03 112.442 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 156' ' ' GLU . . . . . 0.577 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 14.1 pt-20 -91.89 140.37 29.74 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 122.682 -0.304 . . . . 75.01 110.262 -178.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 44.9 mm -83.38 123.83 39.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.879 0.371 . . . . 73.31 110.103 177.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 158' ' ' LYS . . . . . 0.577 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 27.0 mmmt -106.35 148.06 28.5 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.149 -0.686 . . . . 61.31 109.149 179.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 159' ' ' THR . . . . . 0.569 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.0 OUTLIER -130.46 124.87 33.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.049 0.452 . . . . 73.44 111.584 178.449 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 160' ' ' PHE . . . . . 0.406 ' CD2' HD12 ' B' ' 166' ' ' LEU . 90.1 m-85 -132.68 126.84 33.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.587 -0.733 . . . . 74.34 110.405 176.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.7 -23.1 62.41 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.976 -0.557 . . . . 71.41 111.495 -179.09 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -150.97 177.25 10.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.851 0.358 . . . . 61.52 110.471 175.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 76.3 mt -86.65 -7.56 58.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.881 -0.6 . . . . 74.54 111.736 -175.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 164' ' ' GLN . . . . . 0.495 ' OE1' ' HD3' ' B' ' 167' ' ' ARG . 5.7 tp-100 -78.59 -40.11 35.53 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.991 -0.744 . . . . 75.32 108.991 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 22.5 t -67.79 -39.24 84.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.435 -0.802 . . . . 73.12 110.014 175.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . 0.406 HD12 ' CD2' ' B' ' 160' ' ' PHE . 53.0 tp -68.06 -29.87 68.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.875 -0.602 . . . . 75.14 110.476 177.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . 0.495 ' HD3' ' OE1' ' B' ' 164' ' ' GLN . 58.5 ttt180 -60.46 -28.05 68.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.992 -0.549 . . . . 75.15 110.908 178.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -79.89 -26.37 40.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.142 -0.481 . . . . 75.22 111.175 177.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -88.3 -42.37 12.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.159 -0.473 . . . . 71.2 110.834 -176.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.64 -23.06 67.14 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.092 -0.504 . . . . 74.21 111.535 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 3.1 p -81.14 -26.28 36.24 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.409 -0.36 . . . . 74.33 111.826 -178.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -92.73 -14.63 27.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.041 0.448 . . . . 74.43 110.526 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 173' ' ' LYS . . . . . 0.655 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 29.4 mmmt -85.56 117.34 24.4 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.01 -0.541 . . . . 75.34 109.822 175.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 11.2 m -59.67 -35.97 75.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.883 0.373 . . . . 71.42 111.449 -175.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 7.0 p -76.51 -47.83 21.48 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.269 -0.423 . . . . 73.34 111.102 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 176' ' ' MET . . . . . 0.46 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 82.3 mtp -72.31 -18.79 61.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.828 0.347 . . . . 65.44 111.293 -176.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' B' ' 173' ' ' LYS . 84.0 tttt -58.75 -41.59 86.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.904 -0.589 . . . . 72.21 111.28 -177.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . 0.586 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 9.2 mm-40 -89.23 -6.76 56.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.601 0.715 . . . . 70.12 109.647 -174.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 179' ' ' LEU . . . . . 0.49 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 64.3 mt -82.77 -43.1 17.15 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.051 -0.977 . . . . 74.4 109.971 177.129 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 180' ' ' LEU . . . . . 0.642 ' HB3' HD12 ' B' ' 184' ' ' LEU . 4.3 mm? -95.89 -9.78 30.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.872 -0.604 . . . . 74.22 112.102 -174.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 181' ' ' LYS . . . . . 0.586 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 17.5 ptmt -56.5 -20.93 22.61 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.841 0.682 . . . . 72.34 112.841 -175.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -68.66 -40.16 80.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.989 0.423 . . . . 75.53 111.252 179.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 26.3 m -103.07 -15.58 7.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.081 -0.508 . . . . 75.02 111.537 -176.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 184' ' ' LEU . . . . . 0.642 HD12 ' HB3' ' B' ' 180' ' ' LEU . 9.9 mp -93.26 154.93 41.43 Favored Pre-proline 0 C--N 1.325 -0.457 0 N-CA-C 109.654 -0.498 . . . . 74.54 109.654 175.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -68.86 72.66 1.02 Allowed 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.7 2.267 . . . . 75.32 112.286 178.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -127.75 99.63 5.63 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.419 -0.809 . . . . 72.1 109.38 175.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 187' ' ' LYS . . . . . 0.697 ' HZ3' ' HB2' ' B' ' 187' ' ' LYS . 7.8 mtmp? -90.05 -4.29 57.46 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.856 -0.611 . . . . 74.51 110.275 -177.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 188' ' ' GLU . . . . . 0.49 ' OE1' ' HB2' ' B' ' 187' ' ' LYS . 1.9 mp0 . . . . . 0 C--O 1.248 1.006 0 CA-C-N 115.529 -0.759 . . . . 71.13 109.983 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.819 0 N-CA-C 111.65 -0.58 . . . . 65.02 111.65 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 31.2 m -86.6 -26.2 6.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.303 0.573 . . . . 73.05 109.65 177.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 85.6 mt -103.12 158.06 16.56 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.604 -0.725 . . . . 75.52 109.561 174.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -73.86 -9.72 58.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.195 0.522 . . . . 74.22 110.764 -178.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -124.36 129.08 50.06 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.683 -0.69 . . . . 70.32 109.726 177.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.416 ' H ' ' CD ' ' A' ' 6' ' ' GLU . 0.6 OUTLIER -96.85 9.74 40.97 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.147 -0.478 . . . . 72.33 111.257 -175.899 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -79.15 62.64 3.99 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.892 -0.67 . . . . 72.12 111.763 176.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -91.22 155.69 18.39 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.833 0.349 . . . . 51.14 110.908 -178.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.2 m -74.37 152.91 6.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.972 -0.558 . . . . 74.51 111.295 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.0 pp -101.27 157.89 16.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.934 -0.575 . . . . 74.31 110.505 177.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.8 t -79.17 161.78 26.21 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.186 -0.461 . . . . 72.12 110.602 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.445 HD13 ' N ' ' A' ' 13' ' ' ALA . 0.9 OUTLIER -145.9 125.76 13.54 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.754 -0.832 . . . . 71.15 108.754 179.136 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.977 ' HB1' ' HB3' ' A' ' 17' ' ' SER . . . -137.63 146.69 44.23 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.93 0.395 . . . . 73.52 110.887 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.65 -33.98 66.95 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.736 -0.665 . . . . 73.41 111.992 -175.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -82.1 53.13 2.15 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.261 0.467 . . . . 71.22 112.261 -175.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.1 mt 57.87 19.61 5.91 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 112.62 0.6 . . . . 74.42 112.62 173.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.977 ' HB3' ' HB1' ' A' ' 13' ' ' ALA . 38.4 t -84.0 -6.57 59.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.142 0.496 . . . . 72.24 110.503 -179.295 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.4 m -85.96 75.8 9.93 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.0 -0.545 . . . . 73.02 110.388 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -137.18 93.52 2.83 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.976 -0.557 . . . . 74.25 110.882 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.6 m -153.98 112.05 3.55 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.923 -0.58 . . . . 73.15 109.589 177.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.0 tt -140.33 124.07 17.24 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.025 -0.361 . . . . 71.33 110.025 -176.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -154.16 177.16 11.41 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.846 -0.798 . . . . 73.45 108.846 177.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.9 tt -75.63 159.9 5.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.91 -0.404 . . . . 74.11 109.91 -178.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.7 m -66.35 90.78 0.16 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.261 0.553 . . . . 75.41 110.247 176.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.704 ' HD3' ' H ' ' A' ' 25' ' ' LYS . 0.6 OUTLIER -82.16 24.32 0.66 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.598 -0.728 . . . . 74.52 111.432 -176.513 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -87.68 -178.16 6.02 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.959 -0.564 . . . . 72.31 110.504 -177.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 76.2 m95 -61.07 -22.81 64.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.998 -0.546 . . . . 74.43 112.386 -174.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.418 ' C ' ' H ' ' A' ' 30' ' ' VAL . 50.0 m 66.86 36.15 4.58 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 122.662 1.22 . . . . 73.33 107.954 179.288 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 -71.16 12.09 0.35 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 113.053 -1.885 . . . . 74.33 112.488 -171.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.418 ' H ' ' C ' ' A' ' 28' ' ' SER . 27.7 m -78.59 -35.52 18.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.594 -0.276 . . . . 74.41 111.361 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.573 ' HB3' HD12 ' B' ' 149' ' ' LEU . 26.1 p90 -84.45 -12.13 54.9 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 120.723 -0.391 . . . . 74.44 110.806 -178.435 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.543 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 8.8 t30 -60.54 -46.1 91.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.063 -0.517 . . . . 71.42 110.156 178.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.495 HG22 ' HB3' ' B' ' 179' ' ' LEU . 45.2 mm -62.66 -35.98 73.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-O 121.22 0.534 . . . . 74.4 110.439 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 72.0 mt -64.36 -39.18 93.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.758 -0.655 . . . . 71.41 110.225 178.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 57.3 ttt85 -69.51 -40.95 76.66 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.099 -0.501 . . . . 75.45 110.858 178.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.543 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 5.5 mm-40 -64.48 -31.08 72.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.831 0.348 . . . . 72.11 111.406 -178.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -100.52 1.35 40.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.02 0.438 . . . . 53.35 110.824 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 58.79 58.15 3.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.128 -0.942 . . . . 63.13 112.259 177.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -84.18 -2.86 57.62 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.478 -0.783 . . . . 73.45 109.388 169.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 60.68 75.09 0.48 Allowed Pre-proline 0 C--O 1.234 0.252 0 CA-C-N 114.912 -1.04 . . . . 74.23 111.114 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -82.54 159.21 16.86 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.632 2.222 . . . . 74.44 111.214 176.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.768 ' HD3' ' HB1' ' B' ' 150' ' ' ALA . 3.6 mptp? -75.21 -168.38 0.77 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.418 0.525 . . . . 74.24 112.418 -177.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 16.7 p90 -99.15 86.06 3.36 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 113.409 0.892 . . . . 75.25 113.409 -161.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.3 mm? 63.79 121.83 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.742 -1.117 . . . . 74.43 113.115 168.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 12.6 p -78.8 -4.42 49.33 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.358 0.599 . . . . 73.21 110.476 176.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -102.47 88.43 3.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.706 -0.679 . . . . 75.04 109.302 178.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.513 HG23 ' CZ ' ' B' ' 143' ' ' PHE . 31.5 t -101.95 127.21 55.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.471 -0.786 . . . . 74.22 109.291 174.031 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.525 ' H ' ' HD2' ' A' ' 48' ' ' LYS . 1.7 mptp? -81.06 140.69 34.97 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.471 -0.937 . . . . 75.43 108.471 178.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.562 HD21 ' HB3' ' B' ' 131' ' ' PHE . 21.0 tp -92.92 23.27 4.3 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 109.52 -0.548 . . . . 73.12 109.52 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.69 ' HB3' ' HD3' ' B' ' 142' ' ' LYS . . . -34.3 103.7 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 O-C-N 124.553 1.158 . . . . 64.15 112.895 -173.035 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.758 ' HB3' ' HA ' ' B' ' 141' ' ' PRO . 46.8 p90 -132.09 172.04 12.87 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.086 -0.961 . . . . 74.43 109.969 -178.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -101.46 115.11 29.77 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.277 0.56 . . . . 72.51 110.871 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.498 ' O ' ' HG2' ' A' ' 56' ' ' GLU . 41.9 t -112.31 99.84 8.33 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.432 -0.804 . . . . 61.05 110.454 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.6 t70 64.61 15.34 9.63 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.449 0.642 . . . . 73.42 110.817 176.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.17 -35.41 3.11 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.788 -0.72 . . . . 65.32 112.801 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.767 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 13.4 pt-20 -88.72 133.31 34.26 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.712 0.292 . . . . 75.12 110.902 -176.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.404 ' HA ' ' O ' ' A' ' 51' ' ' PHE . 47.9 mm -80.91 120.37 32.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 109.24 -0.652 . . . . 74.53 109.24 176.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.767 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 28.9 mmmt -111.2 112.27 23.93 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.932 0.396 . . . . 75.2 111.509 -173.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.498 HG21 ' HB1' ' A' ' 50' ' ' ALA . 1.0 OUTLIER -88.88 104.09 16.61 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.964 -0.562 . . . . 64.14 110.488 172.818 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.515 ' CD2' HD11 ' A' ' 66' ' ' LEU . 21.4 m-85 -120.32 142.74 48.84 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.054 -0.521 . . . . 75.23 110.953 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 32.9 p -137.05 -14.26 1.57 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.149 -0.932 . . . . 73.24 109.667 173.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.446 ' HB2' ' OG ' ' A' ' 65' ' ' SER . 9.3 m-20 -98.97 157.71 16.14 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.651 -0.704 . . . . 71.42 109.265 177.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.5 mp -92.72 -39.5 11.22 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.919 -0.4 . . . . 73.03 109.919 177.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -55.03 -43.83 74.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.895 -0.593 . . . . 74.3 111.408 178.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.446 ' OG ' ' HB2' ' A' ' 62' ' ' ASP . 16.9 p -65.42 -52.01 56.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.849 0.357 . . . . 74.14 110.891 -179.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.515 HD11 ' CD2' ' A' ' 60' ' ' PHE . 63.1 tp -63.47 -34.14 77.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.04 -0.527 . . . . 75.42 110.705 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.484 ' HG3' HD22 ' A' ' 84' ' ' LEU . 20.3 ttt180 -60.81 -40.16 91.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.786 -0.643 . . . . 74.44 110.297 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.407 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 46.1 mtmt -71.97 -45.11 62.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.99 -0.55 . . . . 74.22 110.737 174.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -58.89 -49.76 76.57 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.795 -0.639 . . . . 75.45 110.949 -175.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.57 -38.18 74.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.876 0.37 . . . . 74.03 111.501 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 42.9 m -70.77 -30.52 67.03 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.27 -0.423 . . . . 72.45 111.462 -177.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 13.1 pt20 -97.12 12.14 33.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.209 0.528 . . . . 74.22 110.662 178.214 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.421 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 26.2 mmmt -119.07 114.84 23.12 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.83 -0.623 . . . . 74.21 110.086 175.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.5 m -58.59 -33.42 69.96 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.247 0.546 . . . . 73.43 110.545 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 12.1 m -78.54 -23.64 46.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.884 -0.598 . . . . 73.33 111.974 -176.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.456 ' HE2' HD13 ' A' ' 66' ' ' LEU . 46.6 mtp -104.94 -18.28 14.24 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.792 0.664 . . . . 63.34 112.792 -176.249 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.555 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 81.8 tttt -72.92 -17.37 61.5 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.264 0.554 . . . . 73.33 110.208 -176.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.558 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 56.5 mm-40 -102.66 4.11 37.86 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.512 -0.767 . . . . 65.33 109.665 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.584 ' HB3' HG21 ' B' ' 133' ' ' ILE . 71.8 mt -100.61 -44.48 5.83 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.15 -0.932 . . . . 72.41 109.657 175.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.9 mt -97.09 0.02 47.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.862 -0.608 . . . . 74.01 110.691 -175.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.558 ' HD3' ' HA ' ' A' ' 78' ' ' GLU . 64.4 pttt -56.61 -22.69 35.69 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.195 -0.457 . . . . 74.12 111.781 178.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -75.73 -56.58 4.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.914 0.387 . . . . 73.45 110.879 178.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 29.8 m -80.64 -20.47 11.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.076 -0.511 . . . . 73.03 112.184 -172.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.484 HD22 ' HG3' ' A' ' 67' ' ' ARG . 10.7 mp -101.23 132.97 21.25 Favored Pre-proline 0 C--N 1.326 -0.449 0 N-CA-C 109.222 -0.658 . . . . 75.51 109.222 172.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 84' ' ' LEU . 32.2 Cg_exo -58.19 98.97 0.09 OUTLIER 'Trans proline' 0 C--O 1.236 0.378 0 C-N-CA 122.738 2.292 . . . . 64.55 112.515 -178.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -144.04 146.76 33.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.796 -0.638 . . . . 75.5 110.118 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -102.3 -23.48 13.98 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.339 -0.615 . . . . 74.34 109.339 173.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 115.336 -0.847 . . . . 75.13 110.564 -179.96 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.407 0 N-CA-C 112.182 -0.367 . . . . 61.42 112.182 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 22.5 m -105.21 -30.01 2.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 120.898 0.38 . . . . 63.1 111.121 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 93.9 mt -85.76 142.75 28.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.363 -0.38 . . . . 64.5 110.784 -178.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -78.46 -41.82 31.63 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.059 -0.719 . . . . 63.33 109.059 177.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -116.55 130.97 57.05 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.074 -0.966 . . . . 73.43 108.733 176.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -86.77 36.48 0.71 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.021 0.439 . . . . 74.31 111.499 -172.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -71.99 70.54 0.98 Allowed Glycine 0 CA--C 1.518 0.243 0 CA-C-N 116.056 -0.52 . . . . 74.01 112.492 177.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -130.45 -164.3 1.41 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.673 -0.491 . . . . 71.52 109.673 178.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 9.0 p -124.93 138.74 53.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 120.806 0.336 . . . . 72.03 110.558 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 6.8 mp -95.66 167.35 11.34 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.337 -0.392 . . . . 73.24 110.298 -179.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 9.1 t -72.91 161.94 30.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.23 -0.441 . . . . 63.41 110.4 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 57.7 tp -136.8 130.47 31.92 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.012 0.434 . . . . 71.31 110.588 -178.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 113' ' ' ALA . . . . . 0.521 ' HB2' ' HB2' ' B' ' 117' ' ' SER . . . -152.13 168.54 24.96 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.971 -0.558 . . . . 72.24 110.205 178.443 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -98.78 -49.36 4.6 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.185 -0.461 . . . . 63.41 111.546 -176.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -63.3 -64.33 0.94 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.604 -0.725 . . . . 74.12 111.239 -171.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -159.93 90.26 0.91 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.631 -0.713 . . . . 70.05 112.016 -173.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.521 ' HB2' ' HB2' ' B' ' 113' ' ' ALA . 64.1 m -154.82 -40.76 0.09 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.705 -0.679 . . . . 65.14 109.804 176.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 8.5 m -58.76 111.4 1.26 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.727 -0.669 . . . . 74.44 110.005 174.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -98.95 166.47 11.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.114 -0.494 . . . . 60.23 111.266 -176.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 9.8 m -73.86 131.1 41.15 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.631 -0.713 . . . . 75.13 110.176 177.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -76.96 174.45 10.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.842 0.353 . . . . 75.33 110.882 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 122' ' ' ASP . . . . . 0.483 ' OD1' HG23 ' B' ' 123' ' ' ILE . 4.5 t70 -155.85 -160.72 1.05 Allowed 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.772 -0.825 . . . . 73.41 108.772 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . 0.483 HG23 ' OD1' ' B' ' 122' ' ' ASP . 11.0 tt -68.03 132.06 32.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.334 0.588 . . . . 74.41 111.563 -177.208 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 34.2 p -76.25 132.69 40.03 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.923 -0.58 . . . . 75.41 110.385 176.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . 0.69 ' HD3' ' H ' ' B' ' 125' ' ' LYS . 0.0 OUTLIER -108.64 77.19 1.07 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.813 0.816 . . . . 73.15 111.456 -174.195 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -97.73 151.62 19.96 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.749 -0.66 . . . . 75.14 110.031 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 31.3 m95 -86.97 42.24 1.01 Allowed 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.633 0.605 . . . . 74.42 112.633 -169.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 49.4 m 74.62 15.2 3.34 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.813 0.816 . . . . 74.25 110.045 169.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 22.4 p-10 -65.09 -29.9 70.8 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.111 -1.404 . . . . 75.43 111.809 -176.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 48.6 t -64.71 -55.38 21.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.429 -0.35 . . . . 73.53 111.645 -178.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 131' ' ' PHE . . . . . 0.562 ' HB3' HD21 ' A' ' 49' ' ' LEU . 33.5 p90 -91.95 4.07 53.8 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.909 -0.316 . . . . 74.14 111.841 -175.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -63.77 -37.42 87.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.277 0.56 . . . . 71.21 109.979 175.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 133' ' ' ILE . . . . . 0.584 HG21 ' HB3' ' A' ' 79' ' ' LEU . 22.7 mm -64.33 -34.06 66.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.266 -0.879 . . . . 75.42 110.751 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 77.1 mt -66.92 -34.9 78.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.789 -0.641 . . . . 73.42 111.228 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -71.85 -41.27 68.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.909 0.385 . . . . 75.14 110.343 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -59.92 -46.77 88.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.954 -0.566 . . . . 73.32 111.172 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -92.53 3.18 56.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.139 -0.482 . . . . 75.4 111.349 -176.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 53.42 71.14 0.52 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.906 0.706 . . . . 63.13 112.906 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -89.65 -6.21 56.38 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.798 -0.637 . . . . 74.42 110.331 171.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 58.68 74.96 0.56 Allowed Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 115.486 -0.779 . . . . 74.04 110.81 178.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . 0.758 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 5.0 Cg_exo -74.77 -179.57 5.04 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.36 2.707 . . . . 75.03 111.801 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 142' ' ' LYS . . . . . 0.69 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 11.5 tptp -89.62 -152.58 0.25 Allowed 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 119.899 -0.72 . . . . 71.2 110.812 -178.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 143' ' ' PHE . . . . . 0.513 ' CZ ' HG23 ' A' ' 47' ' ' VAL . 9.6 p90 -79.62 176.78 9.4 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 120.973 0.416 . . . . 74.22 111.356 -170.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . 0.626 ' H ' HD23 ' B' ' 144' ' ' LEU . 1.5 mm? -62.51 128.42 35.94 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.46 -0.791 . . . . 75.54 111.518 -172.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 16.3 t -96.27 14.49 24.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.601 0.715 . . . . 73.05 109.227 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 -79.85 39.58 0.43 Allowed 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.495 -0.775 . . . . 74.42 110.508 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 89.5 t -78.65 122.18 33.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.868 -0.605 . . . . 73.52 111.098 -176.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.02 152.31 44.43 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 107.921 -1.14 . . . . 72.32 107.921 173.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.719 ' HB3' ' HD1' ' B' ' 151' ' ' PHE . 3.7 mm? -51.32 -51.45 54.29 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.212 0.32 . . . . 74.14 111.742 -175.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.768 ' HB1' ' HD3' ' A' ' 42' ' ' LYS . . . 47.32 36.67 4.99 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 123.976 0.797 . . . . 74.43 111.673 176.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 151' ' ' PHE . . . . . 0.719 ' HD1' ' HB3' ' B' ' 149' ' ' LEU . 28.5 p90 -87.66 167.68 13.67 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.867 -0.606 . . . . 73.1 109.992 -177.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -96.87 121.34 38.63 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.174 -0.466 . . . . 75.55 110.294 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 153' ' ' CYS . . . . . 0.438 ' HB2' ' CE2' ' B' ' 151' ' ' PHE . 48.7 t -122.06 113.2 19.2 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.795 -0.639 . . . . 74.52 109.635 176.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.1 t70 68.63 16.46 9.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.613 -0.721 . . . . 72.21 111.127 174.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 116.71 -32.25 5.59 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.568 -0.825 . . . . 62.52 112.827 178.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 156' ' ' GLU . . . . . 0.464 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 13.4 pt-20 -97.87 157.68 15.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.831 0.348 . . . . 75.35 110.67 -177.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.9 mm -92.23 123.55 44.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.388 -0.369 . . . . 73.13 110.389 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 158' ' ' LYS . . . . . 0.464 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 26.5 mmmt -106.59 103.82 13.36 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.987 0.422 . . . . 74.13 110.89 -177.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.17 96.25 10.48 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.084 0.468 . . . . 75.24 111.687 -179.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -110.34 123.82 50.54 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.962 -0.563 . . . . 74.21 110.046 174.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 16.2 m -93.8 -26.4 16.97 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.216 -0.661 . . . . 72.04 109.216 174.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 162' ' ' ASP . . . . . 0.416 ' HA ' HG21 ' B' ' 123' ' ' ILE . 5.0 p-10 -102.77 153.64 19.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.282 -0.872 . . . . 74.31 109.48 177.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -87.73 -20.09 26.7 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.744 0.307 . . . . 73.45 110.809 -176.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -64.11 -47.6 79.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.322 -0.399 . . . . 74.44 110.805 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 15.7 m -65.9 -35.46 80.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.549 -0.296 . . . . 62.33 110.97 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 65.3 tp -66.44 -43.4 85.72 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.02 0.438 . . . . 74.31 110.136 177.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . 0.48 ' HG3' ' CD2' ' B' ' 184' ' ' LEU . 68.4 ttt180 -62.12 -41.5 98.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.868 -0.606 . . . . 74.04 110.471 178.38 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -66.48 -41.65 88.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.996 -0.547 . . . . 64.04 110.887 177.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -62.69 -46.3 88.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 74.33 110.666 -179.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 170' ' ' ALA . . . . . 0.401 ' CB ' HD12 ' B' ' 180' ' ' LEU . . . -61.48 -30.42 70.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.29 -0.413 . . . . 75.03 111.518 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 20.4 m -82.75 -12.3 57.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.775 0.322 . . . . 72.01 111.652 -175.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -106.77 -1.99 22.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.436 0.636 . . . . 75.44 109.454 175.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -110.25 103.4 12.07 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.073 -0.967 . . . . 72.42 109.525 177.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 19.9 m -56.87 -32.11 65.5 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.9 0.381 . . . . 72.34 110.984 -177.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 6.2 m -66.11 -40.98 91.13 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.047 -0.524 . . . . 71.3 111.045 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 76.5 mtp -88.28 -21.15 24.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.392 -0.367 . . . . 64.42 111.077 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . 0.506 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 85.6 tttt -65.68 -23.09 66.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.308 0.575 . . . . 72.51 110.269 -179.261 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -95.59 -8.62 34.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.509 -0.769 . . . . 74.44 109.881 -178.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 179' ' ' LEU . . . . . 0.495 ' HB3' HG22 ' A' ' 33' ' ' ILE . 89.8 mt -94.04 -52.0 4.6 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 114.853 -1.067 . . . . 73.23 109.482 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 180' ' ' LEU . . . . . 0.401 HD12 ' CB ' ' B' ' 170' ' ' ALA . 6.0 mt -87.75 -12.45 45.16 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.791 -0.641 . . . . 71.45 112.368 -171.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 181' ' ' LYS . . . . . 0.506 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 64.2 pttt -62.15 -12.01 17.48 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.44 -0.504 . . . . 72.22 111.786 -178.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -70.03 -40.44 75.17 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.101 0.477 . . . . 74.01 110.445 175.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 25.9 m -104.65 -13.23 9.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.939 -0.573 . . . . 64.32 111.094 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 184' ' ' LEU . . . . . 0.48 ' CD2' ' HG3' ' B' ' 167' ' ' ARG . 9.1 mp -99.96 119.33 59.8 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 115.92 -0.582 . . . . 74.23 109.774 175.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -62.53 102.23 0.28 Allowed 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.779 2.319 . . . . 73.5 112.332 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -142.0 130.68 22.74 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.783 -0.644 . . . . 74.43 109.843 178.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 10.1 mtmp? -97.81 18.81 14.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.383 0.611 . . . . 75.52 110.357 178.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 . . . . . 0 C--O 1.25 1.127 0 CA-C-N 115.058 -0.974 . . . . 74.45 109.813 173.677 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.75 0 N-CA-C 112.3 -0.32 . . . . 72.12 112.3 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.484 HG11 HD23 ' A' ' 3' ' ' LEU . 14.8 p -119.48 -22.05 4.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.912 0.387 . . . . 55.43 110.765 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.484 HD23 HG11 ' A' ' 2' ' ' VAL . 2.7 mm? -83.23 162.38 21.22 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.229 -0.286 . . . . 73.32 110.229 177.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 95.1 mmm -96.2 67.81 2.6 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.997 0.427 . . . . 73.24 110.917 -176.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -169.51 152.96 4.93 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.608 -0.723 . . . . 74.02 109.826 178.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -127.13 170.33 12.49 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.801 0.334 . . . . 74.11 111.633 -176.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 136.07 106.37 0.82 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.061 -0.59 . . . . 73.02 111.742 -177.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -86.98 88.47 7.71 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.153 0.501 . . . . 73.11 111.567 -176.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 58.6 t -99.73 143.14 14.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.694 -0.685 . . . . 74.34 109.568 177.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -55.93 131.51 47.34 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.106 0.479 . . . . 74.41 110.507 178.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 50.9 m -119.64 143.99 47.4 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.939 -0.573 . . . . 74.35 110.823 -174.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.622 HD12 ' HB3' ' A' ' 18' ' ' SER . 57.0 tp -112.59 135.65 53.06 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.314 -0.403 . . . . 74.2 110.491 178.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -97.45 161.18 13.91 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.18 -0.464 . . . . 74.02 111.216 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.45 97.42 8.38 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.932 -0.576 . . . . 51.43 110.329 176.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 71.32 -27.33 0.17 Allowed 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.076 1.35 . . . . 74.53 113.417 167.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 85.8 mt -80.33 4.67 17.1 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.208 0.447 . . . . 71.51 112.208 -179.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.9 m -145.78 -29.44 0.42 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.779 0.323 . . . . 75.25 111.609 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.622 ' HB3' HD12 ' A' ' 12' ' ' LEU . 3.6 p -78.2 -26.86 47.71 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.917 0.389 . . . . 71.44 110.74 178.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -134.06 176.17 8.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.937 -0.574 . . . . 62.12 109.828 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 34.4 m -149.69 134.51 17.79 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 110.131 -0.322 . . . . 73.24 110.131 178.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -68.95 156.45 38.55 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.287 -0.415 . . . . 70.12 110.564 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -59.21 118.45 5.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 60.53 110.83 -178.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 6.2 tp -76.17 122.33 30.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.989 -0.55 . . . . 74.44 111.126 -178.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.2 t -133.87 167.74 20.03 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.696 -0.684 . . . . 65.11 109.33 177.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.455 ' HA ' ' HD2' ' A' ' 25' ' ' LYS . 29.8 mmmt -114.94 -15.92 11.74 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.828 0.346 . . . . 73.43 110.786 -179.267 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.626 ' HG3' HG23 ' B' ' 183' ' ' VAL . 30.5 mm-40 -109.96 104.51 13.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.957 -0.565 . . . . 75.2 109.708 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 23.1 m95 -90.9 -68.73 0.77 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.141 -0.481 . . . . 74.01 110.631 -174.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.5 m -127.94 28.46 5.56 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.897 -0.592 . . . . 74.2 110.757 -177.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -73.79 -5.23 39.59 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.593 0.711 . . . . 72.33 110.26 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.587 HG23 HD13 ' B' ' 163' ' ' LEU . 10.9 t -69.05 154.57 8.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.564 -0.744 . . . . 74.52 109.527 176.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.429 ' HB3' HD23 ' B' ' 149' ' ' LEU . 18.4 p90 58.77 -13.45 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 125.158 1.383 . . . . 74.23 114.653 176.02 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.475 ' H ' ' C ' ' A' ' 30' ' ' VAL . 9.7 t30 -57.33 -46.42 83.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.035 0.445 . . . . 54.04 111.023 -178.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.441 HG21 HD22 ' A' ' 37' ' ' ASN . 48.8 mm -64.56 -43.53 96.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.937 -0.574 . . . . 75.44 110.887 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.767 HD11 HD21 ' B' ' 149' ' ' LEU . 85.5 mt -65.25 -17.94 64.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 74.43 111.617 -178.078 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -79.93 -34.38 38.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.113 0.482 . . . . 75.14 110.115 175.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -71.88 -46.17 58.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.753 -0.658 . . . . 64.14 111.293 -176.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.453 ' OD1' ' HA ' ' A' ' 34' ' ' LEU . 11.9 p30 -91.15 -8.0 49.93 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.866 -0.606 . . . . 74.05 110.753 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.1 t0 55.39 73.33 0.43 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.174 -0.921 . . . . 70.45 112.077 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -86.02 12.91 8.46 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.129 -0.942 . . . . 75.41 110.241 170.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.554 ' O ' ' HA ' ' B' ' 151' ' ' PHE . 1.1 tm-20 66.54 73.28 0.39 Allowed Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 115.62 -0.718 . . . . 72.42 110.215 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -76.88 161.31 33.34 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 123.352 2.702 . . . . 72.45 111.959 -178.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.47 ' HD2' ' HA ' ' A' ' 42' ' ' LYS . 10.8 tptt -121.61 144.37 48.79 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 120.195 -0.602 . . . . 72.31 112.438 -176.045 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -164.71 96.72 0.75 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.432 -1.258 . . . . 75.35 109.284 -175.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.833 ' H ' HG12 ' B' ' 147' ' ' VAL . 6.1 mp -101.3 -5.34 25.58 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.973 0.416 . . . . 73.55 110.184 179.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.6 ' H ' HG22 ' B' ' 147' ' ' VAL . 11.3 t 70.26 25.33 4.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.893 -1.049 . . . . 74.15 110.658 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -80.36 76.98 7.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.008 -0.542 . . . . 74.14 109.813 176.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.698 HG13 ' H ' ' A' ' 48' ' ' LYS . 2.3 t -91.21 -155.46 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 109.208 -0.664 . . . . 64.34 109.208 -178.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.698 ' H ' HG13 ' A' ' 47' ' ' VAL . 0.2 OUTLIER -111.23 129.06 56.08 Favored 'General case' 0 CA--C 1.506 -0.738 0 C-N-CA 120.156 -0.617 . . . . 74.44 109.505 -175.78 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.981 HD22 HD11 ' B' ' 134' ' ' LEU . 47.2 tp -79.54 80.4 5.92 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 109.383 -0.599 . . . . 74.44 109.383 175.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.691 ' H ' ' HB2' ' B' ' 142' ' ' LYS . . . -88.4 77.06 8.2 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.514 -0.766 . . . . 63.14 110.146 178.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.573 ' HD1' ' HG ' ' A' ' 49' ' ' LEU . 43.7 p90 -93.77 168.76 10.79 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.638 -0.71 . . . . 73.34 110.919 -174.23 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.457 ' HE3' ' CD1' ' A' ' 57' ' ' ILE . 4.5 tppp? -96.78 114.08 25.68 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.999 -0.546 . . . . 63.42 110.368 -178.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.484 ' SG ' ' HE1' ' A' ' 69' ' ' PHE . 48.7 t -121.57 112.57 18.64 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.141 -0.481 . . . . 52.13 110.66 179.375 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.5 t70 68.88 0.98 2.94 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.298 -0.865 . . . . 74.54 112.456 171.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 127.98 -13.62 6.37 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.182 -1.009 . . . . 43.31 112.91 178.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.591 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 11.9 pt-20 -118.09 144.78 45.35 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.072 0.463 . . . . 75.22 110.272 177.417 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.457 ' CD1' ' HE3' ' A' ' 52' ' ' LYS . 41.0 mm -75.16 126.07 35.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.866 -0.607 . . . . 73.24 109.767 177.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.591 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 30.9 mmmt -114.17 117.51 31.4 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.187 -0.301 . . . . 75.24 110.187 -178.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.56 105.54 16.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.111 0.481 . . . . 70.14 111.458 178.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.436 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 25.5 m-85 -123.29 151.42 42.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.034 -0.53 . . . . 74.3 111.424 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.4 t -158.89 19.06 0.2 Allowed 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.075 -1.083 . . . . 74.11 108.075 173.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -129.88 117.05 19.55 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 114.809 -1.087 . . . . 75.31 109.373 -173.162 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.457 HD11 HD12 ' A' ' 84' ' ' LEU . 51.6 tp -65.38 -37.57 87.39 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.633 0.254 . . . . 74.23 110.535 179.192 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 44.5 tt0 -59.47 -50.39 74.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.09 0.471 . . . . 72.42 111.019 177.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.4 m -66.51 -42.09 87.85 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.101 -0.5 . . . . 71.13 110.881 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 36.4 tp -65.48 -33.17 75.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.271 -0.422 . . . . 63.01 110.714 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.549 ' HA ' HD22 ' A' ' 84' ' ' LEU . 54.3 ttp180 -57.95 -40.38 80.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.328 -0.396 . . . . 75.24 110.659 177.023 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -69.88 -40.61 75.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.081 -0.509 . . . . 74.3 111.228 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.553 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 33.9 t80 -74.66 -45.19 46.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 73.34 111.068 -176.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.48 -28.36 67.79 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.753 0.311 . . . . 74.34 111.028 -177.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 31.6 t -63.92 -29.32 70.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.137 -0.483 . . . . 73.31 111.18 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.553 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 13.5 pt20 -95.9 0.95 52.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.167 0.508 . . . . 73.15 110.199 -179.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.472 ' HD3' ' HA ' ' A' ' 73' ' ' LYS . 43.3 mmtt -102.74 111.38 23.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.944 -0.571 . . . . 71.44 111.067 -178.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.8 m -53.99 -35.53 61.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.019 -0.537 . . . . 64.52 111.228 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.2 p -81.8 -56.88 3.7 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.236 0.541 . . . . 74.1 111.28 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.495 ' HA ' HD11 ' A' ' 79' ' ' LEU . 74.9 mtp -66.23 -24.0 66.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.674 -0.694 . . . . 73.12 112.312 -173.238 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.418 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 45.4 tttm -61.9 -33.99 75.22 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.858 0.361 . . . . 74.15 110.989 179.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -87.76 -14.06 40.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.572 0.701 . . . . 73.04 109.517 -174.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.495 HD11 ' HA ' ' A' ' 76' ' ' MET . 84.8 mt -82.26 -48.19 11.52 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.746 -1.116 . . . . 71.44 109.302 175.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.436 ' O ' ' HB3' ' A' ' 84' ' ' LEU . 4.3 mm? -79.31 -24.3 42.92 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.145 -0.934 . . . . 73.14 112.077 -177.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.475 ' HA ' ' HG3' ' A' ' 86' ' ' GLN . 64.2 pttt -57.85 -16.84 13.06 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.486 0.55 . . . . 72.52 112.486 -174.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -81.1 -45.43 16.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.856 0.36 . . . . 74.03 111.178 -177.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 11.5 m -106.99 -2.19 9.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.225 0.536 . . . . 71.31 111.169 -174.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.731 HD13 ' HD2' ' A' ' 85' ' ' PRO . 40.6 tp -127.43 132.14 24.18 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 115.716 -0.675 . . . . 75.12 109.82 -176.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.731 ' HD2' HD13 ' A' ' 84' ' ' LEU . 76.6 Cg_exo -51.47 113.88 1.33 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 123.189 2.593 . . . . 73.43 113.079 179.209 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.475 ' HG3' ' HA ' ' A' ' 81' ' ' LYS . 83.6 mm-40 -127.92 -148.34 0.38 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.263 -0.881 . . . . 75.04 109.406 176.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.451 ' HD2' ' N ' ' A' ' 87' ' ' LYS . 3.2 mptp? -70.44 -29.52 66.12 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.245 -0.65 . . . . 73.34 109.245 173.136 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 16.0 mp0 . . . . . 0 C--O 1.235 0.305 0 CA-C-N 115.395 -0.82 . . . . 71.24 110.907 176.646 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.362 0 N-CA-C 111.802 -0.519 . . . . 74.44 111.802 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 26.8 m -74.84 -23.32 17.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.57 0.7 . . . . 64.25 109.949 176.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' LEU . . . . . 0.591 HD12 ' N ' ' B' ' 104' ' ' MET . 1.6 tm? -132.59 150.61 52.13 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.652 -1.24 . . . . 75.13 107.652 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' MET . . . . . 0.591 ' N ' HD12 ' B' ' 103' ' ' LEU . 90.1 mmm -77.94 79.91 4.4 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.313 0.578 . . . . 74.41 110.364 -178.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -170.67 -167.43 0.58 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.682 -1.229 . . . . 72.41 107.682 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -93.04 157.58 16.23 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.795 0.331 . . . . 75.33 110.374 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -86.61 -129.62 2.63 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.743 -0.741 . . . . 73.32 112.191 -179.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -146.21 146.94 30.98 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 110.324 -0.25 . . . . 63.41 110.324 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 40.7 t -74.91 -48.63 32.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.251 0.548 . . . . 75.43 110.267 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -155.33 145.31 21.59 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.331 -0.849 . . . . 74.11 109.837 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 86.9 m -148.49 128.73 13.77 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.578 0.228 . . . . 73.04 110.834 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 31.8 tp -67.34 122.0 16.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.054 -0.521 . . . . 74.23 110.23 175.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -74.05 107.04 6.01 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.972 -0.558 . . . . 74.04 111.484 -177.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -80.3 -3.67 50.32 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.616 -0.72 . . . . 71.35 110.8 -179.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -92.31 11.02 27.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.913 -0.585 . . . . 60.11 109.96 176.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 98.8 mt 69.09 87.16 0.12 Allowed 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.179 -0.919 . . . . 75.4 111.356 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 8.8 t -123.28 -39.49 2.46 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.539 -0.755 . . . . 75.32 109.058 175.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -32.86 64.47 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.449 -0.796 . . . . 74.22 110.859 177.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -121.34 132.54 54.84 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.257 -0.429 . . . . 74.14 110.833 -179.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 2.6 m -108.91 160.43 16.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.807 -0.633 . . . . 75.25 109.664 178.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -65.99 157.5 30.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.914 0.387 . . . . 74.43 110.915 177.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -66.46 126.57 29.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.924 -0.58 . . . . 75.5 111.093 -177.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . 0.46 HG13 ' H ' ' B' ' 125' ' ' LYS . 7.7 tp -93.03 135.81 26.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.856 -0.611 . . . . 72.31 110.636 -178.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 124' ' ' SER . . . . . 0.411 ' C ' ' H ' ' B' ' 126' ' ' GLN . 6.5 m -114.78 2.42 14.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.014 0.435 . . . . 71.23 110.231 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . 0.46 ' H ' HG13 ' B' ' 123' ' ' ILE . 31.6 mmmt 70.41 -36.18 0.35 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.081 -0.963 . . . . 73.35 112.498 -179.29 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 126' ' ' GLN . . . . . 0.411 ' H ' ' C ' ' B' ' 124' ' ' SER . 21.2 mm-40 -86.95 143.12 27.52 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.66 -0.496 . . . . 74.41 109.66 179.057 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 75.0 m95 -112.92 -166.99 1.13 Allowed 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.03 0.443 . . . . 65.13 110.295 -176.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 18.0 m -84.17 35.56 0.54 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.586 -0.734 . . . . 73.01 111.556 -174.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -86.89 7.22 28.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.643 0.735 . . . . 64.31 110.232 -178.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.431 HG13 ' N ' ' B' ' 131' ' ' PHE . 5.2 t -73.56 166.8 2.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.414 -0.812 . . . . 74.31 109.252 177.001 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 131' ' ' PHE . . . . . 0.647 ' HD1' HD21 ' A' ' 49' ' ' LEU . 57.2 m-85 73.41 -37.71 0.39 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.502 0.721 . . . . 75.44 112.13 177.503 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.408 ' H ' ' C ' ' B' ' 130' ' ' VAL . 9.9 t30 -55.11 -36.75 66.03 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.352 0.501 . . . . 74.44 112.352 -176.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 133' ' ' ILE . . . . . 0.45 ' CG2' ' HB3' ' A' ' 79' ' ' LEU . 40.6 mm -58.0 -50.7 77.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.922 0.391 . . . . 60.14 110.797 177.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.981 HD11 HD22 ' A' ' 49' ' ' LEU . 40.3 mt -69.35 -9.07 51.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.037 -0.528 . . . . 72.52 111.558 -178.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -82.34 -30.1 30.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.848 0.356 . . . . 71.12 110.109 176.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -73.62 -53.87 9.47 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.269 0.556 . . . . 73.1 110.324 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 137' ' ' ASN . . . . . 0.537 ' OD1' ' HA ' ' B' ' 134' ' ' LEU . 16.1 p30 -80.48 -14.04 58.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.233 -0.894 . . . . 74.33 111.606 -177.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 11.5 t70 55.85 70.91 0.59 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.754 0.787 . . . . 73.4 110.403 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 139' ' ' PHE . . . . . 0.51 ' O ' ' HB2' ' B' ' 140' ' ' GLU . 1.8 m-85 -86.15 26.63 1.0 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.181 -0.918 . . . . 73.32 110.462 178.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 140' ' ' GLU . . . . . 0.516 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 12.4 mm-40 70.36 61.34 0.5 Allowed Pre-proline 0 N--CA 1.464 0.258 0 O-C-N 123.951 0.782 . . . . 72.04 110.529 -177.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . 0.439 ' HD3' ' N ' ' B' ' 140' ' ' GLU . 6.5 Cg_exo -72.8 139.77 31.07 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.722 2.281 . . . . 54.53 112.073 -175.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 142' ' ' LYS . . . . . 0.691 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 13.6 mptt -111.86 135.96 51.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.952 0.406 . . . . 75.21 111.328 -178.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -162.75 90.32 0.7 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.932 -1.031 . . . . 74.23 108.508 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . 0.543 ' H ' HG11 ' A' ' 47' ' ' VAL . 3.0 mm? -86.6 -92.13 0.1 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 110.011 -0.366 . . . . 72.41 110.011 179.51 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 13.1 t -173.84 22.16 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.438 0.637 . . . . 74.52 109.953 177.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . 0.499 ' HB2' HG12 ' A' ' 47' ' ' VAL . 29.4 mt-10 -85.28 100.43 11.79 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.826 -0.624 . . . . 75.05 110.156 -178.179 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 147' ' ' VAL . . . . . 0.833 HG12 ' H ' ' A' ' 44' ' ' LEU . 1.7 t -125.48 -149.31 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.831 -0.622 . . . . 71.34 109.392 -177.083 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . 0.581 ' H ' HG11 ' B' ' 147' ' ' VAL . 1.3 mptt -113.5 122.91 48.71 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 108.662 -0.866 . . . . 73.42 108.662 177.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.767 HD21 HD11 ' A' ' 34' ' ' LEU . 65.9 tp -80.26 84.86 5.85 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.636 0.731 . . . . 72.52 109.147 174.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.565 ' HB1' HG23 ' B' ' 159' ' ' THR . . . -94.76 115.72 27.86 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 114.811 -1.086 . . . . 65.53 109.082 176.666 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 151' ' ' PHE . . . . . 0.554 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 44.8 p90 -130.78 164.78 24.39 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.084 -0.507 . . . . 73.42 110.716 -179.087 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -87.52 123.2 32.17 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.131 -0.486 . . . . 73.42 110.012 179.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 153' ' ' CYS . . . . . 0.576 ' SG ' ' HE3' ' B' ' 173' ' ' LYS . 38.1 t -133.69 104.58 6.4 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.342 -0.39 . . . . 73.41 110.546 178.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 15.0 t70 70.21 14.02 7.65 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.259 -0.882 . . . . 74.51 111.948 172.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 124.54 -29.72 4.9 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.424 -0.893 . . . . 71.54 112.953 176.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 156' ' ' GLU . . . . . 0.428 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 15.4 pt-20 -106.68 150.85 25.83 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 122.553 -0.38 . . . . 74.53 110.644 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 44.6 mm -84.77 127.34 39.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.555 -0.535 . . . . 74.12 109.555 177.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 158' ' ' LYS . . . . . 0.525 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 29.2 mmmt -107.52 112.05 24.63 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.498 -0.319 . . . . 75.02 110.557 -177.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 159' ' ' THR . . . . . 0.565 HG23 ' HB1' ' B' ' 150' ' ' ALA . 0.8 OUTLIER -86.35 103.54 15.02 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.921 0.391 . . . . 74.32 110.988 176.777 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 160' ' ' PHE . . . . . 0.441 ' HD2' HD11 ' B' ' 166' ' ' LEU . 20.4 m-30 -120.66 116.56 25.54 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.173 -0.467 . . . . 74.41 111.197 178.254 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 8.0 t -109.64 10.53 24.91 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.354 -0.98 . . . . 75.45 108.354 171.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -122.09 121.62 37.35 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 114.863 -1.062 . . . . 74.42 110.104 -177.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . 0.587 HD13 HG23 ' A' ' 30' ' ' VAL . 63.0 tp -65.96 -35.48 80.71 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.925 -0.398 . . . . 75.54 109.925 177.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -62.29 -42.29 99.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.941 -0.572 . . . . 75.22 110.813 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 43.6 m -67.15 -43.5 82.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.215 -0.448 . . . . 75.11 110.645 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . 0.441 HD11 ' HD2' ' B' ' 160' ' ' PHE . 64.5 tp -65.35 -38.0 88.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.253 -0.431 . . . . 73.33 110.532 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 36.6 ttp180 -58.37 -41.08 83.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.341 -0.391 . . . . 60.12 110.55 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 40.0 mtmt -65.19 -51.97 57.76 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.01 -0.541 . . . . 74.13 110.886 177.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -65.97 -44.8 83.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.296 -0.865 . . . . 72.1 111.266 -171.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.57 -30.52 71.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.374 -0.375 . . . . 62.33 111.511 -179.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 25.6 t -77.67 -20.47 53.67 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.495 -0.321 . . . . 71.14 111.111 -177.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -100.07 1.68 42.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.247 0.546 . . . . 75.02 110.618 178.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 173' ' ' LYS . . . . . 0.576 ' HE3' ' SG ' ' B' ' 153' ' ' CYS . 60.8 mmtt -102.18 118.11 36.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.57 -0.741 . . . . 73.15 109.58 173.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 4.2 p -59.01 -43.12 91.5 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.14 0.495 . . . . 40.22 111.007 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 4.5 m -69.6 -32.87 71.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.815 -0.63 . . . . 60.44 111.687 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 176' ' ' MET . . . . . 0.488 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 77.1 mtp -96.82 -10.85 25.76 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.698 0.258 . . . . 63.42 111.698 -172.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -56.58 -40.85 75.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.25 -0.432 . . . . 74.33 111.723 -177.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . 0.595 ' HA ' ' HD3' ' B' ' 181' ' ' LYS . 31.9 mt-10 -94.51 -0.31 54.74 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.262 0.553 . . . . 71.52 110.622 -173.456 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 179' ' ' LEU . . . . . 0.44 ' HB3' HG22 ' A' ' 33' ' ' ILE . 83.8 mt -83.21 -51.01 7.85 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.465 -0.789 . . . . 74.31 109.496 176.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 180' ' ' LEU . . . . . 0.625 ' HB3' HD12 ' B' ' 184' ' ' LEU . 3.7 mm? -92.01 1.54 57.13 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.775 -0.648 . . . . 73.31 111.481 -175.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 181' ' ' LYS . . . . . 0.595 ' HD3' ' HA ' ' B' ' 178' ' ' GLU . 63.8 pttt -65.19 -2.35 2.88 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.714 0.635 . . . . 73.34 112.714 -176.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -79.48 -31.0 42.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.357 0.599 . . . . 74.55 109.939 174.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 183' ' ' VAL . . . . . 0.626 HG23 ' HG3' ' A' ' 26' ' ' GLN . 5.3 p -107.23 -21.25 5.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.46 -0.791 . . . . 73.21 110.006 177.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 184' ' ' LEU . . . . . 0.625 HD12 ' HB3' ' B' ' 180' ' ' LEU . 10.1 mp -88.62 113.21 54.65 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 115.998 -0.547 . . . . 74.14 109.927 174.65 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -63.17 114.64 2.56 Favored 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 122.735 2.29 . . . . 72.34 112.461 -177.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -89.76 -168.93 2.28 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.918 -0.583 . . . . 72.12 110.314 177.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 187' ' ' LYS . . . . . 0.419 ' HD2' ' N ' ' B' ' 187' ' ' LYS . 2.6 mptp? -84.86 -25.11 28.24 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.825 -0.625 . . . . 74.23 110.173 -179.033 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 . . . . . 0 C--O 1.248 1.026 0 CA-C-N 115.562 -0.744 . . . . 64.33 109.903 177.834 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.864 ' HA2' ' SG ' ' A' ' 45' ' ' CYS . . . . . . . . 0 N--CA 1.48 1.597 0 N-CA-C 111.829 -0.509 . . . . 73.03 111.829 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 18.9 m -54.04 -36.73 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 CA-C-O 121.232 0.539 . . . . 72.1 110.725 178.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.563 HD12 ' HA ' ' A' ' 28' ' ' SER . 93.9 mt -136.43 137.46 40.48 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.492 -0.929 . . . . 75.25 108.492 173.06 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 68.7 mtm -118.01 21.8 12.6 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.973 0.416 . . . . 73.15 110.553 -175.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -55.96 119.94 6.63 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.347 -0.842 . . . . 65.25 111.413 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -89.0 84.98 6.61 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.439 -0.801 . . . . 73.31 110.161 178.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -84.84 -141.74 5.5 Favored Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 115.56 -0.745 . . . . 41.05 112.496 -178.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -140.98 -171.0 3.16 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 120.852 0.358 . . . . 65.34 110.754 -177.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 19.4 m -94.13 -150.91 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.743 -0.662 . . . . 74.51 110.054 177.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.421 ' N ' HD12 ' A' ' 10' ' ' LEU . 6.4 mp -70.69 87.82 0.69 Allowed 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.759 -0.46 . . . . 75.03 109.759 176.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 53.2 m -94.26 107.74 19.66 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.292 0.568 . . . . 65.21 111.241 -177.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.511 HD23 ' HA ' ' A' ' 16' ' ' LEU . 1.7 tt -94.77 125.6 39.53 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.24 -1.022 . . . . 74.41 108.24 174.66 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.694 ' HB3' ' O ' ' A' ' 16' ' ' LEU . . . -74.98 -165.22 0.36 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.398 -0.364 . . . . 75.14 111.702 -176.003 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.83 -77.39 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.837 0.68 . . . . 71.21 112.837 -173.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -83.03 -54.28 5.18 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.519 -0.919 . . . . 72.21 108.519 177.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.694 ' O ' ' HB3' ' A' ' 13' ' ' ALA . 4.7 mp -145.59 176.91 9.26 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 106.641 -1.614 . . . . 74.24 106.641 172.252 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.47 ' HA ' ' HB3' ' A' ' 13' ' ' ALA . 48.9 m -76.91 45.48 0.43 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.933 0.873 . . . . 74.12 110.125 177.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.462 ' H ' ' C ' ' A' ' 16' ' ' LEU . 29.6 t -120.22 118.62 30.96 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.356 -1.293 . . . . 62.35 109.216 -178.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -152.94 175.9 12.44 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.629 -0.26 . . . . 63.03 110.666 -177.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.8 m -66.63 139.41 57.87 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.472 -0.566 . . . . 72.12 109.472 175.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 21' ' ' LEU . 3.9 mm? -47.51 130.37 13.8 Favored 'General case' 0 N--CA 1.464 0.264 0 O-C-N 123.58 0.55 . . . . 75.31 112.018 -175.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -97.39 -167.6 1.56 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.385 -0.825 . . . . 74.22 110.914 -174.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 12.8 tt -97.73 -22.15 5.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 112.318 0.488 . . . . 74.55 112.318 -171.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.0 m -106.05 128.89 54.16 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.179 0.514 . . . . 71.3 112.069 -172.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.41 ' HD3' ' HA ' ' A' ' 25' ' ' LYS . 21.9 mmtm -117.86 98.77 6.52 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.567 0.698 . . . . 75.13 110.4 173.419 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.672 ' H ' ' NE2' ' A' ' 26' ' ' GLN . 0.0 OUTLIER -81.06 113.44 19.25 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 114.674 -1.148 . . . . 72.54 109.366 179.754 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.429 ' C ' ' H ' ' A' ' 29' ' ' ASN . 25.8 t-105 -115.08 35.07 4.5 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.688 0.756 . . . . 73.22 109.624 -179.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.563 ' HA ' HD12 ' A' ' 3' ' ' LEU . 3.4 m -77.44 31.5 0.15 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.378 -0.828 . . . . 73.14 111.209 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.429 ' H ' ' C ' ' A' ' 27' ' ' TRP . 8.7 t30 -79.8 85.96 5.41 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.105 0.478 . . . . 71.33 110.846 -176.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 58.3 t -125.97 -62.52 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.718 -0.674 . . . . 73.44 109.639 175.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.542 ' HB3' HD13 ' B' ' 149' ' ' LEU . 13.0 p90 -103.43 5.99 37.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.623 -0.717 . . . . 75.12 111.475 -177.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.614 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 9.2 t30 -59.3 -61.13 2.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.323 -0.399 . . . . 70.25 111.217 -174.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.535 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 1.7 mp -53.45 -41.59 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.44 -0.345 . . . . 65.11 111.508 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.1 mt -60.06 -40.49 89.66 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.13 -0.487 . . . . 73.32 111.27 178.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -67.83 -43.39 79.68 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 116.605 -0.27 . . . . 74.21 110.799 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.614 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 4.8 mm-40 -63.5 -38.93 93.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 70.3 111.005 -177.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -92.23 1.17 57.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 72.22 111.032 -178.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 56.77 53.45 8.28 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.608 -0.724 . . . . 72.1 112.371 177.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -81.37 -11.34 59.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.856 -0.611 . . . . 73.44 109.629 171.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 60.25 81.85 0.24 Allowed Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 114.506 -1.225 . . . . 72.43 111.734 176.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.583 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 20.9 Cg_exo -66.27 164.28 28.72 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.719 2.279 . . . . 74.3 110.969 175.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 1.132 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -78.58 -67.39 0.75 Allowed 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 119.595 -0.842 . . . . 64.11 110.476 -176.347 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.451 ' C ' ' H ' ' A' ' 45' ' ' CYS . 89.0 m-85 -128.82 143.38 50.89 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 108.966 -0.753 . . . . 73.12 108.966 175.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.41 HD22 ' N ' ' A' ' 44' ' ' LEU . 2.2 mm? -78.58 38.48 0.31 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.053 0.454 . . . . 74.21 109.834 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.864 ' SG ' ' HA2' ' A' ' 1' ' ' GLY . 5.0 t 61.66 25.29 15.22 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.824 0.821 . . . . 74.3 109.655 -173.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.6 147.98 22.51 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.836 -1.075 . . . . 74.25 109.235 176.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 29.6 m -137.0 151.35 27.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-O 121.196 0.522 . . . . 74.13 111.003 -178.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.94 136.28 32.07 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.406 -0.816 . . . . 75.54 109.396 175.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.68 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 11.0 mp -72.61 92.35 1.51 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.339 -0.391 . . . . 74.24 110.293 178.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.625 ' HA ' ' O ' ' A' ' 58' ' ' LYS . . . -87.56 70.25 9.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.966 -0.561 . . . . 75.41 109.834 175.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.68 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 45.3 p90 -100.92 169.29 9.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.622 -0.717 . . . . 72.24 110.527 -177.413 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -105.65 121.72 44.57 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.477 -0.328 . . . . 73.15 111.391 -176.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.555 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 48.5 t -110.18 103.62 12.34 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.109 -0.496 . . . . 65.0 109.891 175.136 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 65.01 12.81 8.21 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.676 0.621 . . . . 73.24 112.676 174.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.45 -28.94 4.9 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.402 -0.904 . . . . 63.13 112.482 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.404 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 12.0 pt-20 -95.54 131.92 41.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.015 0.436 . . . . 74.21 110.721 -179.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 50.0 mm -75.26 129.64 36.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.103 -0.499 . . . . 72.33 110.375 177.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.625 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 28.0 mmmt -113.05 155.36 25.0 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.078 -0.712 . . . . 64.44 109.078 178.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.4 p -128.45 108.82 10.86 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.001 0.429 . . . . 74.54 110.889 175.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.452 ' CD2' HD12 ' A' ' 66' ' ' LEU . 87.2 m-85 -121.17 123.69 42.9 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.94 -0.573 . . . . 73.23 111.27 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.7 p -116.82 -17.27 10.51 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.396 -0.82 . . . . 74.31 109.527 174.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -106.97 127.3 53.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.472 -0.786 . . . . 70.34 110.526 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.5 tt -65.35 -44.06 88.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.996 -0.547 . . . . 74.04 110.328 -176.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.534 ' O ' ' HG3' ' A' ' 68' ' ' LYS . 47.9 tp60 -58.55 -41.48 85.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.095 -0.502 . . . . 75.1 110.84 -177.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.7 m -62.91 -45.76 90.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.12 -0.491 . . . . 74.31 111.011 178.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.452 HD12 ' CD2' ' A' ' 60' ' ' PHE . 55.2 tp -70.35 -31.8 69.24 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 75.43 110.888 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.417 ' HG2' ' HG ' ' A' ' 84' ' ' LEU . 3.4 tmm_? -62.79 -29.22 70.54 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.173 -0.467 . . . . 72.31 110.378 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.534 ' HG3' ' O ' ' A' ' 64' ' ' GLN . 91.5 mttt -70.02 -46.16 65.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.352 0.596 . . . . 71.14 110.599 176.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -67.28 -48.8 66.6 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.186 -0.915 . . . . 73.53 110.956 -176.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.1 -26.69 67.58 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.17 -0.468 . . . . 72.22 111.636 -177.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 35.9 t -75.97 -23.53 55.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.559 -0.291 . . . . 75.53 111.472 -178.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -102.82 2.01 34.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.328 0.585 . . . . 74.34 110.299 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.555 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 28.2 mmmt -103.5 101.12 11.0 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.216 -0.902 . . . . 73.34 109.751 175.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.4 p -55.83 -33.32 64.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.04 0.448 . . . . 73.2 111.07 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.444 ' O ' HD12 ' A' ' 79' ' ' LEU . 3.0 m -62.34 -45.64 92.3 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.727 -0.669 . . . . 72.53 110.937 177.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 82.0 mtp -90.95 -13.51 33.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.159 -0.473 . . . . 74.12 111.482 -174.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.636 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 33.6 ttpt -75.24 -9.05 58.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.778 0.323 . . . . 72.21 110.709 -176.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -99.06 -5.06 31.0 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.904 0.859 . . . . 74.24 109.492 174.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.713 ' HB3' HG21 ' B' ' 133' ' ' ILE . 10.7 mp -97.62 -55.92 2.67 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.442 -1.254 . . . . 74.34 109.42 176.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.806 ' HB3' HD13 ' A' ' 84' ' ' LEU . 3.8 mm? -81.19 -7.79 59.63 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 114.806 -1.088 . . . . 74.42 112.111 -176.254 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.636 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 64.8 pttt -55.05 -20.22 9.03 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.812 0.339 . . . . 75.4 111.729 178.012 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -69.24 -33.69 73.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.348 -0.387 . . . . 74.22 111.219 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.511 HG13 ' CZ2' ' B' ' 127' ' ' TRP . 27.0 m -115.9 -8.3 12.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.018 0.377 . . . . 72.04 112.018 -175.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.806 HD13 ' HB3' ' A' ' 80' ' ' LEU . 8.3 mp -96.75 138.14 21.39 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.464 -0.334 . . . . 64.14 110.823 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_exo -66.38 107.44 1.2 Allowed 'Trans proline' 0 C--O 1.235 0.36 0 C-N-CA 122.71 2.273 . . . . 71.5 111.289 174.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 84.2 mm-40 -122.26 176.91 5.6 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.23 0.538 . . . . 70.35 110.78 -176.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -116.84 -45.84 2.76 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.218 -0.901 . . . . 73.24 109.835 175.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 . . . . . 0 C--O 1.235 0.312 0 CA-C-N 115.896 -0.593 . . . . 63.43 110.288 -178.994 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 N-CA-C 111.987 -0.445 . . . . 73.25 111.987 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 29.6 m -111.97 154.34 13.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.722 0.296 . . . . 73.55 110.621 179.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.38 129.54 39.1 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.51 -0.552 . . . . 73.5 109.51 179.349 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' MET . . . . . 0.426 ' HB2' ' HE3' ' B' ' 104' ' ' MET . 10.3 mtm -84.17 85.46 7.35 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.652 -0.703 . . . . 72.43 110.789 -174.306 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -115.96 143.87 44.85 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.299 -0.41 . . . . 75.23 110.758 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -119.86 138.32 53.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.178 -0.465 . . . . 73.34 110.224 177.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -137.03 -118.37 1.72 Allowed Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.696 -0.764 . . . . 61.41 112.528 -178.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -117.3 143.79 45.56 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.874 0.368 . . . . 64.32 110.973 -178.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 16.7 m -85.33 -158.87 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.599 -0.728 . . . . 71.4 110.816 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 110' ' ' LEU . . . . . 0.582 ' H ' HD12 ' B' ' 110' ' ' LEU . 5.7 mp -55.16 103.79 0.1 Allowed 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 110.14 -0.319 . . . . 64.42 110.14 177.187 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 26.4 m -119.65 129.71 54.71 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.419 -0.355 . . . . 71.42 111.21 -175.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . 0.416 HD22 ' N ' ' B' ' 113' ' ' ALA . 3.6 tt -91.07 132.7 35.86 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.941 -0.763 . . . . 71.23 108.941 175.538 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 113' ' ' ALA . . . . . 0.695 ' HB1' ' O ' ' B' ' 116' ' ' LEU . . . -73.67 -68.06 0.54 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.379 -0.373 . . . . 72.41 111.72 -175.571 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -144.62 -69.0 0.3 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.974 0.416 . . . . 74.43 110.674 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -105.03 -38.61 6.53 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 107.965 -1.124 . . . . 62.22 107.965 173.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.695 ' O ' ' HB1' ' B' ' 113' ' ' ALA . 5.4 mp -128.65 -170.47 2.27 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 107.035 -1.469 . . . . 75.02 107.035 169.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.444 ' HA ' ' CB ' ' B' ' 113' ' ' ALA . 44.6 m -96.29 53.78 1.36 Allowed 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.003 0.906 . . . . 65.41 109.322 173.593 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 16.5 t -82.11 96.82 7.91 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 114.587 -1.188 . . . . 74.12 110.167 -178.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -122.1 140.15 52.87 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.309 -0.405 . . . . 71.22 110.639 -179.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 1.4 m -66.57 -70.48 0.24 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.423 0.63 . . . . 61.14 110.706 -179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . 0.402 ' HA ' HD11 ' B' ' 121' ' ' LEU . 3.3 mm? -128.46 134.33 48.71 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 114.935 -1.03 . . . . 74.34 109.725 176.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -88.38 146.77 25.08 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 110.012 -0.366 . . . . 75.12 110.012 177.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 13.6 tt -79.06 -19.82 12.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.299 -0.41 . . . . 70.13 111.544 -175.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 14.4 m -87.36 100.52 12.78 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.984 0.421 . . . . 64.41 111.212 -175.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . 0.668 ' HD3' ' H ' ' B' ' 125' ' ' LYS . 0.3 OUTLIER -94.34 9.81 36.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.515 0.674 . . . . 72.43 109.594 172.394 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -79.32 130.7 35.71 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.291 -1.003 . . . . 62.41 108.291 173.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 127' ' ' TRP . . . . . 0.511 ' CZ2' HG13 ' A' ' 83' ' ' VAL . 29.0 t-105 -103.84 -93.16 0.34 Allowed 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.432 -0.507 . . . . 74.2 110.717 -173.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 41.8 m 52.25 24.12 2.69 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.01 0.433 . . . . 72.22 111.9 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -80.81 83.26 6.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.245 -0.434 . . . . 74.52 110.913 -174.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 57.4 t -128.31 -64.12 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.945 -0.57 . . . . 61.34 110.859 -179.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 29.7 p90 -63.44 -20.7 65.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.588 -0.733 . . . . 73.45 111.569 -177.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.43 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 30.0 t30 -58.13 -54.55 45.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.855 -0.612 . . . . 70.4 111.079 -179.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 133' ' ' ILE . . . . . 0.713 HG21 ' HB3' ' A' ' 79' ' ' LEU . 4.1 mp -62.0 -40.57 87.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.138 0.494 . . . . 73.41 110.651 -177.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 89.9 mt -64.27 -31.38 72.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.928 -0.578 . . . . 74.44 111.142 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 54.2 ttt-85 -70.52 -45.02 66.36 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.113 0.482 . . . . 72.01 110.359 177.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 136' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 14.6 mm-40 -66.25 -33.08 74.94 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.587 -0.733 . . . . 73.13 111.58 -176.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -100.22 7.99 44.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.707 0.289 . . . . 74.43 111.22 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 56.16 68.16 0.9 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.718 -0.673 . . . . 73.14 112.639 175.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 139' ' ' PHE . . . . . 0.412 ' O ' ' HB2' ' A' ' 51' ' ' PHE . 11.4 m-85 -97.96 1.86 48.4 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.996 -0.547 . . . . 75.15 110.377 173.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 140' ' ' GLU . . . . . 0.453 ' HG3' ' HZ3' ' B' ' 142' ' ' LYS . 18.4 tp10 66.81 71.57 0.44 Allowed Pre-proline 0 CA--C 1.534 0.362 0 O-C-N 123.886 0.741 . . . . 74.5 110.696 -178.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -74.18 160.3 42.7 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.648 2.232 . . . . 61.25 111.689 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 142' ' ' LYS . . . . . 0.453 ' HZ3' ' HG3' ' B' ' 140' ' ' GLU . 11.4 mptt -108.36 -156.23 0.58 Allowed 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.151 0.426 . . . . 71.31 112.151 -176.109 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 143' ' ' PHE . . . . . 0.43 ' H ' ' HB3' ' B' ' 142' ' ' LYS . 17.7 m-85 -50.4 123.23 8.23 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.308 -0.86 . . . . 74.22 112.343 -171.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -83.88 57.22 4.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.954 -0.566 . . . . 72.25 109.636 174.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 8.2 t 68.71 8.76 6.94 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.133 -0.94 . . . . 74.42 110.738 -176.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -103.21 108.64 19.92 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.736 -0.665 . . . . 65.34 109.442 177.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 147' ' ' VAL . . . . . 0.45 ' CG1' ' HA ' ' A' ' 45' ' ' CYS . 5.9 p -148.25 162.46 6.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 C-N-CA 120.909 -0.316 . . . . 74.12 110.566 -174.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -95.09 150.57 20.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.206 0.527 . . . . 72.04 110.648 -177.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.542 HD13 ' HB3' ' A' ' 31' ' ' PHE . 23.5 tp -98.2 15.11 25.43 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.402 -0.817 . . . . 74.44 109.02 172.663 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.639 ' HB1' HG22 ' B' ' 159' ' ' THR . . . -34.61 104.11 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 O-C-N 124.317 1.011 . . . . 74.42 113.242 -173.29 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 151' ' ' PHE . . . . . 0.583 ' HB3' ' HA ' ' A' ' 41' ' ' PRO . 50.5 p90 -119.04 174.23 6.43 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 114.921 -1.036 . . . . 75.53 109.543 -177.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -100.56 123.45 44.79 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.146 0.498 . . . . 70.41 111.578 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 153' ' ' CYS . . . . . 0.539 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 49.8 t -124.8 116.59 22.53 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.399 -0.819 . . . . 74.5 109.229 174.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . 0.504 ' CG ' ' HZ2' ' B' ' 173' ' ' LYS . 1.0 OUTLIER 63.29 17.58 10.36 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.462 -0.335 . . . . 72.04 111.469 178.542 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 110.44 -29.59 8.96 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.641 -0.79 . . . . 73.2 112.714 178.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 156' ' ' GLU . . . . . 0.613 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 12.7 pt-20 -93.79 146.66 23.71 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.051 0.453 . . . . 64.15 110.677 -177.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.7 mm -85.06 120.17 35.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.227 -0.442 . . . . 73.41 110.162 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 158' ' ' LYS . . . . . 0.613 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 28.4 mmmt -102.54 120.03 39.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.458 -0.337 . . . . 74.31 110.267 -178.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 159' ' ' THR . . . . . 0.639 HG22 ' HB1' ' B' ' 150' ' ' ALA . 2.5 p -95.69 110.52 22.64 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.118 -0.492 . . . . 74.12 112.164 -176.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 160' ' ' PHE . . . . . 0.56 ' CD2' HD13 ' B' ' 166' ' ' LEU . 61.5 m-85 -132.65 151.94 51.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.709 -0.678 . . . . 73.04 110.192 176.577 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 13.2 p -134.03 14.11 3.92 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.049 -0.523 . . . . 73.44 110.006 176.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -146.96 144.59 29.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.757 -0.656 . . . . 74.02 110.598 -176.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . 0.431 ' O ' HD12 ' B' ' 163' ' ' LEU . 2.6 tm? -78.19 -34.28 49.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.456 . . . . 75.52 110.679 -175.304 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -67.17 -46.77 73.0 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.688 0.28 . . . . 74.03 110.496 -178.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 41.8 m -61.42 -39.12 89.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.359 -0.382 . . . . 63.14 110.86 177.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . 0.56 HD13 ' CD2' ' B' ' 160' ' ' PHE . 62.5 tp -71.47 -31.83 67.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.423 -0.353 . . . . 71.54 110.858 179.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 21.5 ttm180 -57.5 -39.35 76.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.356 -0.384 . . . . 74.31 110.543 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -60.11 -51.95 67.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.942 -0.572 . . . . 75.22 110.591 177.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 169' ' ' PHE . . . . . 0.425 ' CZ ' ' HE2' ' B' ' 158' ' ' LYS . 73.9 t80 -66.16 -43.6 86.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.261 -0.881 . . . . 74.32 111.074 -176.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -59.9 -40.89 90.3 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.121 -0.491 . . . . 64.44 111.977 -177.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 12.8 t -78.54 -21.32 48.95 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.759 0.281 . . . . 73.21 111.759 -174.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -93.96 -13.53 26.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.193 0.521 . . . . 72.13 110.617 179.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 173' ' ' LYS . . . . . 0.539 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 27.7 mmmt -88.59 117.16 27.35 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.042 -0.526 . . . . 75.11 110.28 176.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 1.5 m -51.42 -46.26 62.89 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 123.449 0.468 . . . . 65.12 110.96 -179.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 5.4 m -67.26 -43.87 80.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.897 -0.592 . . . . 71.34 111.556 -179.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 176' ' ' MET . . . . . 0.421 ' HA ' HD13 ' B' ' 179' ' ' LEU . 73.5 mtp -80.09 -22.39 42.27 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.779 0.323 . . . . 74.44 111.712 -174.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . 0.452 ' HE2' ' HB3' ' B' ' 177' ' ' LYS . 33.8 ttpt -58.37 -38.94 78.28 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.02 -0.536 . . . . 75.53 110.851 -177.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -86.1 -3.23 58.91 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.644 0.735 . . . . 74.3 110.063 -174.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 179' ' ' LEU . . . . . 0.535 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 78.1 mt -94.48 -42.13 9.01 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 114.89 -1.05 . . . . 74.24 109.667 179.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 180' ' ' LEU . . . . . 0.602 ' HB3' HD12 ' B' ' 184' ' ' LEU . 4.0 mm? -96.38 -9.84 29.04 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.608 -0.724 . . . . 73.11 111.929 -176.29 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 181' ' ' LYS . . . . . 0.444 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 65.5 pttt -55.52 -17.61 5.7 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.838 0.681 . . . . 73.21 112.838 -177.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -70.9 -38.53 73.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.859 0.361 . . . . 43.23 110.687 179.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 31.5 m -107.67 -10.35 10.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.259 -0.428 . . . . 74.42 111.365 -176.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 184' ' ' LEU . . . . . 0.602 HD12 ' HB3' ' B' ' 180' ' ' LEU . 9.3 mp -99.6 147.21 33.06 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.272 -0.422 . . . . 72.12 110.316 177.498 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -69.2 96.24 0.54 Allowed 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 122.576 2.184 . . . . 63.01 112.413 178.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 -116.85 133.63 55.77 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.889 -0.782 . . . . 75.55 108.889 178.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -104.52 -52.25 2.93 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.101 -0.499 . . . . 73.41 111.238 -173.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 . . . . . 0 C--O 1.245 0.841 0 CA-C-O 118.217 -0.897 . . . . 71.31 110.287 -178.612 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.657 0 N-CA-C 111.593 -0.603 . . . . 74.22 111.593 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.7 p -126.44 -22.8 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 121.354 0.597 . . . . 75.33 109.824 177.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 88.0 mt -102.74 -174.83 2.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.602 -0.726 . . . . 74.03 109.926 177.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 19.3 ptp -130.19 80.63 1.96 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.575 0.702 . . . . 74.34 110.419 176.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -94.68 132.07 39.8 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.602 -0.726 . . . . 65.14 109.983 176.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -123.63 136.3 54.42 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.931 -0.577 . . . . 72.23 109.72 179.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -92.12 -152.85 29.24 Favored Glycine 0 N--CA 1.44 -1.039 0 C-N-CA 120.536 -0.84 . . . . 71.44 111.907 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -161.65 169.41 21.63 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 110.262 -0.273 . . . . 75.32 110.262 -177.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 61.7 t -76.61 115.43 18.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.165 -0.47 . . . . 74.22 109.829 175.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.659 HD21 ' H ' ' A' ' 10' ' ' LEU . 0.7 OUTLIER -90.4 106.96 18.85 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.115 0.484 . . . . 71.23 110.567 -178.573 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 31.8 m -144.4 112.57 6.4 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.139 -0.482 . . . . 74.54 110.231 178.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 31.5 tp -78.37 127.98 32.98 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.287 -0.415 . . . . 75.34 110.817 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.745 ' CB ' ' HA ' ' A' ' 17' ' ' SER . . . 58.23 55.25 5.21 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 115.19 -0.914 . . . . 75.44 112.452 174.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.98 90.68 5.97 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 115.65 -0.705 . . . . 75.4 109.855 173.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 25.1 t70 78.31 -47.09 0.44 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.876 -1.057 . . . . 64.45 111.664 174.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.6 mt -76.89 -32.89 57.75 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.867 0.365 . . . . 75.4 111.008 -178.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.745 ' HA ' ' CB ' ' A' ' 13' ' ' ALA . 17.4 m 56.61 36.04 27.02 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.602 -0.727 . . . . 63.22 111.356 -177.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.3 t 60.33 101.7 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.739 -1.118 . . . . 63.31 111.136 -174.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.51 -13.19 49.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.251 0.548 . . . . 73.54 110.017 177.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 23.8 m -78.35 144.67 35.79 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.494 -0.776 . . . . 74.14 110.029 176.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.22 116.53 9.76 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.995 0.426 . . . . 74.43 110.856 -178.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -70.18 134.06 47.72 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.679 -0.691 . . . . 74.12 110.721 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 13.9 tt -82.14 135.06 25.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.139 -0.482 . . . . 75.32 110.719 -178.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.2 m -60.97 126.32 26.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.951 -0.568 . . . . 70.13 110.914 179.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.533 ' H ' ' HD2' ' A' ' 25' ' ' LYS . 2.2 mptp? -87.41 1.88 52.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.071 0.462 . . . . 74.02 110.114 -178.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -63.79 132.98 52.59 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.364 -0.835 . . . . 74.42 110.253 -176.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -86.18 84.98 7.35 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.731 -0.668 . . . . 71.11 111.538 -172.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.6 m 53.8 69.41 0.71 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.612 -0.722 . . . . 64.1 111.235 176.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -97.05 17.07 17.84 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.772 -0.649 . . . . 72.41 110.119 -176.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 17.0 m -59.17 130.97 23.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.624 -0.716 . . . . 75.23 110.947 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.44 ' HB2' ' HB3' ' A' ' 41' ' ' PRO . 22.6 p90 51.42 12.01 0.14 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.77 1.228 . . . . 63.21 113.918 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.474 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 9.4 t30 -66.35 -53.09 40.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.878 0.37 . . . . 74.33 110.307 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.56 HG23 ' HB3' ' B' ' 179' ' ' LEU . 45.8 mm -58.07 -43.7 85.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.87 -0.604 . . . . 74.22 110.616 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.639 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 64.7 mt -60.3 -42.06 94.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.695 -0.684 . . . . 74.31 111.252 179.358 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -64.61 -42.43 95.54 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.408 -0.36 . . . . 75.4 110.185 -179.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 38.8 mm-40 -65.75 -32.81 74.56 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.257 -0.429 . . . . 73.21 111.32 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -99.67 7.16 45.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.947 0.403 . . . . 54.35 111.064 -178.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 56.65 54.63 7.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.433 -0.803 . . . . 75.4 112.278 177.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.639 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 7.9 m-85 -84.45 -7.94 59.12 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.13 -0.693 . . . . 74.54 109.13 168.271 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 64.15 88.14 0.12 Allowed Pre-proline 0 N--CA 1.455 -0.18 0 CA-C-N 114.633 -1.167 . . . . 74.2 111.685 179.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.44 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 51.1 Cg_endo -70.28 148.36 61.51 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.56 2.174 . . . . 75.42 111.362 175.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.582 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 3.6 tptp -85.85 -177.25 6.3 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 119.848 -0.741 . . . . 74.41 110.846 -179.306 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.633 ' HA ' HG13 ' B' ' 147' ' ' VAL . 12.7 t80 177.83 -33.23 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.847 -0.615 . . . . 52.45 110.059 -167.42 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.24 106.76 0.19 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.356 -0.838 . . . . 74.41 109.403 178.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.404 ' HB2' ' HB ' ' B' ' 147' ' ' VAL . 1.7 t -163.84 175.28 10.59 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.754 -0.832 . . . . 75.52 108.754 -173.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.418 ' CD ' ' H ' ' A' ' 46' ' ' GLU . 0.1 OUTLIER -86.57 53.73 2.91 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.657 0.741 . . . . 74.21 109.861 176.608 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.474 HG21 ' HB3' ' B' ' 145' ' ' CYS . 57.3 t -61.11 139.45 20.38 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 CA-C-N 115.217 -0.901 . . . . 75.45 109.466 176.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.567 ' O ' ' HB3' ' B' ' 142' ' ' LYS . 3.8 mptt -72.65 164.16 26.94 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 109.099 -0.704 . . . . 75.32 109.099 178.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.759 HD23 HD13 ' B' ' 134' ' ' LEU . 46.2 tp -111.26 78.87 1.15 Allowed 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 109.225 -0.657 . . . . 74.2 109.225 169.501 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.826 ' H ' ' HB2' ' B' ' 142' ' ' LYS . . . -90.95 83.33 5.64 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.196 -0.911 . . . . 74.34 109.506 176.051 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.528 ' HD1' ' HG ' ' A' ' 49' ' ' LEU . 31.2 p90 -103.53 170.94 7.64 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.427 -0.806 . . . . 75.42 109.732 -178.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -98.24 127.51 44.22 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 120.324 -0.55 . . . . 71.41 110.177 177.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.499 ' SG ' ' HE2' ' A' ' 69' ' ' PHE . 29.8 t -133.5 108.81 8.86 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.895 -0.593 . . . . 73.11 109.567 175.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 70.82 27.06 3.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.321 -0.854 . . . . 63.42 110.627 176.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 103.68 -36.48 4.32 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.482 -0.866 . . . . 71.34 112.771 177.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.448 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 10.7 pt-20 -91.77 148.95 21.86 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.211 0.529 . . . . 75.23 110.673 -178.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 50.7 mm -86.16 127.27 40.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.481 -0.781 . . . . 74.42 109.652 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.66 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 29.2 mmmt -112.58 128.26 56.31 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.421 -0.354 . . . . 62.22 110.331 -176.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.33 109.37 21.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.007 0.432 . . . . 70.24 111.189 179.15 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.66 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 35.5 m-85 -118.82 148.4 42.9 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.129 -0.487 . . . . 73.53 110.472 178.567 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 11.7 p -138.17 6.58 2.6 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.184 -0.462 . . . . 71.22 110.939 176.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -142.43 144.01 32.88 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.879 -0.415 . . . . 73.43 109.879 179.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.461 ' O ' HD11 ' A' ' 63' ' ' LEU . 1.4 tm? -72.11 -32.33 66.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.25 -0.432 . . . . 75.43 110.244 -179.355 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.414 ' NE2' HH21 ' A' ' 67' ' ' ARG . 7.0 tp60 -64.8 -44.98 88.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.97 0.414 . . . . 73.41 110.355 -178.066 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.4 m -64.69 -38.32 90.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.789 -0.641 . . . . 62.4 110.181 178.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.481 ' HA ' ' CE2' ' A' ' 60' ' ' PHE . 47.3 tp -70.83 -36.17 72.78 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.764 -0.653 . . . . 74.3 111.178 -177.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.414 HH21 ' NE2' ' A' ' 64' ' ' GLN . 56.8 ttp85 -54.48 -45.62 73.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.09 0.471 . . . . 74.24 111.2 178.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 39.0 mtmt -66.23 -38.6 88.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.983 -0.553 . . . . 73.14 111.076 -176.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.499 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 55.8 t80 -74.44 -39.32 62.64 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.239 0.542 . . . . 73.23 110.443 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.69 -23.89 66.18 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.013 -0.539 . . . . 73.4 111.449 179.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.1 t -74.94 -38.84 61.66 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.522 -0.308 . . . . 73.13 111.128 -179.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 20.6 pt20 -74.8 -28.2 60.62 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.006 0.431 . . . . 73.14 110.237 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.433 ' HE3' ' HB3' ' A' ' 73' ' ' LYS . 25.8 mmmt -79.23 109.9 13.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.942 -0.572 . . . . 75.34 110.68 176.192 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.5 p -61.53 -29.75 70.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.376 -0.374 . . . . 71.21 111.737 -176.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.7 p -76.4 -45.57 31.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.951 0.405 . . . . 63.22 110.973 178.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 81.2 mtp -71.42 -26.32 62.7 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.34 -0.391 . . . . 73.43 110.634 -178.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.539 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 26.1 ttpp -56.44 -29.3 61.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.906 -0.588 . . . . 74.54 111.081 177.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -96.36 -4.69 41.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.292 0.568 . . . . 73.14 110.641 -176.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.582 ' HB3' ' CG2' ' B' ' 133' ' ' ILE . 84.3 mt -91.97 -46.95 7.55 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.314 -0.857 . . . . 71.14 109.421 177.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.78 -11.6 53.12 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.318 -0.856 . . . . 74.15 111.693 -177.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.539 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 62.6 pttt -60.17 -18.59 49.04 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.372 0.508 . . . . 72.41 112.372 -177.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.53 -44.53 86.58 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.128 0.489 . . . . 62.31 110.399 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.593 HG13 ' ND2' ' B' ' 129' ' ' ASN . 23.1 m -98.46 -11.1 8.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.83 -0.623 . . . . 74.01 111.107 -177.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.9 mt -110.0 94.26 17.22 Favored Pre-proline 0 C--N 1.325 -0.497 0 N-CA-C 109.334 -0.617 . . . . 75.25 109.334 174.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -69.01 104.2 1.16 Allowed 'Trans proline' 0 C--O 1.235 0.334 0 C-N-CA 122.804 2.336 . . . . 72.15 112.168 -178.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -90.39 86.44 6.46 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.342 0.592 . . . . 74.11 111.676 -175.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 52.8 mttp -104.9 -56.92 2.1 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.492 -0.776 . . . . 74.3 109.325 169.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 . . . . . 0 C--N 1.324 -0.529 0 CA-C-N 115.701 -0.682 . . . . 75.41 110.461 179.112 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 N-CA-C 111.969 -0.453 . . . . 75.24 111.969 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 27.9 m -90.8 2.41 7.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.035 0.445 . . . . 72.2 111.007 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 85.0 mt -95.36 108.63 20.83 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.901 -0.59 . . . . 74.34 109.613 177.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 19.0 ptp -82.13 79.96 8.49 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.614 0.721 . . . . 70.45 111.841 -174.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -176.91 124.12 0.15 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.069 -0.969 . . . . 75.02 109.814 176.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -90.79 123.07 34.06 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.175 -0.466 . . . . 71.21 110.145 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -81.74 95.85 1.74 Allowed Glycine 0 N--CA 1.442 -0.958 0 CA-C-N 115.836 -0.62 . . . . 71.44 112.178 -176.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -82.91 158.59 22.58 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 110.041 -0.355 . . . . 75.1 110.041 176.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 30.6 m -81.3 147.09 6.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-O 120.825 0.345 . . . . 73.32 110.639 179.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 110' ' ' LEU . . . . . 0.648 HD21 ' H ' ' B' ' 110' ' ' LEU . 2.5 pt? -94.54 131.59 40.11 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.179 0.514 . . . . 73.15 110.713 -177.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 24.6 m -103.46 112.41 25.3 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.024 -0.534 . . . . 74.44 109.814 176.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 40.7 tp -67.21 115.08 6.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.166 -0.47 . . . . 74.21 110.327 176.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . 56.35 -152.39 0.38 Allowed 'General case' 0 C--N 1.331 -0.234 0 O-C-N 123.89 0.744 . . . . 74.24 110.959 -179.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -175.23 -62.2 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.635 -0.876 . . . . 74.1 108.635 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -153.99 29.53 0.46 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.141 -0.936 . . . . 75.13 108.768 173.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 99.7 mt -137.94 -8.99 1.58 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.205 -0.907 . . . . 72.24 111.392 -177.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 42.4 m 56.87 25.56 10.59 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.106 0.563 . . . . 71.12 112.301 -176.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 49.1 m 65.87 139.59 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.526 0.679 . . . . 54.14 112.509 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -95.23 10.92 34.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.958 -0.564 . . . . 62.12 110.367 178.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 15.0 m -96.73 135.58 38.46 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.795 -0.639 . . . . 74.4 110.668 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -86.86 136.13 33.08 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.918 0.39 . . . . 65.01 110.635 178.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.82 146.1 54.79 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.788 -0.642 . . . . 71.02 111.35 -178.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 13.1 tt -91.08 133.06 33.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 109.931 -0.396 . . . . 72.21 109.931 176.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 13.2 m -66.89 115.7 6.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.417 -0.356 . . . . 72.4 111.528 -174.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . 0.433 ' H ' ' HD2' ' B' ' 125' ' ' LYS . 1.5 mptp? -83.82 -2.27 56.04 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.362 0.601 . . . . 75.32 109.841 177.145 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -92.68 97.38 10.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.437 -0.801 . . . . 73.14 110.168 -178.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 34.2 m95 -72.94 -45.88 55.63 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.663 -0.699 . . . . 75.22 110.449 -177.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 68.0 m -82.94 43.52 0.86 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.9 -0.591 . . . . 71.2 111.426 -176.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . 0.593 ' ND2' HG13 ' A' ' 83' ' ' VAL . 28.7 t-20 -102.88 -26.87 12.96 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.636 0.255 . . . . 70.04 110.602 176.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.41 HG11 ' CD2' ' B' ' 131' ' ' PHE . 32.8 t -57.47 117.05 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 73.13 110.692 -177.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 131' ' ' PHE . . . . . 0.484 ' HB3' HD22 ' A' ' 49' ' ' LEU . 22.1 p90 52.67 10.63 0.15 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.955 1.302 . . . . 74.12 113.426 -178.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.46 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 8.9 t30 -69.98 -44.31 69.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.522 0.201 . . . . 72.24 110.844 -177.296 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 133' ' ' ILE . . . . . 0.582 ' CG2' ' HB3' ' A' ' 79' ' ' LEU . 50.3 mm -58.24 -43.54 86.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.395 0.617 . . . . 64.31 110.414 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.759 HD13 HD23 ' A' ' 49' ' ' LEU . 61.1 mt -67.4 -29.98 69.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.616 -0.72 . . . . 73.35 110.711 178.194 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -71.82 -41.56 68.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.988 -0.551 . . . . 74.51 110.1 178.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 136' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 11.1 mm-40 -66.7 -37.17 84.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.922 -0.581 . . . . 74.24 111.461 179.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -96.42 -0.64 48.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.468 -0.333 . . . . 74.13 111.36 -176.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 38.4 t70 58.34 69.24 0.75 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.648 0.737 . . . . 74.24 112.043 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 139' ' ' PHE . . . . . 0.543 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 3.2 m-85 -97.54 7.34 46.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.529 -0.759 . . . . 70.25 109.501 170.745 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 62.14 79.15 0.28 Allowed Pre-proline 0 C--N 1.332 -0.177 0 CA-C-N 114.61 -1.177 . . . . 74.55 111.046 -176.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.51 156.34 66.53 Favored 'Trans proline' 0 N--CA 1.464 -0.242 0 C-N-CA 122.388 2.059 . . . . 75.13 110.33 173.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 142' ' ' LYS . . . . . 0.826 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 23.3 tptt -83.2 174.32 10.87 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 119.296 -0.962 . . . . 75.21 110.548 -178.075 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 143' ' ' PHE . . . . . 0.494 ' H ' ' HG3' ' B' ' 142' ' ' LYS . 58.2 t80 -168.36 -33.79 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.688 -0.687 . . . . 74.2 110.279 -170.399 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 56.7 tp -62.97 95.31 0.08 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.206 -0.906 . . . . 75.44 111.087 179.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 145' ' ' CYS . . . . . 0.474 ' HB3' HG21 ' A' ' 47' ' ' VAL . 49.1 t -154.79 159.13 40.4 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.734 -0.667 . . . . 74.45 109.29 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -90.15 81.45 6.15 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.433 0.635 . . . . 75.04 110.791 -177.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 147' ' ' VAL . . . . . 0.633 HG13 ' HA ' ' A' ' 43' ' ' PHE . 3.0 p -96.92 152.02 4.02 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.366 -0.834 . . . . 72.13 108.983 173.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . 0.421 ' H ' ' HD2' ' B' ' 148' ' ' LYS . 0.0 OUTLIER -81.86 132.29 35.27 Favored 'General case' 0 CA--C 1.509 -0.618 0 C-N-CA 120.006 -0.678 . . . . 71.42 109.341 -176.031 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.642 ' HG ' ' HD1' ' B' ' 151' ' ' PHE . 56.5 tp -75.11 83.52 2.32 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.263 0.554 . . . . 75.2 109.678 177.314 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.582 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -91.5 76.9 5.8 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.289 -0.869 . . . . 63.22 109.863 177.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 151' ' ' PHE . . . . . 0.642 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 42.3 p90 -94.01 167.87 11.32 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.52 -0.764 . . . . 73.31 110.323 -176.122 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -99.58 113.89 26.59 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 121.248 0.547 . . . . 74.23 110.66 179.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 153' ' ' CYS . . . . . 0.586 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 44.1 t -110.22 102.47 11.14 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.507 -0.769 . . . . 74.31 110.098 179.377 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 15.0 t70 68.91 17.93 8.59 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 115.545 -0.752 . . . . 73.01 111.234 175.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 122.26 -34.73 3.72 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.204 -0.998 . . . . 64.04 112.882 177.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -94.61 150.16 20.51 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.624 0.249 . . . . 72.13 110.611 -178.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.9 mm -84.23 131.39 34.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 109.899 -0.408 . . . . 74.12 109.899 175.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 158' ' ' LYS . . . . . 0.592 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 31.8 mmmt -120.98 129.81 53.57 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.032 -0.358 . . . . 74.35 110.032 178.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.83 107.14 17.88 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.102 0.477 . . . . 74.41 111.85 -176.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 160' ' ' PHE . . . . . 0.592 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 42.6 m-85 -120.47 135.54 55.03 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.18 -0.463 . . . . 75.32 110.78 178.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 31.4 p -120.7 10.12 10.92 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.103 0.478 . . . . 65.32 110.461 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -144.2 138.76 28.29 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.829 -0.623 . . . . 74.21 110.543 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -74.77 -39.31 61.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.864 -0.607 . . . . 75.41 110.275 -176.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -60.8 -45.67 93.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.086 0.469 . . . . 74.13 110.64 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 165' ' ' SER . . . . . 0.547 ' HA ' ' HE2' ' B' ' 168' ' ' LYS . 23.8 m -60.71 -38.21 84.29 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.815 -0.629 . . . . 73.23 110.63 176.282 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 53.3 tp -70.55 -32.08 69.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.093 -0.503 . . . . 73.22 111.091 -178.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -59.45 -38.27 80.29 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.666 0.27 . . . . 73.23 110.504 177.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 168' ' ' LYS . . . . . 0.547 ' HE2' ' HA ' ' B' ' 165' ' ' SER . 56.9 mtmt -61.6 -46.58 89.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.274 0.559 . . . . 73.32 110.588 177.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 169' ' ' PHE . . . . . 0.497 ' O ' ' HG2' ' B' ' 172' ' ' GLN . 66.9 t80 -66.67 -43.41 84.57 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.406 -0.816 . . . . 72.53 110.327 -179.465 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -60.8 -36.13 78.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.002 -0.545 . . . . 74.43 111.2 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 45.3 m -74.62 -22.25 59.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.487 -0.324 . . . . 65.44 111.849 -176.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . 0.497 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 13.7 pt20 -95.54 -7.73 37.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.091 0.472 . . . . 74.05 110.454 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 173' ' ' LYS . . . . . 0.586 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 30.1 mmmt -96.86 119.56 35.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.858 -0.61 . . . . 72.54 110.138 179.18 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 24.1 m -56.51 -37.59 70.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.99 0.424 . . . . 72.23 110.805 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 11.2 p -76.02 -49.83 16.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.678 -0.692 . . . . 74.01 111.521 -178.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 176' ' ' MET . . . . . 0.487 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 81.1 mtp -74.57 -22.3 59.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.092 -0.504 . . . . 74.34 111.996 -173.363 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -62.63 -25.91 68.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.136 0.493 . . . . 64.53 111.014 -178.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -103.27 8.31 38.33 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.612 0.72 . . . . 75.35 110.544 -177.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 179' ' ' LEU . . . . . 0.56 ' HB3' HG23 ' A' ' 33' ' ' ILE . 97.3 mt -103.31 -49.36 3.74 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.049 -0.978 . . . . 74.44 110.28 176.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 180' ' ' LEU . . . . . 0.496 ' HB3' HD13 ' B' ' 184' ' ' LEU . 4.0 mm? -85.05 -17.91 35.97 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.671 -0.695 . . . . 73.44 112.312 -174.1 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 59.2 pttt -64.26 -20.55 66.13 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.69 0.281 . . . . 74.22 111.665 -174.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -67.92 -47.99 67.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.977 0.418 . . . . 74.12 110.548 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 183' ' ' VAL . . . . . 0.416 HG21 ' HG ' ' B' ' 184' ' ' LEU . 31.4 m -91.82 -21.58 6.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.955 -0.566 . . . . 75.13 111.279 -177.377 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 184' ' ' LEU . . . . . 0.496 HD13 ' HB3' ' B' ' 180' ' ' LEU . 87.7 mt -110.08 101.91 49.1 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 109.147 -0.686 . . . . 74.2 109.147 176.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.06 109.17 0.34 Allowed 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 123.226 2.617 . . . . 62.11 112.84 -174.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -120.16 96.27 5.09 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.855 -0.611 . . . . 65.43 110.33 176.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -106.15 -58.26 1.94 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.153 -0.684 . . . . 74.4 109.153 175.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 . . . . . 0 C--O 1.245 0.83 0 CA-C-N 115.386 -0.825 . . . . 74.14 109.604 178.869 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.544 0 N-CA-C 112.363 -0.295 . . . . 64.45 112.363 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.497 HG23 HD22 ' A' ' 3' ' ' LEU . 7.3 p -73.12 -38.54 55.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.69 -0.485 . . . . 61.14 109.69 176.798 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.497 HD22 HG23 ' A' ' 2' ' ' VAL . 2.9 mm? -128.0 103.63 7.34 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.598 -0.89 . . . . 73.24 108.598 171.405 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 80.5 mtp -80.97 -64.4 1.2 Allowed 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.198 -0.456 . . . . 74.13 110.837 -173.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -125.3 161.47 26.88 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.183 -0.462 . . . . 72.23 110.275 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -164.76 102.01 0.79 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.433 -0.58 . . . . 42.42 109.433 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -148.04 99.75 0.2 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.66 -0.781 . . . . 70.12 112.747 -177.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -86.78 118.0 25.9 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.727 0.298 . . . . 71.3 110.706 178.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.9 t -90.92 127.1 43.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 120.79 0.328 . . . . 75.42 110.769 -178.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -88.27 143.64 26.91 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.508 -0.553 . . . . 71.22 109.508 176.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 60.9 m -152.53 126.46 9.04 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.804 0.335 . . . . 74.41 111.483 -178.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.441 HD22 ' H ' ' A' ' 13' ' ' ALA . 0.5 OUTLIER -150.23 148.15 28.55 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.408 -0.59 . . . . 73.42 109.408 176.328 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.441 ' H ' HD22 ' A' ' 12' ' ' LEU . . . -94.63 116.67 29.04 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.822 0.344 . . . . 73.21 110.354 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.485 ' O ' ' HB2' ' A' ' 18' ' ' SER . . . -69.18 -57.38 5.45 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.945 -0.571 . . . . 73.25 111.966 -176.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -99.72 -22.1 15.52 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.905 -0.318 . . . . 74.12 111.419 -173.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 75.7 mt -96.85 15.78 21.14 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.036 0.384 . . . . 70.33 112.036 -176.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.426 ' CB ' ' HB2' ' A' ' 13' ' ' ALA . 15.1 t -160.23 -52.65 0.05 Allowed 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 121.097 -0.241 . . . . 70.44 110.974 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.868 ' HB3' ' HE3' ' B' ' 177' ' ' LYS . 30.0 m -74.42 113.14 11.31 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.038 0.447 . . . . 70.34 112.145 -176.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -155.9 -151.2 0.33 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.738 -0.664 . . . . 71.02 109.395 175.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.1 m -152.37 96.75 2.2 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.631 -0.507 . . . . 70.02 109.631 172.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 66.8 mt -105.3 -37.63 6.79 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.116 -0.493 . . . . 75.35 111.921 -176.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -104.14 175.3 5.53 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.659 -0.701 . . . . 71.51 110.418 -174.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 5.6 tp -106.58 118.02 53.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.477 0.656 . . . . 73.31 111.384 -176.114 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.457 ' HB3' ' HA ' ' B' ' 184' ' ' LEU . 5.4 m -65.25 138.98 58.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.555 -0.748 . . . . 70.42 110.452 177.5 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.704 ' HB3' ' HZ2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -118.83 13.47 13.18 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.438 0.533 . . . . 75.34 112.438 -174.522 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.568 ' HB2' ' O ' ' B' ' 183' ' ' VAL . 2.8 mp0 -99.49 146.12 26.72 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.818 -0.438 . . . . 74.2 109.818 176.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 12.6 t-105 -115.93 12.17 15.67 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.212 0.449 . . . . 75.0 112.212 -170.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.4 p -81.78 32.68 0.37 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.348 0.594 . . . . 75.32 111.46 -177.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -90.57 1.26 56.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.964 -0.562 . . . . 73.42 110.132 -174.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.0 m -71.15 83.54 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 112.355 0.502 . . . . 72.23 112.355 -177.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.581 ' HB3' HD12 ' B' ' 149' ' ' LEU . 36.0 p90 48.89 12.28 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 125.223 1.409 . . . . 75.33 114.549 175.265 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -67.28 -57.17 7.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.839 0.352 . . . . 75.01 111.618 -175.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.485 HG21 ' HB3' ' B' ' 179' ' ' LEU . 48.7 mm -62.38 -37.81 79.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.367 0.603 . . . . 74.15 111.136 -177.245 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.4 mt -59.2 -33.15 70.62 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.332 -0.849 . . . . 74.25 111.551 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 51.4 ttt180 -68.56 -46.87 68.33 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.07 0.462 . . . . 71.22 110.406 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -69.04 -27.68 65.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.396 -0.82 . . . . 75.44 111.645 -173.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -106.61 6.83 30.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.548 -0.296 . . . . 72.43 111.19 -177.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.2 t70 58.55 69.89 0.69 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 115.494 -0.776 . . . . 75.53 111.919 175.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -98.76 3.13 47.48 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.697 -0.683 . . . . 74.42 111.037 172.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 58.02 71.37 1.06 Allowed Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 115.943 -0.571 . . . . 73.41 110.783 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -87.31 166.7 7.92 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.616 2.211 . . . . 75.13 112.505 -178.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.782 ' HB2' ' HA ' ' B' ' 149' ' ' LEU . 0.2 OUTLIER -105.93 -167.12 1.27 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.333 -0.394 . . . . 75.43 110.413 177.319 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.405 ' H ' ' HB3' ' A' ' 42' ' ' LYS . 32.6 p90 -132.61 179.11 6.34 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.251 0.463 . . . . 74.11 112.251 -170.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.673 ' HA ' HG12 ' B' ' 147' ' ' VAL . 3.3 mm? -97.92 142.21 29.94 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.218 -1.03 . . . . 73.22 108.218 169.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 11.6 t -130.95 -151.68 0.48 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.772 0.32 . . . . 74.21 110.735 -170.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -135.86 144.44 45.62 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 109.101 -0.703 . . . . 73.54 109.101 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.717 HG13 HD13 ' B' ' 144' ' ' LEU . 1.9 t -91.88 129.26 42.81 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-O 121.516 0.674 . . . . 73.53 110.106 172.189 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.428 ' HD2' ' O ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -128.66 129.21 45.52 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.995 -1.002 . . . . 74.41 109.59 178.226 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.771 ' HA ' ' HB2' ' B' ' 142' ' ' LYS . 0.2 OUTLIER -75.71 90.96 2.87 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 120.492 -0.483 . . . . 75.41 109.815 178.21 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.16 90.58 1.58 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.506 -0.77 . . . . 74.01 109.348 173.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.421 ' HA ' ' O ' ' B' ' 140' ' ' GLU . 53.9 p90 -107.16 166.84 10.33 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.525 -0.761 . . . . 73.14 110.514 -177.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.804 ' HE2' ' HA2' ' A' ' 55' ' ' GLY . 82.3 tttt -105.93 113.0 26.28 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.628 -0.715 . . . . 72.03 109.928 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.621 ' SG ' ' HE3' ' A' ' 73' ' ' LYS . 53.6 t -100.13 93.54 5.77 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.9 -0.591 . . . . 62.32 110.032 -179.248 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.9 t70 70.91 -9.09 0.87 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.664 0.745 . . . . 74.53 111.609 176.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.804 ' HA2' ' HE2' ' A' ' 52' ' ' LYS . . . 150.39 -27.25 1.09 Allowed Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.677 -0.692 . . . . 64.01 112.276 -178.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 53' ' ' CYS . 11.7 pt-20 -91.88 130.06 37.72 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.743 0.306 . . . . 75.53 110.695 -179.055 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.6 mm -80.9 122.38 36.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.682 -0.488 . . . . 74.21 109.682 177.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.585 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 30.6 mmmt -120.62 131.08 54.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.449 -0.342 . . . . 75.34 110.444 -177.744 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.1 p -101.09 113.73 27.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.068 0.461 . . . . 74.44 111.311 177.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.585 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 22.6 m-85 -120.85 139.48 53.11 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.892 -0.595 . . . . 75.21 110.825 178.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.4 t -120.85 -24.24 5.71 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.833 -0.803 . . . . 60.44 108.833 176.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -101.38 137.3 39.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.261 -0.881 . . . . 51.21 109.658 179.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.7 mt -83.25 -31.55 26.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.958 0.408 . . . . 75.14 110.701 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -69.39 -36.84 77.18 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.467 -0.333 . . . . 74.33 110.312 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.1 m -70.61 -32.71 70.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.032 0.444 . . . . 71.4 110.331 176.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.488 ' HA ' ' CE2' ' A' ' 60' ' ' PHE . 3.5 tm? -67.82 -42.16 81.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.719 -0.673 . . . . 65.11 109.721 177.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -33.6 70.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.466 -0.788 . . . . 75.32 110.128 -179.658 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -65.43 -47.84 74.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.651 -0.704 . . . . 75.24 111.057 176.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -63.35 -40.28 96.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.666 -0.697 . . . . 73.01 110.886 -175.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.8 -22.88 66.0 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.486 -0.325 . . . . 72.32 111.155 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.1 m -76.05 -20.73 57.5 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.302 -0.408 . . . . 73.54 111.673 -178.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -100.01 3.19 44.07 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.197 0.522 . . . . 75.41 110.724 178.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.621 ' HE3' ' SG ' ' A' ' 53' ' ' CYS . 70.6 mmtt -108.5 109.68 21.0 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.665 -0.698 . . . . 64.54 110.184 178.358 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.9 m -58.35 -32.41 68.51 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.823 0.344 . . . . 75.11 111.131 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.443 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 8.1 m -76.36 -37.96 56.52 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.304 -0.407 . . . . 71.41 111.251 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.557 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 77.4 mtp -86.35 -22.33 26.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.881 0.372 . . . . 71.42 111.566 -175.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -62.25 -30.0 70.8 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.994 -0.548 . . . . 74.02 111.981 -175.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -103.92 3.47 33.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.552 0.691 . . . . 74.55 110.319 -178.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 75' ' ' SER . 63.9 mt -86.52 -51.35 6.23 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.352 -0.84 . . . . 73.23 108.761 170.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.85 -7.66 56.98 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.88 -1.055 . . . . 73.0 111.393 -177.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.453 ' HE3' ' HB2' ' A' ' 81' ' ' LYS . 19.0 ptmt -57.85 -19.12 26.7 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.115 0.413 . . . . 74.13 112.115 -177.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -74.12 -43.77 56.31 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.998 -0.281 . . . . 75.22 110.773 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.424 ' O ' ' HB2' ' B' ' 126' ' ' GLN . 32.7 m -91.41 -20.16 6.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.084 0.469 . . . . 71.4 110.909 -179.441 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 40.9 mt -101.39 101.6 17.83 Favored Pre-proline 0 C--N 1.326 -0.453 0 N-CA-C 108.991 -0.744 . . . . 75.23 108.991 175.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -61.34 112.42 1.41 Allowed 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 123.086 2.524 . . . . 72.32 113.711 -171.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 -99.33 121.58 41.29 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 108.608 -0.886 . . . . 75.32 108.608 174.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.723 ' HD2' ' HB2' ' B' ' 122' ' ' ASP . 24.8 mtpt -61.78 -55.89 25.25 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.374 -0.83 . . . . 75.24 111.891 -171.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 . . . . . 0 C--N 1.324 -0.521 0 CA-C-N 116.65 -0.25 . . . . 75.43 110.501 -178.875 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 N-CA-C 111.973 -0.451 . . . . 43.14 111.973 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 8.2 p -135.76 137.81 48.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.897 0.38 . . . . 74.33 110.8 -179.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -80.21 101.37 8.81 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.354 -0.61 . . . . 74.01 109.354 176.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 87.6 mtp -87.92 -54.77 4.07 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.545 -0.752 . . . . 63.34 111.47 -174.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -94.19 173.41 7.66 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.399 0.619 . . . . 75.43 111.758 -173.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -136.65 128.38 28.96 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 107.811 -1.181 . . . . 75.13 107.811 177.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -143.17 86.45 0.18 Allowed Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.11 -1.043 . . . . 71.4 113.018 -174.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -105.32 94.7 5.36 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.74 -0.467 . . . . 65.21 109.74 173.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 46.9 t -110.84 111.51 36.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.988 -0.551 . . . . 75.02 110.316 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -91.59 104.27 16.77 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.242 -0.436 . . . . 74.42 110.225 -178.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 87.9 m -99.93 113.5 26.11 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.289 0.566 . . . . 75.54 111.115 -179.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 1.4 tt -141.02 140.43 34.3 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.639 -1.245 . . . . 74.42 107.639 175.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 113' ' ' ALA . . . . . 0.626 ' HB1' ' HB2' ' B' ' 116' ' ' LEU . . . -62.29 108.67 1.13 Allowed 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 121.079 -0.249 . . . . 41.22 110.449 177.596 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.97 97.04 0.15 Allowed 'General case' 0 C--N 1.323 -0.547 0 O-C-N 123.45 0.469 . . . . 53.43 111.017 -177.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 31.8 t70 84.48 -21.91 0.23 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.355 -1.293 . . . . 75.24 110.887 170.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.626 ' HB2' ' HB1' ' B' ' 113' ' ' ALA . 51.1 mt -69.08 -52.95 23.13 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.596 -0.729 . . . . 74.33 110.125 177.184 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.439 ' HB3' ' HB2' ' B' ' 113' ' ' ALA . 47.1 t -103.12 -28.15 12.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.989 -0.551 . . . . 71.24 110.738 -179.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 41.7 p -78.32 77.37 4.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.243 0.544 . . . . 72.42 110.603 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -143.93 -179.05 6.24 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.669 -0.696 . . . . 53.22 109.939 179.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 49.6 m -108.78 112.28 24.47 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.167 -0.679 . . . . 75.03 109.167 174.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 76.3 mt -103.59 -61.3 1.44 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.363 0.601 . . . . 75.11 112.598 -170.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 122' ' ' ASP . . . . . 0.723 ' HB2' ' HD2' ' A' ' 87' ' ' LYS . 1.8 t70 -105.6 -162.8 0.89 Allowed 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.132 -0.94 . . . . 74.4 111.152 -170.731 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . 0.617 HG13 ' H ' ' B' ' 124' ' ' SER . 11.2 tp -92.91 173.09 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.019 -0.537 . . . . 72.21 110.164 -179.032 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 124' ' ' SER . . . . . 0.617 ' H ' HG13 ' B' ' 123' ' ' ILE . 24.2 m -121.88 139.23 53.9 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.427 -0.583 . . . . 74.32 109.427 179.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -132.81 2.7 3.73 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.723 0.638 . . . . 74.42 112.723 -175.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 126' ' ' GLN . . . . . 0.424 ' HB2' ' O ' ' A' ' 83' ' ' VAL . 2.8 mp0 -87.91 133.07 34.0 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 110.05 -0.352 . . . . 73.4 110.05 177.753 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 127' ' ' TRP . . . . . 0.449 ' C ' ' H ' ' B' ' 129' ' ' ASN . 42.5 t-105 -92.34 -2.49 56.35 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.939 -0.573 . . . . 75.34 110.41 -174.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 32.3 t -75.75 19.29 0.21 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.774 -0.648 . . . . 71.0 111.309 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . 0.449 ' H ' ' C ' ' B' ' 127' ' ' TRP . 27.8 t-20 -81.03 -18.64 46.09 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.23 -0.441 . . . . 74.12 110.975 -178.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.404 HG11 ' O ' ' B' ' 130' ' ' VAL . 7.5 p -59.69 89.9 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-O 121.65 0.738 . . . . 65.52 112.876 -173.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 131' ' ' PHE . . . . . 0.652 ' HB3' HD13 ' A' ' 49' ' ' LEU . 24.6 p90 44.38 21.17 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.494 1.517 . . . . 64.21 114.086 179.367 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -68.31 -61.55 1.79 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.95 0.405 . . . . 72.55 110.854 -178.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 133' ' ' ILE . . . . . . . . . . . . . 49.0 mm -60.06 -38.44 76.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.902 -0.59 . . . . 74.32 111.044 -177.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 70.0 mt -56.46 -37.41 70.26 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.545 -0.752 . . . . 73.52 111.158 177.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -69.45 -42.72 74.56 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.3 -0.409 . . . . 73.32 110.906 -178.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -69.93 -29.45 66.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.916 -0.584 . . . . 71.21 111.533 -175.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -98.47 -0.14 44.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.035 0.445 . . . . 70.35 110.677 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 26.4 t70 61.84 64.01 1.06 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.05 -0.977 . . . . 74.53 111.515 177.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -91.36 2.97 56.01 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.283 -0.871 . . . . 75.54 110.372 171.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 140' ' ' GLU . . . . . 0.421 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 14.7 tp10 61.71 63.41 2.23 Favored Pre-proline 0 CA--C 1.538 0.49 0 CA-C-N 115.948 -0.569 . . . . 75.15 111.397 178.617 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.4 163.47 34.41 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.262 1.975 . . . . 71.23 111.204 177.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 142' ' ' LYS . . . . . 0.81 ' HA ' ' HE3' ' B' ' 142' ' ' LYS . 0.0 OUTLIER -99.22 -159.57 0.75 Allowed 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.81 -0.356 . . . . 75.24 111.372 -176.896 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 143' ' ' PHE . . . . . 0.443 ' CD1' ' HB2' ' B' ' 145' ' ' CYS . 5.2 p90 -138.39 160.99 38.1 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 113.081 0.771 . . . . 74.0 113.081 -165.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . 0.717 HD13 HG13 ' A' ' 47' ' ' VAL . 3.3 mm? -82.83 81.89 8.37 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.149 -0.932 . . . . 72.14 109.28 175.193 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 145' ' ' CYS . . . . . 0.443 ' HB2' ' CD1' ' B' ' 143' ' ' PHE . 9.1 t -80.69 -160.92 0.34 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.04 -0.527 . . . . 64.42 110.695 -177.49 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -143.02 148.58 36.99 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 107.626 -1.25 . . . . 74.31 107.626 -175.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 147' ' ' VAL . . . . . 0.673 HG12 ' HA ' ' A' ' 44' ' ' LEU . 9.0 p -120.29 150.14 23.01 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.221 0 C-N-CA 120.039 -0.664 . . . . 65.23 109.476 175.745 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . 0.529 ' CG ' HG23 ' B' ' 159' ' ' THR . 0.0 OUTLIER -138.0 144.84 41.28 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.108 -0.496 . . . . 74.42 110.22 -170.435 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.782 ' HA ' ' HB2' ' A' ' 42' ' ' LYS . 0.5 OUTLIER -78.29 86.2 4.4 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 109.285 -0.635 . . . . 72.52 109.285 174.525 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -78.56 91.28 4.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.242 -0.89 . . . . 73.3 109.295 175.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 151' ' ' PHE . . . . . 0.442 ' CE2' ' HB2' ' B' ' 153' ' ' CYS . 52.6 p90 -108.57 164.7 12.12 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.08 -0.509 . . . . 75.11 110.736 -175.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 152' ' ' LYS . . . . . 0.726 ' HE2' ' HA2' ' B' ' 155' ' ' GLY . 78.0 tttt -92.9 104.92 17.12 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.762 -0.654 . . . . 72.25 110.015 179.232 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 153' ' ' CYS . . . . . 0.788 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 36.8 t -93.45 92.26 7.54 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.352 -0.84 . . . . 73.04 110.607 -174.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 16.8 t70 66.44 6.89 4.62 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.762 -0.654 . . . . 74.53 111.294 174.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 155' ' ' GLY . . . . . 0.726 ' HA2' ' HE2' ' B' ' 152' ' ' LYS . . . 138.53 -32.65 2.29 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.966 -0.635 . . . . 73.53 112.348 -179.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 156' ' ' GLU . . . . . 0.486 ' OE1' ' HD3' ' B' ' 158' ' ' LYS . 16.0 pt-20 -98.06 135.18 40.11 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.502 0.191 . . . . 71.03 110.665 -177.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 46.7 mm -77.48 120.14 27.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.54 -0.541 . . . . 75.42 109.54 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 158' ' ' LYS . . . . . 0.507 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 32.3 mmmt -117.17 123.58 47.04 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.81 0.338 . . . . 74.12 110.621 -177.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 159' ' ' THR . . . . . 0.529 HG23 ' CG ' ' B' ' 148' ' ' LYS . 0.3 OUTLIER -93.94 107.67 19.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.095 -0.502 . . . . 73.5 111.005 178.567 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 160' ' ' PHE . . . . . 0.507 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 57.3 m-85 -115.13 123.79 49.85 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.329 0.585 . . . . 74.44 111.482 179.126 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 23.3 t -120.79 10.75 11.01 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 107.665 -1.235 . . . . 73.14 107.665 171.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -129.7 110.39 11.74 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.36 -1.291 . . . . 63.24 109.476 -177.322 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -69.52 -32.96 72.11 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.486 -0.324 . . . . 71.12 111.087 -176.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -68.44 -45.8 71.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.847 0.356 . . . . 73.42 110.458 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 49.8 m -64.27 -30.78 71.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.215 -0.448 . . . . 55.42 110.485 176.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . 0.437 ' HA ' ' CE2' ' B' ' 160' ' ' PHE . 61.5 tp -68.1 -39.98 82.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.489 . . . . 71.14 110.69 177.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -59.55 -38.68 81.72 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.251 -0.431 . . . . 75.25 110.648 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -58.66 -54.84 42.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.294 0.569 . . . . 75.44 110.575 176.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 169' ' ' PHE . . . . . 0.607 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 57.0 t80 -66.56 -44.86 81.17 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.944 -1.025 . . . . 74.44 111.584 -172.273 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.4 -29.49 70.53 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 111.948 0.351 . . . . 73.31 111.948 -178.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 3.7 t -80.65 -23.55 39.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.754 0.312 . . . . 63.22 110.96 -175.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -95.27 -15.81 22.91 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.82 0.343 . . . . 71.03 111.102 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 173' ' ' LYS . . . . . 0.788 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 25.6 mmmt -78.41 116.25 18.68 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.522 -0.547 . . . . 73.24 109.522 173.617 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 22.0 t -59.51 -33.87 71.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.356 -0.384 . . . . 71.22 111.412 -174.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 175' ' ' SER . . . . . 0.427 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 5.1 p -78.97 -40.98 30.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.768 0.318 . . . . 71.42 111.291 179.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 176' ' ' MET . . . . . 0.525 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 70.3 mtp -75.21 -27.29 59.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.566 -0.288 . . . . 71.54 111.667 -177.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . 0.868 ' HE3' ' HB3' ' A' ' 18' ' ' SER . 45.8 tttm -52.79 -40.26 63.05 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.284 -0.416 . . . . 74.41 111.625 -178.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -92.33 -2.99 56.04 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.561 0.695 . . . . 65.23 110.051 -173.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 179' ' ' LEU . . . . . 0.485 ' HB3' HG21 ' A' ' 33' ' ' ILE . 60.1 mt -88.7 -47.72 8.04 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.014 -0.994 . . . . 63.1 108.92 173.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 180' ' ' LEU . . . . . 0.43 HD12 HG13 ' A' ' 33' ' ' ILE . 4.1 mm? -86.62 -7.94 57.9 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.881 -1.054 . . . . 72.34 111.689 -176.096 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 18.1 ptmt -53.21 -23.16 7.95 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.499 0.555 . . . . 72.32 112.499 -178.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -72.41 -40.85 66.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.239 0.543 . . . . 64.31 110.174 177.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 183' ' ' VAL . . . . . 0.568 ' O ' ' HB2' ' A' ' 26' ' ' GLN . 47.5 t -82.14 -35.71 13.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.77 0.795 . . . . 72.14 109.934 178.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 184' ' ' LEU . . . . . 0.457 ' HA ' ' HB3' ' A' ' 24' ' ' SER . 30.8 mt -110.54 89.3 8.72 Favored Pre-proline 0 C--N 1.316 -0.85 0 CA-C-N 115.104 -0.953 . . . . 73.44 109.47 -178.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 185' ' ' PRO . . . . . 0.564 ' HD3' ' O ' ' B' ' 183' ' ' VAL . 21.7 Cg_exo -65.74 91.77 0.24 Allowed 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 122.51 2.14 . . . . 74.42 111.372 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 186' ' ' GLN . . . . . 0.579 HE22 ' HG3' ' B' ' 177' ' ' LYS . 61.1 mt-30 -81.86 87.47 6.38 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.356 -0.838 . . . . 75.34 110.167 -179.62 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -50.52 -47.3 57.46 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 114.793 -1.094 . . . . 73.21 110.124 178.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 117.875 -1.059 . . . . 74.33 108.953 171.254 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.711 0 N-CA-C 112.383 -0.287 . . . . 55.12 112.383 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 47.5 t -102.5 -45.84 10.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 109.395 -0.594 . . . . 60.33 109.395 176.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 pp -157.12 171.47 20.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.096 -0.956 . . . . 74.31 109.294 177.18 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 88.9 mmm 58.48 36.91 25.6 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.325 0.583 . . . . 73.12 109.725 -175.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -103.17 133.15 48.74 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.475 -0.784 . . . . 74.14 111.854 -170.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -145.71 105.09 3.94 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.222 -0.899 . . . . 72.54 108.893 172.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -120.89 104.17 0.95 Allowed Glycine 0 N--CA 1.442 -0.903 0 C-N-CA 120.628 -0.796 . . . . 71.04 112.174 -176.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -86.15 94.74 9.36 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.128 0.49 . . . . 74.04 110.232 178.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 21.8 t -87.38 78.23 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.323 0.582 . . . . 74.44 110.202 -177.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.5 mp -128.84 157.83 40.41 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.313 -0.858 . . . . 73.33 108.923 176.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.6 t -145.14 152.98 40.9 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.565 -0.454 . . . . 75.32 110.52 179.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -146.99 117.13 7.3 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 108.261 -1.014 . . . . 75.34 108.261 178.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.37 118.35 18.97 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.454 -0.339 . . . . 64.53 111.149 -176.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.85 98.48 2.0 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.512 -0.551 . . . . 72.51 109.512 172.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.8 t70 79.92 -43.29 0.26 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 114.957 -1.019 . . . . 70.03 112.279 173.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.4 mt -52.08 -79.95 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.016 0.747 . . . . 74.23 113.016 -175.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.0 m -81.04 -15.55 55.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.992 0.425 . . . . 74.52 111.475 -176.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.7 m -88.73 15.29 8.48 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.177 -0.465 . . . . 73.35 110.725 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -71.48 153.03 42.52 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.953 -0.567 . . . . 73.5 111.549 -179.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 12.0 t -156.52 164.87 37.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.962 -0.563 . . . . 73.42 109.558 178.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 43.6 mt -121.71 152.19 39.68 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.165 0.507 . . . . 73.11 111.166 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -124.44 129.76 51.25 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.63 -0.713 . . . . 75.45 109.253 175.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.449 ' HA ' ' NE2' ' B' ' 164' ' ' GLN . 11.4 tt -104.0 108.72 25.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-O 121.699 0.762 . . . . 72.55 110.712 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 45.4 m -129.96 150.49 51.22 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.237 -0.892 . . . . 74.55 110.941 -178.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.9 ' HD3' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -81.48 86.3 6.35 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.348 -0.842 . . . . 65.5 110.047 178.596 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 21.1 mm-40 -97.14 178.6 5.2 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.438 -0.801 . . . . 74.15 110.809 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -123.0 -162.74 1.05 Allowed 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 120.707 0.289 . . . . 74.02 110.464 -176.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.437 ' C ' ' H ' ' A' ' 30' ' ' VAL . 4.7 t -108.24 19.21 20.18 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.027 0.441 . . . . 72.05 111.168 -173.137 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.466 ' OD1' ' HB3' ' A' ' 32' ' ' ASN . 64.0 t30 -72.92 6.98 2.25 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.471 0.653 . . . . 74.22 110.858 178.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.464 HG23 HD22 ' B' ' 166' ' ' LEU . 6.2 p -57.35 -42.65 80.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 CA-C-N 115.479 -0.782 . . . . 74.22 112.639 -175.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 11.2 p90 -90.87 -13.4 33.75 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.338 0.495 . . . . 73.12 112.338 -173.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.466 ' HB3' ' OD1' ' A' ' 29' ' ' ASN . 8.1 t30 -73.3 -52.27 14.54 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.999 -0.28 . . . . 74.25 111.073 -175.359 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.52 HG21 ' HB3' ' B' ' 179' ' ' LEU . 43.3 mm -55.56 -45.33 78.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.22 0.533 . . . . 74.54 111.338 -178.457 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 1.008 HD13 HD22 ' B' ' 149' ' ' LEU . 66.2 mt -66.78 -26.87 67.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.809 -0.632 . . . . 70.34 111.414 -176.332 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.469 ' HB2' ' HG3' ' A' ' 41' ' ' PRO . 1.0 OUTLIER -68.77 -40.34 79.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.785 0.326 . . . . 74.11 110.39 176.994 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -76.56 -23.82 53.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.106 0.479 . . . . 74.11 110.8 -177.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -100.54 4.3 43.43 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.017 -0.538 . . . . 74.22 110.906 -179.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.7 t70 56.11 58.59 4.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.507 -0.77 . . . . 74.21 111.85 177.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.598 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 5.8 m-85 -96.69 7.15 47.23 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.797 -0.638 . . . . 71.2 109.578 172.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.448 ' O ' ' HA ' ' B' ' 151' ' ' PHE . 30.7 tt0 61.55 80.03 0.26 Allowed Pre-proline 0 C--N 1.333 -0.117 0 CA-C-N 114.829 -1.078 . . . . 73.22 110.942 -178.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.469 ' HG3' ' HB2' ' A' ' 35' ' ' ARG . 69.3 Cg_endo -75.31 152.36 39.24 Favored 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.583 2.189 . . . . 73.45 111.966 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.636 ' H ' HD12 ' B' ' 149' ' ' LEU . 0.2 OUTLIER -108.81 152.07 25.38 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.785 -0.366 . . . . 75.23 110.675 -179.922 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 1.015 ' HA ' HG11 ' B' ' 147' ' ' VAL . 64.7 m-85 -155.74 -10.47 0.11 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.481 -0.781 . . . . 73.55 111.008 -170.57 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.0 mp -64.11 104.33 0.72 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.412 0.625 . . . . 72.1 110.543 -177.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.46 ' HB2' ' HB ' ' B' ' 147' ' ' VAL . 35.9 t -135.65 159.63 41.02 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.401 -0.818 . . . . 65.22 109.825 -175.133 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -66.51 100.59 0.68 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.468 -0.938 . . . . 70.13 108.468 173.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.901 HG23 ' H ' ' A' ' 48' ' ' LYS . 7.7 p -138.18 -161.87 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 115.183 -0.917 . . . . 75.4 109.527 -166.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.901 ' H ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -105.73 124.74 50.05 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.421 -0.955 . . . . 75.22 108.421 176.377 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.658 HD11 ' HB3' ' B' ' 141' ' ' PRO . 12.5 tp -74.93 86.49 2.28 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.012 0.434 . . . . 75.24 109.961 -176.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.54 ' HB2' HG22 ' A' ' 59' ' ' THR . . . -88.17 103.85 16.15 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.488 -0.778 . . . . 74.23 110.255 177.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -125.7 169.89 12.09 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.101 -0.5 . . . . 64.53 110.088 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.402 ' O ' ' HD1' ' B' ' 139' ' ' PHE . 32.2 ttmt -101.71 116.62 33.13 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.333 -0.394 . . . . 75.35 110.758 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.601 ' O ' ' HG2' ' A' ' 56' ' ' GLU . 52.7 t -116.18 104.12 11.21 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.937 -0.574 . . . . 60.13 110.365 179.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.8 t70 70.24 4.33 4.82 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.854 0.835 . . . . 73.54 110.805 175.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.12 -31.43 4.27 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.542 -0.753 . . . . 75.3 112.017 -179.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.601 ' HG2' ' O ' ' A' ' 53' ' ' CYS . 11.7 pt-20 -84.24 131.16 34.77 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.014 0.435 . . . . 74.21 110.082 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 41.1 mm -82.21 114.81 23.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.486 -0.561 . . . . 74.32 109.486 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.426 ' HE2' ' CE1' ' A' ' 69' ' ' PHE . 32.1 mmmt -109.63 129.72 55.57 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.23 -0.441 . . . . 73.14 111.187 -174.421 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.54 HG22 ' HB2' ' A' ' 50' ' ' ALA . 2.5 p -103.07 118.16 36.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.095 -0.502 . . . . 75.34 110.593 176.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.442 ' CD2' HD13 ' A' ' 66' ' ' LEU . 49.7 m-85 -129.72 121.36 26.75 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.206 0.527 . . . . 75.44 110.669 177.188 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.0 p -95.34 1.81 54.48 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.841 -0.618 . . . . 73.24 110.599 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -155.2 166.88 32.21 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.543 -0.753 . . . . 74.4 110.158 -178.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.579 ' HB3' ' HB3' ' B' ' 126' ' ' GLN . 2.8 tm? -87.6 -21.22 25.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.167 -0.469 . . . . 74.3 109.898 -177.752 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -62.88 -47.66 82.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.088 -0.506 . . . . 71.52 110.946 -177.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 12.2 t -71.31 -34.26 70.43 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.372 -0.376 . . . . 74.55 110.196 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.448 HD21 HG23 ' B' ' 130' ' ' VAL . 57.1 tp -68.45 -34.53 76.12 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 120.996 -0.281 . . . . 74.13 110.457 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.558 ' HG3' HD12 ' A' ' 84' ' ' LEU . 50.8 ttt180 -56.17 -46.33 79.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.231 0.539 . . . . 74.31 109.914 173.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.473 ' HE2' HD13 ' B' ' 121' ' ' LEU . 15.8 mmmt -57.57 -36.16 71.32 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.058 -0.974 . . . . 73.35 111.299 177.76 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.462 ' CE2' ' HE3' ' A' ' 73' ' ' LYS . 58.5 t80 -84.87 -44.19 13.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.742 -0.663 . . . . 74.11 111.511 -175.519 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.12 -22.21 63.98 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.46 -0.336 . . . . 64.5 111.364 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 14.2 t -74.71 -17.9 60.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.316 -0.402 . . . . 74.4 111.286 -178.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 13.0 pt20 -101.79 -8.94 21.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.229 0.538 . . . . 74.13 110.185 176.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 70.0 mmtt -94.0 104.34 16.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.704 -0.68 . . . . 73.4 109.631 176.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.5 m -53.42 -32.58 50.36 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.879 0.371 . . . . 75.12 111.713 -178.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 26.9 m -76.94 -45.13 28.82 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.813 0.339 . . . . 73.41 111.297 179.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.509 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 61.4 mtp -78.38 -17.09 56.93 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.901 0.382 . . . . 74.44 111.422 -175.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.473 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 12.9 tmtt? -63.97 -24.15 67.61 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.944 -0.571 . . . . 72.23 110.593 177.205 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.543 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 28.3 mm-40 -98.24 6.62 47.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.295 0.569 . . . . 65.42 110.287 -178.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.738 ' HB3' HG23 ' B' ' 133' ' ' ILE . 43.2 mt -100.59 -46.99 5.02 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.226 -0.897 . . . . 72.24 110.233 178.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -94.92 -0.39 53.99 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.939 -0.573 . . . . 62.53 111.052 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.543 ' HD2' ' HA ' ' A' ' 78' ' ' GLU . 20.5 ptmt -51.2 -21.31 1.96 Allowed 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.364 0.876 . . . . 75.5 113.364 -178.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -76.25 -46.67 27.03 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.801 0.334 . . . . 75.21 111.476 -178.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 29.2 m -89.19 -12.58 9.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.263 -0.426 . . . . 74.24 111.221 -175.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.558 HD12 ' HG3' ' A' ' 67' ' ' ARG . 80.3 mt -106.34 156.87 36.19 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 116.076 -0.511 . . . . 71.14 109.622 178.415 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -74.35 58.17 4.34 Favored 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 122.727 2.285 . . . . 70.33 111.706 177.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.459 ' OE1' ' HA ' ' A' ' 81' ' ' LYS . 96.6 mt-30 -111.78 95.45 5.5 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.963 -1.017 . . . . 73.24 110.362 -177.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 23.3 tttp -138.26 -34.96 0.63 Allowed 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.206 -0.906 . . . . 74.14 110.137 -178.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 115.833 -0.621 . . . . 72.04 110.911 177.111 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 N-CA-C 112.079 -0.408 . . . . 61.02 112.079 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 61.2 t -77.76 -41.74 28.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 121.275 0.56 . . . . 74.41 109.663 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 3.7 pp -129.86 168.9 15.89 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.345 -0.843 . . . . 75.24 109.601 177.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 86.9 mmm -92.48 91.0 7.41 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.014 0.435 . . . . 74.3 111.43 -178.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -98.04 116.31 29.99 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.175 -0.676 . . . . 74.23 109.175 170.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -101.15 104.73 15.83 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.507 -0.769 . . . . 73.23 110.194 -176.011 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -118.51 -135.58 5.26 Favored Glycine 0 N--CA 1.446 -0.675 0 CA-C-N 115.764 -0.653 . . . . 64.51 112.416 -179.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -139.21 122.14 16.66 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.82 0.343 . . . . 72.53 110.939 -177.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 43.6 t -87.77 -20.93 7.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.521 0.676 . . . . 74.51 110.089 178.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 9.1 mp -88.73 153.19 21.29 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.279 -0.873 . . . . 75.35 110.716 -178.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 7.2 t -151.45 160.2 43.84 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.073 -0.714 . . . . 71.05 109.073 176.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -131.91 127.08 35.69 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.814 -0.439 . . . . 75.34 109.814 -177.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.95 137.8 57.97 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 116.425 -0.352 . . . . 71.01 110.812 -179.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -98.09 100.14 11.44 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.193 -0.458 . . . . 75.1 110.511 177.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 16.1 t70 77.5 -32.05 0.17 Allowed 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 114.814 -1.084 . . . . 64.44 112.395 170.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 4.4 tt -69.05 -80.29 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.568 -0.287 . . . . 74.43 111.202 -175.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 21.3 m -79.59 -29.86 41.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.676 0.274 . . . . 71.4 111.463 -175.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 23.1 m -74.51 101.56 4.21 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.876 -0.416 . . . . 74.32 109.876 177.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -150.59 143.06 24.4 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.146 -0.479 . . . . 61.51 110.644 -177.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 31.2 m -138.35 125.37 21.33 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.194 -0.457 . . . . 74.2 109.979 175.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . 0.473 HD13 ' HE2' ' A' ' 68' ' ' LYS . 3.9 mm? -101.24 148.38 25.17 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.236 -0.438 . . . . 74.43 110.843 -178.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -139.76 146.9 40.09 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.975 -0.557 . . . . 64.03 110.032 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 12.8 tt -114.03 133.21 60.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.237 -0.438 . . . . 75.03 110.54 -179.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 63.1 m -147.34 170.85 16.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.15 -0.477 . . . . 73.21 111.111 -177.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . 0.776 ' HD3' ' H ' ' B' ' 125' ' ' LYS . 0.0 OUTLIER -85.2 81.67 8.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.665 0.745 . . . . 74.42 110.306 -179.771 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 126' ' ' GLN . . . . . 0.748 HE21 ' HA ' ' B' ' 126' ' ' GLN . 0.0 OUTLIER -94.27 150.99 19.77 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.7 -0.682 . . . . 75.01 109.841 -179.793 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 38.5 m95 -116.26 -165.17 1.02 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.966 0.412 . . . . 73.21 111.145 -173.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 128' ' ' SER . . . . . 0.405 ' C ' ' H ' ' B' ' 130' ' ' VAL . 25.1 m -100.44 18.15 19.77 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.869 -0.605 . . . . 74.23 111.575 -172.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -84.13 23.43 1.06 Allowed 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.866 0.841 . . . . 74.11 110.011 179.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.448 HG23 HD21 ' A' ' 66' ' ' LEU . 2.9 p -74.15 -48.2 38.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.228 -0.896 . . . . 74.22 112.459 -174.526 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 34.9 p90 -78.52 -14.99 59.08 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 111.791 0.293 . . . . 72.3 111.791 -173.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -64.25 -58.64 5.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.524 -0.307 . . . . 73.45 111.178 -177.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 133' ' ' ILE . . . . . 0.738 HG23 ' HB3' ' A' ' 79' ' ' LEU . 27.3 mm -61.05 -38.95 80.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-O 121.194 0.521 . . . . 74.22 110.828 -176.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.603 ' HA ' ' HD2' ' B' ' 139' ' ' PHE . 51.6 mt -65.4 -33.28 75.59 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.67 -0.695 . . . . 73.24 111.235 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 42.2 ttt-85 -65.36 -48.23 73.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.146 0.498 . . . . 74.25 110.154 175.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -61.2 -42.03 97.87 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.149 -0.932 . . . . 72.14 111.616 -177.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -86.46 0.12 54.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.304 -0.407 . . . . 65.51 110.997 -179.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 15.6 t70 56.66 62.79 2.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.298 -0.864 . . . . 74.54 112.016 177.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 139' ' ' PHE . . . . . 0.603 ' HD2' ' HA ' ' B' ' 134' ' ' LEU . 75.3 m-85 -91.3 -4.5 55.82 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.06 -0.518 . . . . 73.42 110.394 169.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 60.1 84.67 0.2 Allowed Pre-proline 0 CA--C 1.529 0.157 0 CA-C-N 115.316 -0.857 . . . . 65.22 110.859 -176.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . 0.658 ' HB3' HD11 ' A' ' 49' ' ' LEU . 17.6 Cg_exo -67.03 161.96 40.33 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 123.179 2.586 . . . . 72.21 112.092 177.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 142' ' ' LYS . . . . . 0.413 ' CB ' ' H ' ' A' ' 50' ' ' ALA . 23.4 tptt -105.95 172.19 6.93 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.819 -0.352 . . . . 74.54 110.133 179.294 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 143' ' ' PHE . . . . . 0.804 ' HA ' HG11 ' A' ' 47' ' ' VAL . 3.2 m-85 -176.56 -35.01 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 122.982 0.513 . . . . 74.21 110.133 -170.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 9.8 mp -50.45 109.39 0.3 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.045 -0.979 . . . . 74.25 111.196 -177.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 38.2 t -160.14 -174.95 4.8 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.64 -0.874 . . . . 74.42 108.64 -177.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -71.29 106.74 3.96 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.686 -0.857 . . . . 74.15 108.686 174.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 147' ' ' VAL . . . . . 1.015 HG11 ' HA ' ' A' ' 43' ' ' PHE . 12.4 p -135.84 -158.46 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 CA-C-N 114.888 -1.051 . . . . 74.43 109.236 -168.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . 0.938 ' H ' HG21 ' B' ' 147' ' ' VAL . 0.1 OUTLIER -124.91 127.75 47.57 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.374 -0.602 . . . . 74.51 109.374 178.586 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 1.008 HD22 HD13 ' A' ' 34' ' ' LEU . 66.4 tp -77.32 92.57 3.92 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.519 -0.764 . . . . 71.44 110.811 -174.631 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.54 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -95.01 85.75 4.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.677 -0.692 . . . . 74.11 109.788 175.062 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 151' ' ' PHE . . . . . 0.588 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 45.4 p90 -102.54 171.95 7.14 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.876 -0.602 . . . . 75.31 110.349 -177.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -103.2 119.56 39.09 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.103 0.478 . . . . 75.14 110.625 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 153' ' ' CYS . . . . . 0.432 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 23.0 t -113.15 101.22 9.23 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.802 -0.636 . . . . 72.33 109.618 177.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 65.69 14.69 9.67 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.605 -0.725 . . . . 62.35 112.115 176.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 128.89 -32.82 3.21 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.103 -1.046 . . . . 70.01 112.84 177.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -100.2 142.13 32.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.145 0.498 . . . . 71.45 110.918 -177.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . 0.431 ' HA ' ' O ' ' B' ' 151' ' ' PHE . 49.1 mm -80.3 124.96 38.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.809 -0.632 . . . . 74.22 110.278 178.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 158' ' ' LYS . . . . . 0.436 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 26.7 mmmt -114.34 132.47 56.18 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.888 -0.412 . . . . 71.15 109.888 179.155 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.4 109.93 21.85 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.902 0.382 . . . . 74.44 111.667 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 160' ' ' PHE . . . . . 0.436 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 33.9 m-85 -119.8 128.99 54.22 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.047 -0.524 . . . . 73.34 110.438 177.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 2.9 p -100.85 -16.56 17.21 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.125 -0.489 . . . . 73.1 111.764 -178.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -139.37 164.44 29.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.924 0.392 . . . . 74.02 110.786 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . 0.456 HD21 ' HA ' ' A' ' 30' ' ' VAL . 3.0 tm? -86.45 -25.29 25.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.763 -0.653 . . . . 73.42 110.251 -176.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 164' ' ' GLN . . . . . 0.449 ' NE2' ' HA ' ' A' ' 23' ' ' ILE . 51.3 tt0 -60.85 -46.76 89.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.011 0.434 . . . . 72.14 110.86 -177.575 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 14.2 m -68.63 -34.43 75.73 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.845 -0.616 . . . . 74.22 110.373 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . 0.464 HD22 HG23 ' A' ' 30' ' ' VAL . 42.8 tp -71.45 -26.95 62.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.915 -0.584 . . . . 72.21 110.615 -178.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -56.2 -43.35 78.41 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.664 -0.244 . . . . 70.33 110.681 177.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 28.0 mtmt -67.36 -43.15 82.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.033 0.444 . . . . 74.54 110.234 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 169' ' ' PHE . . . . . 0.562 ' O ' ' HG2' ' B' ' 173' ' ' LYS . 70.8 t80 -64.16 -45.9 86.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.516 -0.765 . . . . 73.3 110.54 -177.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -71.63 -28.62 63.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.101 -0.5 . . . . 72.51 111.286 -178.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 22.9 t -67.89 -32.89 73.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.622 -0.263 . . . . 63.24 111.127 -177.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -84.45 -16.04 43.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.872 0.368 . . . . 70.1 110.403 178.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 173' ' ' LYS . . . . . 0.562 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 31.6 mmmt -83.22 145.72 28.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.151 -0.477 . . . . 75.3 110.129 178.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 12.7 m -83.67 -44.79 14.14 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.284 0.564 . . . . 73.12 109.557 176.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 3.2 m -72.54 -40.29 66.86 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.52 -0.764 . . . . 63.23 111.504 -177.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 176' ' ' MET . . . . . 0.42 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 81.6 mtp -85.2 -17.85 35.86 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.391 0.515 . . . . 75.25 112.391 -172.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . 0.541 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 88.0 tttt -63.93 -31.06 72.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.979 0.419 . . . . 75.3 110.795 -178.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . 0.846 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 51.7 mm-40 -90.08 -0.3 57.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.521 0.677 . . . . 74.22 110.419 -175.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 179' ' ' LEU . . . . . 0.52 ' HB3' HG21 ' A' ' 33' ' ' ILE . 52.8 mt -94.78 -49.71 5.47 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.024 -0.989 . . . . 64.04 109.806 -179.244 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 180' ' ' LEU . . . . . 0.597 ' O ' ' HG ' ' B' ' 184' ' ' LEU . 3.4 mm? -88.89 -14.93 35.64 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.531 -0.759 . . . . 73.2 111.858 -176.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 181' ' ' LYS . . . . . 0.846 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 20.4 ptmt -53.89 -23.96 14.46 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 111.959 0.355 . . . . 73.51 111.959 -178.113 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -65.66 -23.75 66.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.022 -0.535 . . . . 71.53 111.942 -174.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 19.3 m -124.88 3.34 4.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 112.201 0.445 . . . . 74.51 112.201 -178.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 184' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' B' ' 180' ' ' LEU . 81.9 mt -90.0 147.64 37.72 Favored Pre-proline 0 C--N 1.326 -0.452 0 C-N-CA 121.21 -0.196 . . . . 74.33 110.874 -179.151 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -69.91 83.39 0.73 Allowed 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.622 2.215 . . . . 64.45 111.397 173.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -132.59 -137.46 0.19 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.519 -0.764 . . . . 74.15 110.593 -175.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 62.9 mttp 69.94 25.0 5.0 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 122.003 0.906 . . . . 74.33 109.673 -176.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 . . . . . 0 C--O 1.249 1.041 0 CA-C-N 114.124 -1.398 . . . . 62.24 109.102 176.721 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.761 0 N-CA-C 111.861 -0.495 . . . . 64.03 111.861 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.3 p -85.64 -33.73 7.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.159 0.504 . . . . 72.54 109.668 177.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 94.4 mt -132.09 119.76 21.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.694 -0.684 . . . . 75.22 109.432 174.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 24.7 mmt -85.36 -76.08 0.34 Allowed 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.226 -0.443 . . . . 75.1 111.571 -175.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -178.68 123.44 0.09 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.824 -0.626 . . . . 73.3 110.092 -174.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -138.34 -17.07 1.18 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.467 0.651 . . . . 74.21 110.449 -178.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.27 5.25 64.01 Favored Glycine 0 N--CA 1.449 -0.44 0 CA-C-N 115.494 -0.775 . . . . 70.42 112.344 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.58 87.26 1.63 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.164 0.506 . . . . 75.25 110.414 176.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.1 p -127.5 132.8 68.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.734 -0.666 . . . . 74.12 109.418 176.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.418 HD22 ' N ' ' A' ' 10' ' ' LEU . 2.3 pt? -149.25 135.72 19.34 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.239 -0.437 . . . . 75.32 110.058 -178.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.2 m -90.9 95.76 10.29 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.967 0.413 . . . . 75.31 110.128 174.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.884 ' HG ' ' HD2' ' A' ' 81' ' ' LYS . 0.3 OUTLIER -79.51 133.64 36.49 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 107.987 -1.116 . . . . 74.51 107.987 174.641 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.581 ' CB ' ' HB3' ' A' ' 17' ' ' SER . . . -71.02 165.2 23.99 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.014 0.435 . . . . 65.14 111.161 -175.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -96.2 97.16 9.32 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.073 -0.512 . . . . 70.32 110.229 174.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.1 t70 74.26 -58.77 0.58 Allowed 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.191 -0.913 . . . . 73.43 112.819 171.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -69.37 -66.43 0.58 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.344 -0.389 . . . . 75.02 111.896 -170.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.581 ' HB3' ' CB ' ' A' ' 13' ' ' ALA . 7.8 t -82.39 5.91 18.86 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.92 0.391 . . . . 72.44 111.648 -170.159 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.6 m -75.21 53.39 0.64 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.302 0.573 . . . . 62.41 110.534 176.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.95 158.33 30.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.788 -0.642 . . . . 73.42 110.964 -176.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.45 ' HG1' ' HG2' ' A' ' 86' ' ' GLN . 28.6 m -150.14 122.64 8.51 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.156 -0.474 . . . . 74.55 110.235 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 50.4 tp -147.4 145.84 29.39 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.479 -0.328 . . . . 73.4 111.523 -178.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.6 t70 72.82 156.18 0.17 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 122.169 0.985 . . . . 63.13 113.591 170.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.612 ' O ' ' HD3' ' A' ' 25' ' ' LYS . 15.4 tt -149.71 152.47 11.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 106.216 -1.772 . . . . 74.51 106.216 170.492 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 45.4 m -76.08 -17.01 59.81 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 118.7 0.682 . . . . 74.03 111.869 -175.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.612 ' HD3' ' O ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER 39.56 53.49 2.41 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.199 1.0 . . . . 73.03 113.691 -178.114 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -95.62 4.09 53.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.32 0.581 . . . . 74.12 109.791 170.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 4.0 m-90 -84.27 92.26 7.94 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.701 -0.681 . . . . 75.31 110.738 -175.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.3 t -165.76 -52.44 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.08 0.467 . . . . 63.33 110.413 179.147 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.419 ' ND2' ' HB ' ' B' ' 183' ' ' VAL . 44.8 t30 -82.93 90.72 7.01 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.173 0.511 . . . . 62.4 111.354 -175.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.651 HG12 HD22 ' B' ' 163' ' ' LEU . 59.5 t -113.29 -65.95 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 115.636 -0.711 . . . . 74.44 110.145 175.084 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -107.05 6.78 29.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.972 -0.558 . . . . 73.04 110.601 -179.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.406 ' HB3' ' OD1' ' A' ' 29' ' ' ASN . 52.4 t30 -61.03 -50.96 71.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.893 -0.594 . . . . 74.54 110.962 -175.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.48 HG21 ' HB3' ' B' ' 179' ' ' LEU . 28.4 mm -60.59 -39.98 83.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.905 -0.589 . . . . 74.54 111.411 -178.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.462 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 86.4 mt -68.29 -22.49 64.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.863 -0.608 . . . . 71.51 110.982 -176.574 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 46.4 ttt-85 -73.32 -42.6 62.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.09 -0.505 . . . . 73.44 109.914 175.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -72.05 -23.43 61.37 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.925 -0.579 . . . . 64.24 111.04 -177.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -103.89 6.17 36.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.382 -0.372 . . . . 74.14 110.731 179.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 52.06 62.27 2.79 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.387 -0.824 . . . . 71.24 112.816 176.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.465 ' HB3' ' HB2' ' B' ' 151' ' ' PHE . 12.4 m-85 -94.36 -4.8 47.86 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.74 -0.664 . . . . 72.31 109.794 173.251 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 58.82 74.69 0.58 Allowed Pre-proline 0 C--O 1.232 0.183 0 CA-C-N 115.25 -0.886 . . . . 74.11 110.195 -174.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -78.58 142.42 18.29 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 123.006 2.471 . . . . 74.24 112.334 -176.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.643 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 1.4 mptm? -104.27 121.94 44.37 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.072 -0.513 . . . . 75.34 110.061 177.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.574 ' HA ' ' CG1' ' B' ' 147' ' ' VAL . 18.9 t80 -172.19 96.7 0.16 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.859 -0.61 . . . . 74.23 109.824 -177.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -157.2 124.08 5.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.221 -0.445 . . . . 72.14 109.908 176.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.452 ' HB3' ' CG2' ' B' ' 147' ' ' VAL . 18.4 p -162.67 122.73 2.35 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.29 -0.414 . . . . 73.24 110.887 -179.099 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -83.84 66.62 9.2 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.185 0.516 . . . . 72.51 109.839 175.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 34.6 m -109.06 142.83 20.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.026 -0.534 . . . . 64.14 110.658 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.563 ' HD3' HG21 ' A' ' 59' ' ' THR . 0.2 OUTLIER -163.13 144.7 9.81 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.242 -0.89 . . . . 71.1 109.225 -179.458 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.682 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 11.2 mp -70.43 86.57 0.62 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.469 -0.332 . . . . 70.05 110.491 -178.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.575 ' HA ' ' O ' ' A' ' 58' ' ' LYS . . . -84.98 63.08 7.9 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.629 -0.714 . . . . 61.04 110.047 175.459 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.682 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 51.8 p90 -95.33 171.57 8.63 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.485 -0.78 . . . . 74.03 110.077 -177.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -102.51 133.56 47.27 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.324 -0.398 . . . . 74.52 111.25 -178.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 42.3 t -135.8 114.69 12.11 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.695 -0.684 . . . . 74.5 109.453 175.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 70.34 13.95 7.52 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.143 0.577 . . . . 74.11 111.308 177.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 110.21 -32.32 6.76 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.682 -0.77 . . . . 74.4 112.186 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -89.01 156.1 19.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.006 0.432 . . . . 62.33 110.271 -179.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.1 mm -91.94 124.54 44.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 116.007 -0.542 . . . . 75.55 110.425 -179.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.575 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 27.4 mmmt -100.82 155.2 18.06 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.872 -0.788 . . . . 73.44 108.872 177.413 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.563 HG21 ' HD3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -133.45 102.18 5.43 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.177 0.513 . . . . 73.53 111.426 177.088 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.533 ' CD2' HD11 ' A' ' 66' ' ' LEU . 84.6 m-85 -108.35 119.83 40.63 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.804 -0.634 . . . . 74.45 110.448 177.327 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 32.6 t -97.06 -13.57 22.15 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.761 -0.654 . . . . 63.32 110.005 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -130.21 154.54 47.45 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.715 -0.675 . . . . 71.1 110.296 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.4 tt -83.23 -24.36 32.37 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.409 -0.589 . . . . 73.43 109.409 -178.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -54.18 -52.72 60.29 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.443 -0.798 . . . . 64.23 111.013 -178.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.8 m -69.75 -44.13 70.84 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.96 -0.564 . . . . 75.23 111.346 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.533 HD11 ' CD2' ' A' ' 60' ' ' PHE . 54.6 tp -65.74 -35.87 81.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.429 -0.35 . . . . 63.32 111.379 -174.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.429 ' HE ' ' HB3' ' A' ' 67' ' ' ARG . 17.7 ttp180 -58.11 -41.85 84.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.957 0.408 . . . . 73.3 110.342 176.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -72.4 -32.0 66.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.967 -0.561 . . . . 73.24 110.688 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.437 ' HA ' HE21 ' A' ' 72' ' ' GLN . 31.6 t80 -65.31 -44.86 86.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.907 -0.588 . . . . 74.11 109.907 177.392 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.73 -24.57 61.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.192 -0.458 . . . . 72.32 111.399 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.735 ' HA ' ' HE2' ' A' ' 77' ' ' LYS . 70.4 m -73.42 -18.78 61.1 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.599 -0.273 . . . . 72.43 111.294 -179.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.437 HE21 ' HA ' ' A' ' 69' ' ' PHE . 29.7 pt20 -106.52 4.1 27.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.367 0.604 . . . . 75.2 110.194 176.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 56.3 mmtt -105.11 107.58 18.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.599 -0.728 . . . . 75.22 110.183 177.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.3 t -56.89 -33.0 66.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.976 0.417 . . . . 65.22 110.598 -178.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.8 p -80.87 -52.12 7.83 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.123 -0.49 . . . . 74.41 111.293 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.6 ' HA ' HD11 ' A' ' 79' ' ' LEU . 72.9 mtp -67.76 -12.77 61.25 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.843 0.354 . . . . 64.15 111.578 -177.331 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.735 ' HE2' ' HA ' ' A' ' 71' ' ' SER . 16.7 mmtt -61.83 -25.96 67.83 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.072 -0.513 . . . . 74.21 110.513 174.181 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.446 ' O ' ' HE2' ' A' ' 81' ' ' LYS . 3.6 mm-40 -94.95 -5.31 45.02 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.411 0.625 . . . . 74.31 110.131 -178.581 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.6 HD11 ' HA ' ' A' ' 76' ' ' MET . 8.5 mp -92.43 -56.84 2.89 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.265 -0.88 . . . . 74.43 110.094 178.1 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.808 ' HB3' HD13 ' A' ' 84' ' ' LEU . 3.7 mm? -83.22 -4.47 58.44 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.023 -0.535 . . . . 74.32 111.752 -174.133 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.884 ' HD2' ' HG ' ' A' ' 12' ' ' LEU . 64.9 pttt -56.46 -18.5 11.57 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.611 0.597 . . . . 74.41 112.611 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -76.25 -26.03 55.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.76 0.314 . . . . 74.25 111.55 -177.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 7.5 p -116.14 -28.51 2.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.84 0.352 . . . . 71.14 111.375 -177.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.808 HD13 ' HB3' ' A' ' 80' ' ' LEU . 8.8 mp -72.74 134.83 81.3 Favored Pre-proline 0 C--N 1.328 -0.342 0 N-CA-C 109.76 -0.459 . . . . 64.13 109.76 177.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 84' ' ' LEU . 38.1 Cg_exo -60.16 94.3 0.1 OUTLIER 'Trans proline' 0 C--O 1.235 0.332 0 C-N-CA 123.068 2.512 . . . . 75.03 113.409 -176.042 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.45 ' HG2' ' HG1' ' A' ' 20' ' ' THR . 39.8 mt-30 -121.03 112.96 19.38 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.764 -0.828 . . . . 74.44 108.764 173.448 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.668 ' HB2' ' HZ1' ' A' ' 87' ' ' LYS . 8.7 mtmp? -84.96 -21.23 29.65 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.072 0.463 . . . . 74.13 111.174 -172.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.415 ' OE2' ' HB2' ' A' ' 87' ' ' LYS . 1.2 pm0 . . . . . 0 C--N 1.322 -0.601 0 CA-C-N 115.897 -0.592 . . . . 62.44 110.889 -179.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.52 0 N-CA-C 112.132 -0.387 . . . . 64.11 112.132 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . 0.512 HG12 ' HG ' ' B' ' 103' ' ' LEU . 14.2 p -89.53 -25.45 5.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.317 0.58 . . . . 73.5 110.146 177.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 103' ' ' LEU . . . . . 0.512 ' HG ' HG12 ' B' ' 102' ' ' VAL . 95.6 mt -128.81 129.45 45.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.923 -0.58 . . . . 75.41 110.177 178.465 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 23.3 mmt -100.25 -72.91 0.65 Allowed 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.483 -0.562 . . . . 72.24 109.483 179.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -136.99 121.65 18.51 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.219 -0.9 . . . . 61.21 108.75 176.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -97.05 -38.37 9.79 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.434 0.635 . . . . 71.11 110.357 -177.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -172.6 114.12 0.51 Allowed Glycine 0 C--N 1.312 -0.755 0 CA-C-N 114.928 -1.033 . . . . 64.51 111.551 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -121.63 96.85 5.24 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.204 0.526 . . . . 73.42 111.057 -176.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 9.7 p -103.62 136.77 35.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 108.936 -0.764 . . . . 75.1 108.936 174.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 110' ' ' LEU . . . . . 0.41 HD21 ' H ' ' B' ' 110' ' ' LEU . 2.5 pt? -133.16 154.82 50.26 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.953 0.406 . . . . 74.23 110.931 -175.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 38.5 m -98.68 117.47 33.22 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.865 -0.607 . . . . 72.54 110.028 176.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' B' ' 112' ' ' LEU . 0.3 OUTLIER -160.96 135.94 7.57 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.015 -1.106 . . . . 75.41 108.015 177.983 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -84.7 176.51 8.51 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.24 0.543 . . . . 71.01 111.024 -178.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . 0.455 ' O ' ' HB3' ' B' ' 115' ' ' ASP . . . -123.12 95.79 4.75 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.068 -0.515 . . . . 71.44 110.078 174.116 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 115' ' ' ASP . . . . . 0.455 ' HB3' ' O ' ' B' ' 114' ' ' ALA . 17.0 t70 75.28 -17.03 0.53 Allowed 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.221 -0.899 . . . . 71.54 112.256 176.256 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' B' ' 116' ' ' LEU . 0.5 OUTLIER -71.97 -73.18 0.2 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.751 0.31 . . . . 74.34 111.238 -175.699 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 26.0 m -106.5 -10.18 16.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.363 -0.381 . . . . 75.1 111.902 -173.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 118' ' ' SER . . . . . 0.466 ' HA ' ' O ' ' B' ' 188' ' ' GLU . 5.4 m -61.17 115.33 3.71 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.178 -0.465 . . . . 61.24 111.578 -173.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -126.23 164.37 21.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.746 -0.661 . . . . 51.4 110.232 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 4.9 t -85.24 155.0 21.58 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 110.147 -0.316 . . . . 65.53 110.147 -177.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 21.2 tp -140.91 146.32 37.28 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.91 -0.404 . . . . 71.5 109.91 -179.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 122' ' ' ASP . . . . . 0.498 ' HA ' ' NH1' ' B' ' 167' ' ' ARG . 33.0 t70 -93.6 112.96 24.95 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.21 0.528 . . . . 73.03 111.815 -175.535 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 11.8 tt -81.96 144.33 10.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.358 -0.837 . . . . 64.13 109.059 172.094 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 69.6 m -65.62 103.14 0.81 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.398 0.618 . . . . 73.15 111.24 -176.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . 0.806 ' HD3' ' H ' ' B' ' 125' ' ' LYS . 0.0 OUTLIER -86.74 32.81 0.65 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.325 -0.852 . . . . 64.5 111.554 -176.718 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -89.02 13.76 12.19 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.807 -0.633 . . . . 74.51 110.221 176.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 30.0 t-105 -104.08 100.31 10.06 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.069 -0.514 . . . . 75.03 109.734 -178.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 20.7 t -156.28 -12.77 0.1 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.008 -0.542 . . . . 72.01 110.831 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . 0.643 ' OD1' ' HB3' ' B' ' 132' ' ' ASN . 34.4 t30 -89.6 124.4 34.52 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.953 0.406 . . . . 75.25 111.091 -178.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 4.6 p -163.03 -49.22 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 115.579 -0.737 . . . . 73.25 109.251 173.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 45.5 p90 -88.75 -13.62 39.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.062 -0.517 . . . . 65.11 110.016 175.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.643 ' HB3' ' OD1' ' B' ' 129' ' ' ASN . 8.1 t30 -67.47 -35.43 79.17 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.115 -0.493 . . . . 72.42 110.137 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 133' ' ' ILE . . . . . 0.481 HD13 HD22 ' B' ' 129' ' ' ASN . 46.4 mm -64.32 -41.03 91.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.204 0.526 . . . . 75.45 110.231 175.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.405 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 91.4 mt -70.42 -22.06 62.76 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.926 -0.579 . . . . 73.04 110.363 177.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . 0.531 ' HB3' ' O ' ' B' ' 132' ' ' ASN . 22.6 ttt180 -68.71 -51.54 40.42 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.679 -0.489 . . . . 74.31 109.679 171.447 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 136' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 69.7 mm-40 -55.36 -48.74 73.8 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.248 -0.887 . . . . 75.54 111.508 -179.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -87.82 0.64 55.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.47 . . . . 72.45 111.174 -177.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 33.2 t70 52.14 63.46 2.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.643 0.735 . . . . 74.51 111.95 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 139' ' ' PHE . . . . . 0.405 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 4.0 m-85 -93.16 0.81 57.28 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.485 -0.779 . . . . 75.01 109.835 174.081 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 74.3 81.97 0.14 Allowed Pre-proline 0 N--CA 1.465 0.294 0 O-C-N 124.328 1.017 . . . . 73.54 110.679 -176.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -85.27 127.81 3.45 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 122.521 2.147 . . . . 74.2 112.904 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -119.35 117.2 27.9 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.885 -0.598 . . . . 75.31 110.017 174.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -170.57 28.94 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.528 0.68 . . . . 75.25 109.911 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . 0.775 ' H ' HD21 ' B' ' 144' ' ' LEU . 2.0 pt? -80.97 102.63 10.27 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.582 0.706 . . . . 74.45 109.577 -179.602 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 16.3 p -104.88 109.82 21.95 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.441 -0.799 . . . . 63.45 111.764 -173.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -78.43 55.47 1.6 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.23 0.538 . . . . 73.34 109.887 173.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 147' ' ' VAL . . . . . 0.574 ' CG1' ' HA ' ' A' ' 43' ' ' PHE . 40.7 t -120.38 148.89 23.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.782 -0.645 . . . . 74.14 110.502 -174.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -170.78 136.45 1.18 Allowed 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.543 -0.91 . . . . 74.45 108.543 175.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.636 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.8 mp -70.0 91.48 0.68 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.268 -0.424 . . . . 71.42 109.934 -178.376 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.643 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -93.02 61.05 3.39 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.656 -0.498 . . . . 71.53 109.656 175.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 151' ' ' PHE . . . . . 0.636 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 50.5 p90 -88.93 165.7 14.42 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.661 -0.699 . . . . 73.45 110.711 -176.481 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 152' ' ' LYS . . . . . 0.58 ' HE2' ' HA2' ' B' ' 155' ' ' GLY . 57.9 tttt -98.03 115.87 29.09 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.079 -0.51 . . . . 74.12 110.172 -178.082 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 153' ' ' CYS . . . . . . . . . . . . . 53.6 t -117.68 103.38 9.97 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.236 -0.438 . . . . 63.44 110.147 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 65.89 29.14 10.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.444 -0.798 . . . . 74.01 111.374 175.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 155' ' ' GLY . . . . . 0.58 ' HA2' ' HE2' ' B' ' 152' ' ' LYS . . . 108.5 -33.35 6.28 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.525 -0.845 . . . . 52.05 112.987 176.495 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 156' ' ' GLU . . . . . 0.556 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 10.1 pt-20 -99.6 140.3 34.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.911 0.386 . . . . 65.21 110.92 -178.363 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 50.9 mm -76.63 120.56 27.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.045 -0.525 . . . . 75.54 110.173 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 158' ' ' LYS . . . . . 0.556 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 29.9 mmmt -110.54 110.05 20.62 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.827 -0.435 . . . . 75.1 109.827 -177.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 159' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.5 OUTLIER -87.82 126.77 35.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.086 0.47 . . . . 73.41 111.954 -178.75 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -130.27 124.78 33.19 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.783 -0.644 . . . . 74.23 110.592 177.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 34.3 t -112.51 -5.94 14.0 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.789 -0.642 . . . . 65.32 109.899 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -137.8 163.37 31.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.031 -0.531 . . . . 65.14 109.997 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . 0.651 HD22 HG12 ' A' ' 30' ' ' VAL . 91.5 mt -97.92 1.41 48.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.424 -0.353 . . . . 63.14 111.583 -176.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -82.47 -53.08 6.27 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.371 -0.604 . . . . 75.15 109.371 178.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 15.1 m -62.96 -38.89 92.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.74 -0.663 . . . . 71.12 110.039 176.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 53.2 tp -67.66 -35.85 79.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.621 -0.718 . . . . 71.55 110.951 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . 0.498 ' NH1' ' HA ' ' B' ' 122' ' ' ASP . 54.4 ttp180 -61.09 -46.04 92.28 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.989 0.423 . . . . 75.14 109.944 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -63.38 -41.31 98.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.632 -0.713 . . . . 64.4 110.611 178.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 169' ' ' PHE . . . . . 0.716 ' HA ' HE21 ' B' ' 172' ' ' GLN . 51.7 t80 -65.32 -46.64 79.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.7 -0.682 . . . . 72.12 110.985 -178.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -66.23 -28.38 68.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.361 -0.381 . . . . 71.11 111.373 -178.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 40.2 m -75.28 -34.06 61.3 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.52 -0.309 . . . . 75.33 111.305 -178.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . 0.716 HE21 ' HA ' ' B' ' 169' ' ' PHE . 29.6 pt20 -81.97 -25.56 34.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.247 0.546 . . . . 74.12 110.229 178.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 58.0 mmtt -81.25 109.11 15.46 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.587 -0.733 . . . . 71.45 110.762 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 11.8 t -67.2 -24.36 65.84 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.074 -0.713 . . . . 72.11 109.074 176.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 4.8 m -82.68 -12.26 57.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.411 -0.813 . . . . 73.42 111.617 -179.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 176' ' ' MET . . . . . 0.42 ' O ' ' HB2' ' B' ' 179' ' ' LEU . 79.1 mtp -121.77 -10.05 8.77 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.924 0.392 . . . . 72.24 111.441 -179.203 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . 0.408 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 89.0 tttt -64.81 -34.99 79.65 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.083 -0.508 . . . . 72.41 111.056 -177.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -84.43 -6.67 59.4 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 122.001 0.905 . . . . 74.14 109.494 -176.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 179' ' ' LEU . . . . . 0.48 ' HB3' HG21 ' A' ' 33' ' ' ILE . 11.0 mp -90.33 -56.29 3.27 Favored 'General case' 0 N--CA 1.438 -1.06 0 CA-C-N 114.054 -1.43 . . . . 73.54 109.801 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.01 -10.64 56.78 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.782 -0.644 . . . . 72.54 112.242 -173.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 181' ' ' LYS . . . . . 0.55 ' HB2' ' OE1' ' B' ' 186' ' ' GLN . 64.0 pttt -64.8 -5.92 6.97 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.405 -0.518 . . . . 73.02 111.493 178.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -74.75 -30.99 61.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.201 -0.454 . . . . 74.42 110.434 175.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 183' ' ' VAL . . . . . 0.419 ' HB ' ' ND2' ' A' ' 29' ' ' ASN . 10.7 p -104.58 -18.87 6.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 71.52 110.764 -178.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 184' ' ' LEU . . . . . 0.419 ' HB2' ' HA ' ' B' ' 181' ' ' LYS . 9.1 mp -76.64 137.1 67.01 Favored Pre-proline 0 C--N 1.33 -0.258 0 N-CA-C 109.898 -0.408 . . . . 74.43 109.898 176.276 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 185' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' B' ' 184' ' ' LEU . 9.4 Cg_exo -71.51 81.17 1.3 Allowed 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.816 2.344 . . . . 74.12 112.256 -178.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 186' ' ' GLN . . . . . 0.55 ' OE1' ' HB2' ' B' ' 181' ' ' LYS . 85.8 mt-30 -115.68 141.34 48.21 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.957 -0.565 . . . . 74.22 109.584 179.108 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 187' ' ' LYS . . . . . 0.637 ' HZ3' ' HB2' ' B' ' 187' ' ' LYS . 9.1 mtmp? -107.53 -25.83 11.19 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.587 -0.733 . . . . 74.2 109.991 -179.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 188' ' ' GLU . . . . . 0.466 ' O ' ' HA ' ' B' ' 118' ' ' SER . 0.5 OUTLIER . . . . . 0 C--O 1.251 1.172 0 CA-C-O 118.298 -0.858 . . . . 74.33 109.722 177.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.851 0 N-CA-C 112.273 -0.331 . . . . 72.3 112.273 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.699 HG21 ' HG2' ' A' ' 4' ' ' MET . 22.8 m -97.71 176.91 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 120.751 0.31 . . . . 74.15 110.518 -179.166 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.441 HD11 ' N ' ' A' ' 3' ' ' LEU . 5.6 mp -75.03 97.38 3.39 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.125 -0.489 . . . . 74.53 110.076 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.699 ' HG2' HG21 ' A' ' 2' ' ' VAL . 87.7 mmm -127.14 102.05 6.78 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.821 -0.627 . . . . 74.24 110.982 -177.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -97.76 107.7 20.25 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.59 0.709 . . . . 72.05 109.217 172.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -143.16 -179.52 6.43 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 114.521 -1.218 . . . . 74.44 110.001 -173.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -178.86 -117.48 0.54 Allowed Glycine 0 N--CA 1.443 -0.835 0 N-CA-C 111.554 -0.619 . . . . 62.44 111.554 178.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -150.3 138.24 20.11 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 110.1 -0.333 . . . . 75.23 110.1 178.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 35.0 m -66.82 159.85 4.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.175 -0.466 . . . . 71.21 109.985 174.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 68.5 mt -56.59 101.4 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.139 0.495 . . . . 73.43 111.025 -177.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 59.7 m -96.09 107.98 20.36 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.581 -0.736 . . . . 71.33 110.282 178.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.401 HD22 ' N ' ' A' ' 13' ' ' ALA . 1.9 tt -141.35 136.52 31.57 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 108.2 -1.037 . . . . 73.11 108.2 179.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.401 ' N ' HD22 ' A' ' 12' ' ' LEU . . . -64.91 162.43 16.42 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.095 0.474 . . . . 74.22 111.885 -174.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -89.5 -43.74 10.62 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.956 -0.566 . . . . 74.14 110.527 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -111.05 -41.58 4.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.251 -0.432 . . . . 75.4 110.778 179.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.5 mt -87.62 46.42 1.38 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.012 -0.54 . . . . 74.3 109.709 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.6 m -78.17 51.1 0.96 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.261 -0.881 . . . . 72.43 110.72 -173.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 46.2 m -67.64 136.39 54.32 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 114.986 -1.006 . . . . 64.15 111.061 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -113.93 4.61 15.85 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.279 -0.419 . . . . 64.35 111.128 -178.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 28.3 m -87.46 119.58 27.88 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.186 -0.461 . . . . 52.31 109.868 177.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -83.22 153.3 24.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.124 0.487 . . . . 72.11 111.577 -176.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -84.55 144.17 28.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.523 -0.762 . . . . 74.42 110.342 177.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 6.0 tp -60.36 116.62 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.592 0.71 . . . . 73.33 110.738 -178.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.64 ' HB3' ' HB3' ' B' ' 124' ' ' SER . 32.0 m -85.23 123.14 30.39 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.336 -0.847 . . . . 53.33 110.814 -177.245 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.55 ' HG2' ' OE1' ' A' ' 26' ' ' GLN . 0.0 OUTLIER -132.71 14.8 4.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.174 0.512 . . . . 73.4 111.038 179.468 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.55 ' OE1' ' HG2' ' A' ' 25' ' ' LYS . 2.8 mp0 -97.72 82.96 3.12 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.275 -0.639 . . . . 74.13 109.275 175.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.417 ' HZ2' ' HB2' ' A' ' 63' ' ' LEU . 86.9 m95 -100.83 -75.05 0.59 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.968 0.413 . . . . 74.51 111.786 -174.089 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 14.6 m -83.33 19.86 1.43 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.835 0.679 . . . . 74.43 112.835 -169.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.516 ' OD1' ' HB ' ' B' ' 183' ' ' VAL . 27.3 t-20 -85.82 -21.49 28.09 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 122.073 -0.392 . . . . 74.45 110.629 179.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.695 HG13 ' HG ' ' B' ' 163' ' ' LEU . 27.5 m -55.79 -37.32 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 112.593 0.59 . . . . 70.24 112.593 -174.416 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.418 ' HB3' HD11 ' B' ' 149' ' ' LEU . 53.1 p90 -101.99 -5.41 24.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.713 0.292 . . . . 74.42 110.99 -177.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.545 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 8.7 t30 -62.96 -57.23 11.45 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.211 -0.449 . . . . 74.35 111.478 -172.348 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.587 HG23 ' HB3' ' B' ' 179' ' ' LEU . 4.2 mp -65.35 -37.2 79.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.142 0.496 . . . . 73.23 110.985 -176.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.0 mt -63.92 -32.37 73.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.978 -0.555 . . . . 72.13 110.527 178.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -77.08 -29.16 54.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.745 -0.661 . . . . 74.44 110.417 178.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.545 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 95.6 mt-10 -70.21 -47.98 59.08 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.073 -0.512 . . . . 74.55 110.952 177.567 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -92.13 6.09 47.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.067 -0.515 . . . . 70.43 111.536 -175.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 57.2 60.67 2.84 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 113.089 0.774 . . . . 72.32 113.089 177.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -86.32 -1.1 57.21 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.883 -0.784 . . . . 75.4 108.883 167.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 60.43 78.15 0.34 Allowed Pre-proline 0 C--O 1.235 0.291 0 CA-C-N 114.333 -1.303 . . . . 70.24 110.946 -179.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -79.14 161.77 26.14 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.639 2.226 . . . . 72.02 111.529 177.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -91.22 -162.88 0.96 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.146 0.498 . . . . 73.32 111.63 -179.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 12.8 p90 -85.42 154.38 21.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.297 -0.865 . . . . 75.32 112.053 -172.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.419 HD22 ' N ' ' A' ' 44' ' ' LEU . 2.9 mm? -110.73 79.45 1.21 Allowed 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.391 -0.822 . . . . 73.55 109.06 175.086 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 37.8 t -76.84 93.01 3.67 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.916 -0.583 . . . . 54.4 109.516 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -67.16 108.54 2.72 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.864 -0.607 . . . . 73.52 110.226 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.45 HG11 ' HB3' ' B' ' 145' ' ' CYS . 15.3 m -87.2 152.19 3.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 N-CA-C 108.784 -0.821 . . . . 75.31 108.784 172.116 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.515 ' H ' ' HD2' ' A' ' 48' ' ' LYS . 0.1 OUTLIER -102.46 140.22 37.02 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.947 -0.76 . . . . 72.03 108.947 -175.934 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.714 HD12 ' HB3' ' B' ' 131' ' ' PHE . 9.6 tp -66.01 -33.25 75.37 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.973 -0.751 . . . . 75.32 108.973 175.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.575 ' HB3' ' HG2' ' B' ' 142' ' ' LYS . . . 43.09 43.43 3.76 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 124.484 1.115 . . . . 75.1 112.639 169.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 41.6 p90 -84.55 165.08 18.33 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.061 -0.518 . . . . 64.11 110.544 -176.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -101.17 115.26 30.08 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.048 -0.524 . . . . 74.22 110.561 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.599 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 42.5 t -108.37 102.3 11.42 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.782 -0.644 . . . . 73.4 109.844 178.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.4 t70 68.2 8.39 6.53 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.878 -0.601 . . . . 72.24 111.435 174.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 129.52 -32.06 3.28 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.476 -0.869 . . . . 75.14 112.654 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.746 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 11.6 pt-20 -92.71 141.65 28.23 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.783 0.325 . . . . 74.11 110.602 -178.644 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.4 mm -85.88 120.71 36.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.708 -0.478 . . . . 73.21 109.708 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.746 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 26.7 mmmt -108.4 119.22 38.88 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.032 0.444 . . . . 73.13 110.634 -177.567 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.4 p -95.5 108.58 20.82 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.34 0.591 . . . . 71.32 111.838 -179.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -129.71 145.98 51.5 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.4 -0.818 . . . . 74.34 109.616 176.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.6 m -131.24 14.51 5.11 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.031 0.443 . . . . 71.1 110.576 178.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -152.3 173.14 15.4 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.991 -0.55 . . . . 74.04 109.631 177.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.854 ' HG ' HG11 ' B' ' 130' ' ' VAL . 3.1 mt -90.53 -25.68 20.12 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.264 0.468 . . . . 74.14 112.264 -174.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 51.0 tp60 -73.23 -43.55 61.02 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.651 0.262 . . . . 71.24 110.786 -173.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.0 p -68.09 -40.85 82.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.231 -0.44 . . . . 74.43 110.672 179.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.467 HD22 ' O ' ' A' ' 66' ' ' LEU . 6.3 tt -67.35 -36.65 81.82 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.05 -0.523 . . . . 72.5 109.969 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.636 ' HG3' HD11 ' A' ' 84' ' ' LEU . 66.7 ttt180 -58.21 -34.51 70.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.953 -0.567 . . . . 75.42 110.618 -179.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -59.27 -51.81 68.35 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.909 -0.587 . . . . 74.44 110.59 175.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -70.8 -45.94 63.73 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.024 -0.989 . . . . 72.52 111.195 -174.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.59 -31.22 71.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.298 -0.41 . . . . 71.53 111.859 -178.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.7 t -72.79 -40.88 65.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.706 0.289 . . . . 65.32 110.933 -178.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -82.85 -12.77 57.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.012 0.434 . . . . 74.44 111.226 -176.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.599 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 31.0 mmmt -80.78 143.37 32.92 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.244 -0.434 . . . . 74.25 110.141 174.216 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 5.5 m -77.18 -46.43 23.38 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.085 0.469 . . . . 71.43 109.949 178.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 14.0 p -70.15 -50.23 42.59 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.756 -0.657 . . . . 74.33 111.413 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.531 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 68.2 mtp -66.36 -20.13 65.99 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.409 -0.359 . . . . 74.45 111.571 -175.77 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.618 ' HZ2' ' HB2' ' A' ' 77' ' ' LYS . 4.5 ttmp? -61.23 -31.76 71.55 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.017 0.437 . . . . 74.22 110.492 177.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -97.36 1.42 49.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.452 0.644 . . . . 73.31 110.585 -177.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.449 ' HB3' HG22 ' B' ' 133' ' ' ILE . 81.4 mt -98.12 -47.59 5.43 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.377 -0.828 . . . . 75.22 109.433 177.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.554 ' HB3' HD12 ' A' ' 84' ' ' LEU . 4.2 mm? -85.5 -8.57 58.27 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.492 -0.776 . . . . 74.41 111.463 -177.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -56.84 -20.63 23.82 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.868 0.366 . . . . 75.2 111.284 176.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -72.73 -45.54 58.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.192 -0.458 . . . . 74.11 111.46 -176.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 27.1 m -105.67 -22.6 4.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 112.494 0.553 . . . . 74.5 112.494 -174.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.636 HD11 ' HG3' ' A' ' 67' ' ' ARG . 94.2 mt -98.12 126.89 38.48 Favored Pre-proline 0 C--N 1.324 -0.537 0 C-N-CA 120.753 -0.379 . . . . 70.32 110.107 -179.444 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -53.11 127.76 26.35 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 123.408 2.739 . . . . 70.41 112.502 -178.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 86.0 mm-40 -122.59 -160.03 0.86 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.662 -0.699 . . . . 73.44 110.23 -178.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm 67.39 13.4 9.33 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.481 0.712 . . . . 73.11 111.519 178.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 115.515 -0.766 . . . . 73.45 111.1 177.679 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.465 0 N-CA-C 112.003 -0.439 . . . . 73.33 112.003 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . 0.452 HG12 ' HG2' ' B' ' 104' ' ' MET . 48.2 t -91.84 108.37 19.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.814 0.34 . . . . 63.22 110.176 178.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 10.0 mp -80.07 104.73 10.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.207 0.527 . . . . 74.11 111.267 -177.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 104' ' ' MET . . . . . 0.452 ' HG2' HG12 ' B' ' 102' ' ' VAL . 87.9 mmm -127.61 100.75 6.11 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.216 -0.902 . . . . 72.33 109.043 176.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 45.9 m-20 -98.27 126.86 43.94 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.279 0.561 . . . . 75.01 111.371 -173.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -153.73 108.71 3.14 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.122 -0.945 . . . . 75.33 108.785 177.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -73.01 -97.08 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.628 -0.796 . . . . 71.32 112.482 -176.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -135.39 174.56 10.48 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.862 0.363 . . . . 75.45 110.321 -178.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 p -87.12 103.0 12.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 121.635 0.731 . . . . 74.22 110.066 177.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 5.0 tt -75.62 104.0 5.98 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.683 -0.689 . . . . 75.14 109.149 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 56.5 m -149.93 118.25 6.43 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.011 0.434 . . . . 74.15 111.036 -178.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . 0.41 HD12 ' N ' ' B' ' 113' ' ' ALA . 1.2 tm? -89.45 131.51 35.46 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.669 -0.863 . . . . 75.52 108.669 174.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 113' ' ' ALA . . . . . 0.642 ' HB1' ' HA ' ' B' ' 117' ' ' SER . . . -55.13 128.34 33.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.828 0.346 . . . . 72.45 111.589 -177.533 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -91.06 -44.4 9.32 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.31 -0.405 . . . . 75.14 111.778 -177.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -79.15 -55.7 4.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.087 -0.506 . . . . 71.45 110.696 -174.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 6.6 mp -90.56 -28.53 18.41 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.002 -0.545 . . . . 74.01 110.368 -178.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.642 ' HA ' ' HB1' ' B' ' 113' ' ' ALA . 50.7 m 50.96 58.01 6.03 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.534 -0.757 . . . . 65.01 110.906 -175.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 3.4 m -70.67 74.49 0.58 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.902 -1.044 . . . . 74.24 110.39 178.064 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -101.5 9.89 40.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.537 -0.756 . . . . 75.33 110.202 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 21.5 m -88.27 117.38 27.14 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.48 -0.782 . . . . 74.4 109.616 177.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . 0.501 ' HB2' ' HA ' ' B' ' 183' ' ' VAL . 3.5 mm? -70.04 167.07 18.39 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.22 -0.446 . . . . 63.41 110.867 -178.086 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -142.46 143.6 32.67 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.996 -0.547 . . . . 71.31 109.956 -176.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 5.1 tp -66.45 108.11 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.783 0.802 . . . . 75.4 111.399 -176.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 124' ' ' SER . . . . . 0.64 ' HB3' ' HB3' ' A' ' 24' ' ' SER . 48.1 m -91.86 141.14 28.98 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.277 -0.874 . . . . 74.2 110.156 178.648 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.51 17.21 3.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.903 0.382 . . . . 73.12 111.644 -178.323 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -101.12 91.72 4.67 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.076 0.465 . . . . 74.45 110.132 176.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 39.5 m95 -114.89 -57.44 2.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.738 -0.664 . . . . 74.23 110.426 -176.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 19.4 m -82.35 -1.77 50.81 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.71 -0.677 . . . . 71.25 111.692 -173.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -77.96 -14.19 59.62 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.988 0.423 . . . . 74.5 110.496 -177.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.854 HG11 ' HG ' ' A' ' 63' ' ' LEU . 35.6 m -63.01 -32.76 57.3 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-N 116.25 -0.432 . . . . 63.31 111.982 -176.301 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 131' ' ' PHE . . . . . 0.714 ' HB3' HD12 ' A' ' 49' ' ' LEU . 53.8 p90 -108.93 3.56 22.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.743 0.306 . . . . 74.45 110.823 -178.457 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.4 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 7.5 t30 -62.79 -50.63 70.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.018 -0.537 . . . . 73.33 111.151 -173.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 133' ' ' ILE . . . . . 0.449 HG22 ' HB3' ' A' ' 79' ' ' LEU . 3.4 mp -68.39 -41.52 83.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.176 0.512 . . . . 74.42 110.456 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.405 HD13 HD23 ' A' ' 49' ' ' LEU . 88.8 mt -62.95 -29.22 70.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.739 -0.664 . . . . 75.23 111.172 -178.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -72.02 -40.11 68.7 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.197 -0.456 . . . . 75.32 110.692 179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 136' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 9.6 mm-40 -72.8 -32.09 65.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.13 -0.486 . . . . 74.33 110.79 -178.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -95.48 3.72 53.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.005 -0.543 . . . . 72.51 111.072 -179.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 53.19 58.14 5.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.435 -0.802 . . . . 74.41 112.8 177.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -89.31 -1.07 57.92 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.282 0.563 . . . . 63.02 109.604 170.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 63.58 84.05 0.19 Allowed Pre-proline 0 C--O 1.233 0.225 0 CA-C-N 114.508 -1.224 . . . . 74.43 111.534 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . 0.435 ' HB3' ' HB2' ' B' ' 131' ' ' PHE . 60.0 Cg_endo -75.19 132.83 15.6 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.463 2.109 . . . . 73.12 110.604 172.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 142' ' ' LYS . . . . . 0.575 ' HG2' ' HB3' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -79.86 -171.09 2.71 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.605 0.595 . . . . 74.33 112.605 -173.205 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 143' ' ' PHE . . . . . 0.417 ' O ' HG22 ' A' ' 47' ' ' VAL . 13.5 p90 -68.67 131.59 45.45 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.156 0.799 . . . . 72.21 113.156 -163.387 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -90.22 85.54 6.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.543 -0.753 . . . . 71.25 109.838 174.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 145' ' ' CYS . . . . . 0.45 ' HB3' HG11 ' A' ' 47' ' ' VAL . 45.4 t -82.07 106.18 13.77 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.42 -0.585 . . . . 64.31 109.42 177.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.55 94.91 6.98 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.899 -0.592 . . . . 75.14 111.389 -176.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 8.3 m -84.24 152.07 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 N-CA-C 108.438 -0.949 . . . . 74.31 108.438 170.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.28 145.27 48.04 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.896 -0.409 . . . . 73.44 109.896 -173.163 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.609 ' HB3' ' HD1' ' B' ' 151' ' ' PHE . 4.2 mm? -53.44 -46.15 69.74 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 123.48 0.488 . . . . 72.14 109.963 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . 48.14 36.35 6.48 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 124.118 0.886 . . . . 52.04 111.871 174.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 151' ' ' PHE . . . . . 0.609 ' HD1' ' HB3' ' B' ' 149' ' ' LEU . 42.3 p90 -82.59 169.68 16.02 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.099 -0.5 . . . . 75.0 109.952 -178.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 28.4 ttmt -106.39 125.34 50.87 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.214 -0.448 . . . . 65.34 110.581 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 153' ' ' CYS . . . . . . . . . . . . . 35.4 t -124.96 105.2 9.03 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.279 -0.637 . . . . 61.4 109.279 177.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 34.7 t70 67.19 28.6 8.09 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.529 0.68 . . . . 70.13 110.81 176.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 107.12 -35.76 4.83 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.552 -0.832 . . . . 73.22 112.877 175.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -92.87 145.26 24.52 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.047 0.451 . . . . 55.13 110.762 -177.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 50.0 mm -84.74 125.13 40.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.755 -0.657 . . . . 74.22 110.06 -179.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 158' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -106.17 110.77 23.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.141 0.496 . . . . 75.02 110.063 -178.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -98.34 107.49 19.97 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.924 -0.58 . . . . 72.11 112.119 -175.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -131.53 151.97 51.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.54 -0.755 . . . . 75.44 109.928 176.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 64.3 m -131.29 5.63 4.45 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.346 0.594 . . . . 64.45 109.89 173.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -125.4 145.13 50.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.541 -0.754 . . . . 73.32 109.894 -179.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . 0.695 ' HG ' HG13 ' A' ' 30' ' ' VAL . 1.0 OUTLIER -71.58 -35.11 70.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.098 0.475 . . . . 61.21 109.776 178.993 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 164' ' ' GLN . . . . . 0.455 ' O ' ' HG2' ' B' ' 168' ' ' LYS . 50.5 tp60 -66.72 -42.73 85.86 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.934 -0.575 . . . . 73.4 111.414 -176.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 10.3 p -69.6 -39.22 77.38 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.846 0.355 . . . . 64.13 110.925 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 54.0 tp -65.53 -36.24 83.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.964 0.412 . . . . 72.42 109.973 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . 0.423 ' HB3' ' O ' ' B' ' 164' ' ' GLN . 61.4 ttt180 -57.29 -39.84 76.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.711 -0.677 . . . . 74.4 110.57 174.176 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 168' ' ' LYS . . . . . 0.794 ' HZ1' ' HB3' ' B' ' 168' ' ' LYS . 2.8 mmmp? -60.39 -39.24 86.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.717 -0.674 . . . . 64.41 110.91 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -77.66 -45.02 26.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.081 -0.509 . . . . 73.35 110.799 -178.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 170' ' ' ALA . . . . . 0.746 ' HB1' HD12 ' B' ' 180' ' ' LEU . . . -59.19 -38.1 79.02 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.115 -0.493 . . . . 75.43 111.666 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 8.7 t -65.55 -31.68 72.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.092 -0.504 . . . . 75.22 111.157 -176.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -94.17 4.62 53.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.988 0.423 . . . . 71.44 110.718 -179.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -105.55 140.84 38.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.23 -0.441 . . . . 74.55 110.477 177.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.4 p -67.26 -54.92 16.47 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.994 -0.548 . . . . 71.22 111.166 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 175' ' ' SER . . . . . 0.431 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 25.0 p -76.55 -46.99 24.06 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.829 -0.623 . . . . 74.43 111.653 -174.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 69.8 mtp -66.49 -21.59 66.18 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.127 0.417 . . . . 74.23 112.127 -174.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . 0.473 ' HB2' ' HZ1' ' B' ' 177' ' ' LYS . 4.2 ttmp? -64.94 -29.26 70.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.21 0.528 . . . . 74.04 109.828 176.132 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . 0.465 ' CD ' ' HZ2' ' B' ' 181' ' ' LYS . 6.8 mm-40 -94.7 -13.77 25.45 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 115.578 -0.737 . . . . 72.3 110.084 -176.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 179' ' ' LEU . . . . . 0.587 ' HB3' HG23 ' A' ' 33' ' ' ILE . 81.6 mt -86.71 -47.94 8.7 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.389 -0.823 . . . . 63.33 109.823 178.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 180' ' ' LEU . . . . . 0.746 HD12 ' HB1' ' B' ' 170' ' ' ALA . 8.9 mt -89.81 -2.17 58.16 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.759 -0.655 . . . . 64.45 111.339 -173.212 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 181' ' ' LYS . . . . . 0.465 ' HZ2' ' CD ' ' B' ' 178' ' ' GLU . 64.1 pttt -64.92 -9.07 18.41 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.298 0.571 . . . . 74.42 110.518 173.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -61.71 -33.88 74.81 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.571 -0.741 . . . . 75.01 109.914 175.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 183' ' ' VAL . . . . . 0.516 ' HB ' ' OD1' ' A' ' 29' ' ' ASN . 14.3 p -113.15 -29.4 2.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 115.845 -0.616 . . . . 71.14 110.99 178.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 184' ' ' LEU . . . . . . . . . . . . . 91.8 mt -91.52 118.17 68.23 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.431 -0.35 . . . . 75.03 110.975 -176.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_exo -61.54 130.54 32.07 Favored 'Trans proline' 0 C--O 1.236 0.399 0 C-N-CA 122.835 2.357 . . . . 73.44 111.862 178.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 87.7 mm-40 -105.94 -152.68 0.48 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.938 -0.574 . . . . 74.34 110.685 -177.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 63.2 mttm 61.53 34.21 18.03 Favored 'General case' 0 N--CA 1.447 -0.625 0 O-C-N 123.994 0.809 . . . . 75.25 112.313 178.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.425 -0.798 . . . . 65.53 109.012 171.553 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.759 0 N-CA-C 112.065 -0.414 . . . . 73.34 112.065 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 27.0 m -108.88 1.23 9.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.138 0.494 . . . . 65.35 110.445 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 90.6 mt -99.15 -143.97 0.32 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.776 -0.647 . . . . 75.02 109.63 178.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.437 ' O ' ' HG2' ' A' ' 4' ' ' MET . 1.2 pmm? -73.62 81.67 1.52 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.797 0.808 . . . . 73.21 110.644 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -106.09 119.14 38.43 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.369 -0.832 . . . . 72.14 109.986 -178.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -108.09 9.61 28.31 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.441 -0.799 . . . . 73.42 111.28 -175.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 152.11 -85.78 0.15 Allowed Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.339 -0.934 . . . . 73.43 112.76 -178.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -155.35 156.91 36.28 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.971 0.415 . . . . 73.12 111.432 -177.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 28.9 m -83.5 173.3 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.88 -0.6 . . . . 74.44 110.78 176.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.7 mp -90.98 132.71 35.82 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.187 -0.46 . . . . 75.15 111.08 -177.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 26.7 m -120.75 121.6 38.57 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.891 -0.595 . . . . 65.42 109.931 177.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.8 tt -93.43 122.25 35.66 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.313 -0.625 . . . . 73.32 109.313 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.62 ' H ' ' HB3' ' A' ' 17' ' ' SER . . . -125.94 149.33 48.82 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.634 -0.712 . . . . 62.14 110.285 -179.753 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.65 -17.09 63.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.164 -0.471 . . . . 75.4 112.177 -175.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 23.2 p-10 -133.29 -44.54 0.84 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.896 0.379 . . . . 75.33 111.157 -178.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.69 44.26 1.19 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.991 0.424 . . . . 75.32 110.575 -176.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.62 ' HB3' ' H ' ' A' ' 13' ' ' ALA . 22.9 t -176.56 -52.48 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.692 -0.685 . . . . 63.43 109.225 -179.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.0 t -87.69 93.44 9.44 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.515 -0.55 . . . . 74.13 109.515 174.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -92.77 -158.77 0.62 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.927 -0.579 . . . . 74.14 111.769 -174.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.67 -157.85 0.24 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.671 -0.695 . . . . 61.4 110.82 -178.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.458 ' H ' HD22 ' A' ' 21' ' ' LEU . 2.6 pt? -71.38 -175.73 1.33 Allowed 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.328 0.585 . . . . 70.32 111.515 -176.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.436 ' O ' ' HB ' ' A' ' 23' ' ' ILE . 6.2 p-10 -106.16 178.58 4.52 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.332 -0.849 . . . . 71.21 111.566 -173.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.574 HG23 ' HB2' ' B' ' 122' ' ' ASP . 17.3 tt 169.35 128.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 114.476 -1.238 . . . . 74.54 108.054 172.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.7 p -147.82 141.46 25.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.205 0.526 . . . . 54.13 112.055 -172.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.767 ' HB3' ' HA ' ' B' ' 117' ' ' SER . 34.5 mttp -136.58 -7.45 1.94 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.632 -0.713 . . . . 73.13 110.561 177.011 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.656 ' HG2' HD21 ' B' ' 163' ' ' LEU . 21.3 mp0 -87.29 99.52 12.03 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.513 -0.767 . . . . 74.43 111.237 -166.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.571 ' CZ2' ' HB2' ' A' ' 62' ' ' ASP . 68.5 m95 -110.99 -74.33 0.65 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.408 -0.815 . . . . 72.44 111.466 -179.384 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 44.8 t -88.26 -62.85 1.4 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.737 -0.665 . . . . 70.12 112.144 -171.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.492 ' HA ' ' HB3' ' A' ' 32' ' ' ASN . 57.9 t30 -80.28 68.53 6.47 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.338 0.589 . . . . 73.3 111.951 -170.405 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 48.5 t -120.11 -63.1 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 108.698 -0.852 . . . . 74.32 108.698 171.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -88.04 -6.59 57.88 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.191 -0.913 . . . . 72.2 110.292 175.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.492 ' HB3' ' HA ' ' A' ' 29' ' ' ASN . 10.6 t30 -65.38 -43.04 92.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.548 -0.751 . . . . 75.51 111.074 -176.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.833 HG21 ' HB3' ' B' ' 179' ' ' LEU . 38.5 mm -60.41 -40.27 83.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-O 121.478 0.656 . . . . 72.4 110.594 177.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.677 HD13 HD23 ' B' ' 149' ' ' LEU . 82.9 mt -69.23 -25.84 64.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.489 -0.778 . . . . 73.1 110.71 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 54.1 ttt180 -67.47 -47.49 69.95 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.117 -0.492 . . . . 74.13 110.085 175.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -64.11 -39.3 93.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.499 -0.773 . . . . 63.14 111.777 -177.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -97.43 8.37 44.74 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.348 -0.387 . . . . 74.04 111.036 -175.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 14.3 t70 53.32 64.38 1.87 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.213 -0.903 . . . . 70.4 111.949 177.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.65 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 16.8 m-85 -92.82 -6.24 49.29 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.307 -0.627 . . . . 73.3 109.307 167.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 69.43 88.43 0.1 Allowed Pre-proline 0 CA--C 1.53 0.182 0 CA-C-N 114.789 -1.096 . . . . 71.2 111.233 -178.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.432 ' HA ' HD13 ' B' ' 149' ' ' LEU . 16.8 Cg_exo -67.23 135.03 35.63 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.633 2.222 . . . . 71.42 110.505 174.119 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.633 ' H ' HD12 ' B' ' 149' ' ' LEU . 33.4 tptt -80.66 -74.47 0.31 Allowed 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.284 -0.566 . . . . 73.12 111.565 -171.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.558 ' HD2' HG21 ' B' ' 147' ' ' VAL . 44.7 t80 -120.53 130.19 54.14 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.864 0.364 . . . . 75.32 110.024 -178.36 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.402 HD22 ' N ' ' A' ' 44' ' ' LEU . 2.9 mm? -78.18 146.33 35.08 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.063 -0.517 . . . . 71.33 110.031 -179.066 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 49.0 t -78.04 88.11 4.18 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.214 0.531 . . . . 73.33 110.781 -177.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -117.1 11.71 14.29 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 122.01 0.909 . . . . 74.42 109.024 174.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 48.9 t -91.26 104.52 15.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.182 -0.917 . . . . 73.44 110.246 -178.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.68 142.22 46.77 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.62 -0.718 . . . . 74.24 109.637 177.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.714 ' HB3' ' HD1' ' A' ' 51' ' ' PHE . 7.1 mp -57.74 -44.77 86.29 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.334 0.494 . . . . 75.51 112.334 -173.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.857 ' HB1' ' HD2' ' B' ' 142' ' ' LYS . . . 39.49 49.48 1.94 Allowed 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.806 0.691 . . . . 74.34 111.85 -179.422 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.714 ' HD1' ' HB3' ' A' ' 49' ' ' LEU . 48.4 p90 -88.48 167.92 13.05 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.889 -0.596 . . . . 74.42 110.415 -175.467 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.419 ' HE3' ' HB2' ' A' ' 52' ' ' LYS . 29.3 ttmt -99.68 115.0 28.46 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.223 0.535 . . . . 74.52 110.809 -178.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.555 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 34.9 t -110.47 95.23 5.44 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.668 -0.696 . . . . 74.34 110.018 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 69.08 12.45 8.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.998 -1.001 . . . . 54.02 112.3 176.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 138.78 -40.87 1.41 Allowed Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.523 -0.846 . . . . 73.41 112.675 176.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.464 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 9.8 pt-20 -96.42 150.91 20.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.106 0.479 . . . . 73.02 111.157 -175.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.6 mm -83.44 120.57 34.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.585 -0.734 . . . . 75.51 110.533 178.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.544 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 29.1 mmmt -106.25 106.92 17.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.02 -0.536 . . . . 73.15 110.124 -179.574 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -81.44 98.49 8.26 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.952 0.406 . . . . 74.14 111.256 178.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.544 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 41.3 m-85 -117.74 138.26 52.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.228 -0.442 . . . . 74.42 110.953 179.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 4.3 p -136.78 3.96 2.76 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.565 -0.743 . . . . 71.42 109.979 175.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.571 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 29.9 t70 -125.18 122.44 37.07 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.416 -0.811 . . . . 65.31 109.965 -178.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.1 tt -66.98 -42.82 84.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 72.43 110.032 -176.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.458 ' HB3' ' OD2' ' A' ' 62' ' ' ASP . 6.8 tt0 -51.77 -50.69 60.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.815 -0.629 . . . . 74.23 111.376 -179.719 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 10.5 m -69.21 -38.02 78.36 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.855 -0.611 . . . . 60.23 110.934 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.5 tp -68.79 -38.68 80.16 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.234 -0.439 . . . . 72.43 111.001 -178.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -57.28 -43.15 82.85 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.076 -0.511 . . . . 75.34 111.135 179.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -63.48 -40.43 97.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 72.42 110.429 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.484 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 81.3 t80 -67.55 -42.41 82.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.757 -0.656 . . . . 75.43 110.598 179.124 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.98 -32.52 73.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.998 -0.547 . . . . 72.34 111.293 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.4 m -71.61 -31.81 67.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.401 -0.363 . . . . 64.33 111.377 -179.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 20.6 pt20 -85.21 -9.5 57.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.229 0.538 . . . . 72.42 110.394 179.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.555 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 28.3 mmmt -93.42 111.24 22.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.713 -0.676 . . . . 75.33 109.651 174.46 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.6 m -55.55 -37.11 67.56 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.669 0.271 . . . . 74.31 111.137 -178.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.543 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 21.6 m -75.33 -42.92 53.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.569 -0.287 . . . . 72.53 111.325 -178.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.439 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 80.8 mtp -77.87 -24.16 48.6 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.659 0.266 . . . . 72.22 111.614 -174.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -60.13 -36.7 78.08 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.853 0.359 . . . . 73.41 111.31 -179.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.453 ' CD ' ' HZ3' ' A' ' 81' ' ' LYS . 9.5 mm-40 -84.42 -16.11 43.81 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.953 0.883 . . . . 72.31 109.473 -174.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 75' ' ' SER . 59.6 mt -81.1 -51.78 8.09 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 114.312 -1.313 . . . . 74.51 109.697 178.366 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.436 HD12 ' HA ' ' A' ' 80' ' ' LEU . 4.2 mm? -78.49 -30.45 47.24 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.374 -0.83 . . . . 72.2 112.638 -174.001 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.453 ' HZ3' ' CD ' ' A' ' 78' ' ' GLU . 59.6 pttt -64.53 -10.18 24.09 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 118.367 0.531 . . . . 72.04 112.003 -173.097 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -75.55 -39.66 57.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.912 0.387 . . . . 73.31 110.98 -177.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 27.7 m -114.59 -5.92 11.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.091 -0.504 . . . . 70.32 110.92 -178.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 67.9 tp -122.01 95.84 47.19 Favored Pre-proline 0 C--N 1.321 -0.649 0 CA-C-N 115.777 -0.647 . . . . 75.34 109.841 -178.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -69.85 116.2 4.46 Favored 'Trans proline' 0 C--O 1.233 0.233 0 C-N-CA 123.385 2.723 . . . . 74.53 112.753 -177.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -83.05 100.35 10.43 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.012 0.434 . . . . 73.34 110.855 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -85.16 -22.4 28.81 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.775 -0.648 . . . . 75.41 110.008 175.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 . . . . . 0 C--N 1.325 -0.465 0 CA-C-N 115.415 -0.811 . . . . 73.25 110.033 -178.654 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.235 0 N-CA-C 112.316 -0.314 . . . . 54.52 112.316 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . 0.637 HG22 ' HG ' ' B' ' 103' ' ' LEU . 2.7 p -93.8 -57.11 4.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.617 0.246 . . . . 74.4 110.926 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 103' ' ' LEU . . . . . 0.637 ' HG ' HG22 ' B' ' 102' ' ' VAL . 97.6 mt -139.01 169.51 17.65 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.042 -0.355 . . . . 75.13 110.042 -179.39 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 47.55 28.45 1.19 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.437 1.095 . . . . 72.24 112.861 176.076 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -96.36 119.56 35.08 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.744 -0.662 . . . . 62.24 110.701 178.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -97.16 5.12 50.73 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.415 -0.811 . . . . 74.41 110.428 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 91.05 -63.43 2.81 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 121.034 -0.603 . . . . 64.54 112.507 179.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -111.88 145.15 40.02 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.744 0.307 . . . . 73.41 110.435 179.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 23.3 m -99.67 -179.91 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.077 -0.51 . . . . 75.45 110.561 179.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 8.0 mp -85.16 113.66 21.7 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.925 -0.398 . . . . 72.11 109.925 177.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 12.4 m -118.62 114.13 22.3 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.369 -0.378 . . . . 75.22 110.495 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 2.9 tt -78.95 111.58 15.28 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.101 -0.703 . . . . 74.44 109.101 177.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 113' ' ' ALA . . . . . 0.471 ' O ' ' HB3' ' B' ' 117' ' ' SER . . . -95.42 104.39 16.29 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.709 -0.678 . . . . 74.22 110.568 -176.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . 0.48 ' HA ' ' HB3' ' B' ' 118' ' ' SER . . . -81.75 -2.01 49.17 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.158 0.504 . . . . 75.43 111.024 -178.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 29.7 p-10 -123.81 -21.65 5.1 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.75 -0.659 . . . . 74.33 111.456 -177.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 7.0 mp -119.3 6.36 11.19 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 111.976 0.361 . . . . 75.43 111.976 -179.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.767 ' HA ' ' HB3' ' A' ' 25' ' ' LYS . 41.3 t -140.43 -59.73 0.52 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.798 -0.445 . . . . 73.33 109.798 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 118' ' ' SER . . . . . 0.48 ' HB3' ' HA ' ' B' ' 114' ' ' ALA . 22.7 t -78.87 83.09 5.02 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.682 -0.488 . . . . 71.12 109.682 177.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -158.97 -148.85 0.2 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.846 -0.616 . . . . 74.33 110.228 -176.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 120' ' ' THR . . . . . 0.517 ' O ' ' HE2' ' A' ' 25' ' ' LYS . 1.2 m -55.77 110.74 0.77 Allowed 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.559 0.344 . . . . 75.34 110.218 176.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . 0.441 ' HB3' ' HD2' ' B' ' 185' ' ' PRO . 0.2 OUTLIER -65.94 166.24 11.73 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 113.465 0.913 . . . . 74.53 113.465 -171.42 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 122' ' ' ASP . . . . . 0.574 ' HB2' HG23 ' A' ' 23' ' ' ILE . 1.8 p30 -154.73 -177.76 6.73 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-N 114.149 -1.387 . . . . 74.53 109.022 176.042 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -152.01 149.93 13.42 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 115.901 -0.591 . . . . 74.51 111.423 -170.046 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 2.7 p -86.08 137.76 32.44 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.559 -0.746 . . . . 74.54 111.222 -179.051 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.71 6.71 6.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.375 0.607 . . . . 73.44 109.552 175.088 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 23.6 mp0 -114.4 121.88 44.93 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.461 -0.79 . . . . 73.41 109.762 -176.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -94.54 -79.76 0.42 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.18 0.514 . . . . 75.45 110.435 -176.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 23.1 t -104.37 1.2 29.95 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.408 0.623 . . . . 73.4 109.825 -178.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -57.91 -32.02 67.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.198 -0.91 . . . . 71.4 111.822 -174.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 21.8 t -60.94 -61.37 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.961 -0.563 . . . . 74.51 111.897 -174.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -94.19 -4.36 49.17 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.447 -0.342 . . . . 73.12 111.775 -173.18 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.532 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 63.7 t30 -59.75 -50.25 74.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.096 0.474 . . . . 72.14 110.201 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 133' ' ' ILE . . . . . 0.531 ' CG2' ' HB3' ' A' ' 79' ' ' LEU . 46.8 mm -59.38 -48.19 87.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.679 -0.691 . . . . 73.24 110.966 -179.033 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 80.9 mt -57.86 -36.58 72.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.022 -0.535 . . . . 73.14 111.263 177.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 36.9 ttt180 -67.17 -44.21 80.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.231 -0.44 . . . . 75.4 110.532 179.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 136' ' ' GLU . . . . . 0.532 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 10.6 mm-40 -68.3 -39.67 81.98 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.923 -0.581 . . . . 74.42 111.562 -178.046 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 52.4 m-80 -90.0 5.16 47.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.996 0.427 . . . . 74.52 110.695 -179.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 11.8 t70 56.53 57.03 5.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.112 -0.949 . . . . 74.4 112.19 173.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -90.61 8.9 31.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.791 -0.64 . . . . 74.13 109.996 173.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 60.61 80.93 0.25 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 114.926 -1.034 . . . . 73.42 111.488 -176.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -71.15 156.12 60.02 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 121.732 1.622 . . . . 73.11 109.831 171.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 142' ' ' LYS . . . . . 0.857 ' HD2' ' HB1' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -77.69 -144.19 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.239 -0.585 . . . . 70.23 111.739 -176.804 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -75.72 165.64 24.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.115 -0.493 . . . . 75.44 111.089 -169.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . 0.849 HD11 ' H ' ' B' ' 144' ' ' LEU . 0.0 OUTLIER -64.16 160.94 17.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.785 -0.643 . . . . 75.24 110.48 175.757 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 50.1 t -94.91 108.89 20.94 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.226 0.536 . . . . 74.41 111.271 -176.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -97.45 8.5 44.5 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.656 -0.702 . . . . 74.1 109.647 171.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 147' ' ' VAL . . . . . 0.558 HG21 ' HD2' ' A' ' 43' ' ' PHE . 41.2 t -82.22 82.67 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 CA-C-N 115.581 -0.736 . . . . 73.22 111.258 -175.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.75 112.58 16.88 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.14 -1.059 . . . . 74.21 108.14 165.649 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.677 HD23 HD13 ' A' ' 34' ' ' LEU . 63.0 tp -73.68 85.79 1.64 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.101 -0.5 . . . . 75.21 110.173 -176.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -90.71 86.51 6.37 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.366 -0.833 . . . . 73.22 110.485 178.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 151' ' ' PHE . . . . . 0.592 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 51.6 p90 -103.24 171.23 7.49 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.934 -0.575 . . . . 65.43 109.785 178.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -106.5 125.76 51.41 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.088 0.47 . . . . 73.31 111.009 -179.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 153' ' ' CYS . . . . . 0.42 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 48.6 t -122.09 104.29 9.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.74 -0.663 . . . . 72.23 109.746 176.647 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 65.38 26.48 12.0 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.809 -0.632 . . . . 65.13 111.504 176.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 114.94 -35.95 4.15 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.719 -0.753 . . . . 53.21 113.148 176.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -92.64 145.13 24.66 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.971 0.415 . . . . 73.4 110.909 -176.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.2 mm -83.0 131.31 34.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.893 -0.594 . . . . 75.42 109.669 175.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 158' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -117.05 100.7 7.92 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.319 -0.401 . . . . 74.44 110.468 -177.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.09 103.45 10.91 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.127 0.489 . . . . 44.31 111.318 178.313 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -116.6 113.87 23.31 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.962 -0.563 . . . . 74.31 110.84 177.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 14.5 m -103.79 -0.14 29.66 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.454 0.645 . . . . 74.31 109.753 174.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 162' ' ' ASP . . . . . 0.413 ' OD2' ' HB3' ' B' ' 164' ' ' GLN . 0.3 OUTLIER -133.65 141.78 47.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.3 -0.864 . . . . 73.14 110.612 -175.936 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . 0.656 HD21 ' HG2' ' A' ' 26' ' ' GLN . 44.8 tp -71.6 -34.33 69.8 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.952 -0.567 . . . . 75.11 111.341 -177.347 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 164' ' ' GLN . . . . . 0.463 ' O ' ' HG3' ' B' ' 168' ' ' LYS . 6.4 tt0 -60.09 -49.19 78.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.071 0.462 . . . . 73.11 110.238 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 20.9 m -58.43 -42.5 87.43 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.559 -0.746 . . . . 63.42 111.21 178.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 67.4 tp -68.66 -40.34 80.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.451 -0.341 . . . . 74.41 110.756 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . 1.089 ' HG3' HD21 ' B' ' 184' ' ' LEU . 15.1 ttp180 -61.11 -44.64 97.03 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.357 -0.383 . . . . 74.14 110.38 -178.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 168' ' ' LYS . . . . . 0.463 ' HG3' ' O ' ' B' ' 164' ' ' GLN . 48.9 mtmt -60.32 -29.77 69.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.978 -0.555 . . . . 72.12 111.317 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -84.7 -50.19 7.84 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.337 -0.392 . . . . 61.41 110.762 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.53 -32.82 74.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.084 -0.507 . . . . 75.52 111.968 -176.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 17.6 t -69.6 -19.0 63.66 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.886 0.328 . . . . 75.02 111.886 -176.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -104.88 2.34 29.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.912 0.387 . . . . 74.42 110.485 177.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 173' ' ' LYS . . . . . 0.42 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 29.6 mmmt -103.04 111.48 23.84 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.767 -0.651 . . . . 73.4 110.056 179.003 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 69.5 m -55.41 -34.38 64.34 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.8 0.333 . . . . 75.12 111.775 -178.152 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 175' ' ' SER . . . . . 0.455 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 6.8 m -77.03 -46.49 23.56 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.899 0.38 . . . . 75.14 110.975 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 73.9 mtp -78.31 -21.97 48.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.588 -0.278 . . . . 75.51 111.471 -173.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . 0.483 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 79.2 tttt -58.65 -37.46 76.01 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.164 0.507 . . . . 74.1 110.393 178.283 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -85.36 -13.95 47.9 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.6 0.714 . . . . 72.12 109.916 -175.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 179' ' ' LEU . . . . . 0.833 ' HB3' HG21 ' A' ' 33' ' ' ILE . 59.3 mt -84.28 -50.03 8.23 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 114.674 -1.148 . . . . 75.14 110.351 -179.296 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -88.84 -20.09 25.08 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.594 0.59 . . . . 75.33 112.594 -173.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 181' ' ' LYS . . . . . 0.483 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 62.7 pttt -59.95 -18.41 45.09 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.2 0.445 . . . . 75.21 112.2 -174.287 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -55.76 -49.42 73.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.004 0.43 . . . . 64.33 110.879 -177.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 18.4 m -109.71 3.66 9.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.768 -0.651 . . . . 75.55 110.48 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 184' ' ' LEU . . . . . 1.089 HD21 ' HG3' ' B' ' 167' ' ' ARG . 46.1 tp -135.34 83.53 37.78 Favored Pre-proline 0 N--CA 1.447 -0.614 0 CA-C-N 115.956 -0.565 . . . . 73.3 110.352 -175.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 185' ' ' PRO . . . . . 0.441 ' HD2' ' HB3' ' B' ' 121' ' ' LEU . 66.8 Cg_endo -75.73 103.74 1.79 Allowed 'Trans proline' 0 CA--C 1.528 0.219 0 C-N-CA 122.979 2.453 . . . . 74.04 112.772 -177.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 77.7 mm-40 -61.84 132.16 52.15 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.798 -0.637 . . . . 71.41 110.788 -176.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -95.79 -11.04 27.53 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.429 -0.805 . . . . 73.33 110.507 177.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 . . . . . 0 C--O 1.246 0.895 0 CA-C-O 118.54 -0.743 . . . . 70.34 110.492 179.645 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 112.038 -0.425 . . . . 70.24 112.038 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.661 HG23 HD21 ' A' ' 3' ' ' LEU . 18.8 m -107.1 -29.43 2.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 120.831 0.348 . . . . 74.13 110.417 178.25 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.661 HD21 HG23 ' A' ' 2' ' ' VAL . 4.1 mm? -85.26 88.2 7.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.182 0.515 . . . . 64.41 109.751 174.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 89.3 mtp -103.18 97.12 7.26 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.658 -0.701 . . . . 73.34 109.8 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -129.45 122.47 29.4 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.764 -0.653 . . . . 74.23 110.38 -178.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -127.74 101.16 6.25 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.357 -0.838 . . . . 74.54 110.002 -178.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.98 -145.12 13.57 Favored Glycine 0 N--CA 1.441 -0.97 0 C-N-CA 120.446 -0.883 . . . . 52.35 111.96 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -160.75 111.84 1.83 Allowed 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 110.228 -0.286 . . . . 73.53 110.228 -179.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 57.5 t -67.96 115.69 6.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 109.841 -0.429 . . . . 72.31 109.841 176.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 94.8 mt -54.7 130.54 40.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.93 -0.577 . . . . 71.22 110.704 -178.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 46.1 m -73.05 108.54 6.01 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.758 -0.655 . . . . 72.01 111.451 -178.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.524 HD21 ' N ' ' A' ' 13' ' ' ALA . 2.2 tt -81.72 141.59 33.43 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.306 -0.998 . . . . 73.53 108.306 174.114 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.524 ' N ' HD21 ' A' ' 12' ' ' LEU . . . -54.09 161.07 1.36 Allowed 'General case' 0 C--O 1.236 0.39 0 N-CA-C 112.507 0.558 . . . . 73.32 112.507 -177.672 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.28 -28.0 69.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.629 -0.714 . . . . 63.35 111.487 -174.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -149.09 -47.88 0.14 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.346 -0.388 . . . . 72.35 110.347 176.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.7 mt -157.38 137.22 12.38 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.676 -0.693 . . . . 73.22 110.916 -174.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.52 ' HB3' ' HB1' ' A' ' 13' ' ' ALA . 33.1 t 174.93 -24.59 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.966 -1.016 . . . . 72.43 108.539 176.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.9 t -77.81 83.77 4.15 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.423 -0.808 . . . . 72.23 110.155 178.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -98.03 26.94 4.85 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.044 -0.98 . . . . 74.51 108.722 173.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.8 m -59.43 105.19 0.33 Allowed 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 113.856 -1.52 . . . . 73.35 110.939 -173.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.443 ' HA ' ' HG2' ' B' ' 126' ' ' GLN . 4.0 tt -161.11 109.32 1.54 Allowed 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.948 -0.569 . . . . 75.34 109.593 -178.684 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.59 ' OD2' ' HA ' ' B' ' 124' ' ' SER . 3.5 p-10 -119.55 143.3 47.68 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.453 -0.573 . . . . 71.43 109.453 178.345 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 10.9 tt -126.43 123.44 63.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-O 121.177 0.513 . . . . 74.4 111.09 -174.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.565 ' HB2' ' OD1' ' B' ' 122' ' ' ASP . 31.7 p -94.97 -171.0 2.32 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.815 -0.63 . . . . 70.45 110.401 179.289 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -119.74 -54.03 2.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.152 0.501 . . . . 74.11 109.929 176.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -92.05 53.57 2.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.788 -0.642 . . . . 74.23 111.81 -173.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.451 ' HE3' ' C ' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -84.33 42.45 0.89 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.481 0.657 . . . . 75.52 111.439 178.053 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.1 m -110.44 17.4 20.85 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.778 -0.647 . . . . 74.33 110.42 -179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -85.44 44.21 1.08 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.226 0.536 . . . . 72.01 110.516 -176.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 15.3 m -69.14 114.55 6.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.086 -0.507 . . . . 64.42 111.64 -176.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 44.3 p90 44.47 28.16 0.29 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.4 1.08 . . . . 73.45 112.887 178.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -61.72 -53.33 57.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 73.2 111.108 -174.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.496 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 48.9 mm -59.3 -43.65 90.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.924 -0.58 . . . . 74.24 110.832 -177.597 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 86.5 mt -63.26 -35.13 79.33 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.759 -0.655 . . . . 74.41 111.012 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.427 HH11 ' HD3' ' A' ' 35' ' ' ARG . 35.0 ttt180 -70.58 -46.6 63.17 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.92 0.391 . . . . 73.42 110.322 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -59.21 -46.4 88.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.903 -0.59 . . . . 74.24 111.308 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -86.89 1.34 52.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.983 -0.553 . . . . 73.15 111.227 -177.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.6 t70 60.64 71.26 0.57 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.33 -0.85 . . . . 74.0 112.455 175.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -96.41 -6.8 36.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.508 -0.769 . . . . 74.43 110.105 167.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 57.84 73.69 0.72 Allowed Pre-proline 0 CA--C 1.53 0.199 0 CA-C-N 115.263 -0.881 . . . . 75.55 110.582 -176.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -78.44 150.35 25.05 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 122.918 2.412 . . . . 74.45 112.629 -177.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.494 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 5.5 mptp? -108.74 135.95 49.12 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.859 -0.61 . . . . 74.12 109.681 177.027 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 74.5 t80 174.28 100.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 O-C-N 123.637 0.585 . . . . 64.2 109.758 -175.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 86.7 mt -123.39 114.75 20.57 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.516 -0.55 . . . . 72.42 109.516 175.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.665 ' SG ' HG22 ' A' ' 47' ' ' VAL . 47.2 t -130.31 108.28 9.89 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.359 -0.382 . . . . 73.44 111.066 -175.159 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 46' ' ' GLU . 36.9 tt0 -117.5 21.61 12.92 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.738 0.78 . . . . 75.21 109.48 176.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.665 HG22 ' SG ' ' A' ' 45' ' ' CYS . 17.5 m -75.67 157.38 5.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.814 -0.63 . . . . 74.13 110.471 -178.102 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.483 ' HB3' ' OG ' ' A' ' 61' ' ' SER . 0.1 OUTLIER -153.84 143.44 21.69 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.554 -0.748 . . . . 74.22 110.092 -179.657 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.556 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.0 mp -69.64 82.06 0.42 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.155 -0.475 . . . . 73.1 109.957 175.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -82.56 67.38 8.59 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.259 0.552 . . . . 74.31 110.365 178.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.556 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 49.2 p90 -97.85 164.51 12.35 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.883 -0.599 . . . . 75.14 110.672 -177.714 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.2 tppt? -88.41 123.97 33.49 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.636 -0.711 . . . . 73.34 110.57 -178.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 17.6 t -141.72 119.84 12.12 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.326 -0.397 . . . . 63.33 109.954 176.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 69.99 13.9 7.87 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.711 -0.677 . . . . 73.54 112.194 177.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 104.64 -18.53 43.95 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.33 -0.938 . . . . 63.35 112.351 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -110.37 153.04 25.5 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.86 0.362 . . . . 65.3 110.08 179.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 47.6 mm -81.31 115.48 23.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.739 -0.467 . . . . 73.04 109.739 177.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -101.19 103.17 14.19 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.403 -0.362 . . . . 73.45 110.223 -177.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.58 124.82 28.57 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.391 -0.368 . . . . 72.12 111.526 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.423 ' CE2' ' HA ' ' A' ' 66' ' ' LEU . 74.6 m-85 -124.38 104.04 8.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.144 0.497 . . . . 70.31 111.44 176.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.483 ' OG ' ' HB3' ' A' ' 48' ' ' LYS . 5.8 m -95.2 -2.81 48.92 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.389 -0.823 . . . . 73.14 109.407 173.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -130.86 136.94 49.1 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.225 -0.898 . . . . 72.34 110.783 -177.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.6 tp -81.95 -27.24 33.37 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.909 -0.587 . . . . 75.51 110.801 -177.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -65.91 -44.2 85.93 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.244 0.545 . . . . 75.32 110.112 -178.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 45.5 m -65.66 -41.16 92.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.665 -0.698 . . . . 73.01 110.567 175.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.423 ' HA ' ' CE2' ' A' ' 60' ' ' PHE . 45.8 tp -61.1 -46.8 89.14 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 70.43 111.05 -178.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 50.3 ttt-85 -55.31 -48.34 74.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.135 -0.484 . . . . 74.41 111.063 178.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.41 ' HB2' ' HZ1' ' A' ' 68' ' ' LYS . 9.9 mtmp? -70.52 -30.39 67.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.199 -0.455 . . . . 73.53 111.333 -177.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.491 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 81.7 t80 -70.22 -45.86 65.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.309 -0.405 . . . . 73.02 110.149 176.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.21 -30.48 71.62 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.095 0.474 . . . . 73.12 110.465 178.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.5 t -71.02 -29.61 65.58 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.721 -0.672 . . . . 73.31 111.226 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 9.7 pt20 -86.66 -9.48 55.9 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.215 0.531 . . . . 71.32 110.01 177.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.895 ' HE2' ' HA ' ' A' ' 73' ' ' LYS . 9.0 mmpt? -81.79 164.03 21.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.653 -0.703 . . . . 74.11 109.945 176.073 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.2 t -100.45 -42.82 6.44 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.239 -0.652 . . . . 71.23 109.239 173.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.482 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 15.1 p -73.16 -58.8 3.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.648 -0.706 . . . . 71.4 110.778 179.018 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.452 ' HA ' HD11 ' A' ' 79' ' ' LEU . 86.9 mtp -65.09 -17.2 64.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.68 -0.691 . . . . 75.13 111.746 -176.564 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.521 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 24.8 ttpp -59.02 -38.32 78.99 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.272 -0.422 . . . . 75.42 110.825 -178.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -106.8 5.05 28.2 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.164 0.507 . . . . 72.01 110.816 -178.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.766 ' HB3' HG22 ' B' ' 133' ' ' ILE . 31.2 mt -81.41 -54.0 5.83 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.819 -0.628 . . . . 72.23 110.301 176.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.53 -5.59 50.61 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.095 -0.502 . . . . 75.34 111.98 -174.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 62.7 pttt -65.93 -9.07 26.29 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.958 0.408 . . . . 75.35 111.19 -178.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -61.02 -37.53 82.89 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.774 -0.648 . . . . 75.13 110.406 176.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.438 ' O ' ' HD3' ' A' ' 85' ' ' PRO . 14.8 p -115.54 -23.18 4.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.801 -0.636 . . . . 75.22 110.453 178.46 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' A' ' 81' ' ' LYS . 58.8 tp -96.42 105.27 21.43 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.975 -0.557 . . . . 75.13 110.315 -179.638 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.438 ' HD3' ' O ' ' A' ' 83' ' ' VAL . 9.1 Cg_exo -71.88 103.86 1.54 Allowed 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 123.178 2.585 . . . . 73.22 111.969 -177.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -100.44 118.22 36.21 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.053 -0.521 . . . . 62.02 111.261 -176.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt 53.41 76.84 0.19 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.792 -1.095 . . . . 71.3 112.425 174.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 . . . . . 0 C--N 1.308 -1.207 0 CA-C-N 114.224 -1.353 . . . . 74.14 110.087 173.828 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.391 0 N-CA-C 111.942 -0.463 . . . . 51.11 111.942 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 17.3 t -67.51 -18.35 23.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.948 0.404 . . . . 64.2 110.902 -177.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -71.28 -17.47 62.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.284 -0.416 . . . . 72.43 110.606 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 73.5 mtp 60.9 21.61 11.81 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.518 0.675 . . . . 72.31 110.546 -177.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -143.25 116.49 8.99 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.345 -0.843 . . . . 73.33 108.903 177.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -82.5 136.13 34.96 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.573 -0.739 . . . . 55.33 111.116 -173.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -85.05 90.71 1.66 Allowed Glycine 0 N--CA 1.44 -1.065 0 N-CA-C 111.053 -0.819 . . . . 75.33 111.053 176.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -68.79 96.96 0.78 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.856 0.36 . . . . 72.12 110.54 -178.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 42.1 t -78.53 104.76 6.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.92 -0.582 . . . . 72.14 109.689 177.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 92.1 mt -54.54 121.39 8.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.918 -0.583 . . . . 73.53 110.93 -177.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 87.7 m -77.36 106.1 8.89 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.779 -0.646 . . . . 75.34 110.602 -179.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 2.9 tt -85.14 126.69 33.83 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.394 -0.821 . . . . 75.51 108.958 178.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.06 125.41 22.55 Favored 'General case' 0 C--N 1.329 -0.288 0 O-C-N 123.304 0.378 . . . . 70.25 110.6 178.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -57.43 -38.07 73.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.082 -0.508 . . . . 73.12 112.056 -172.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -84.96 27.82 0.74 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.417 -0.356 . . . . 73.24 111.114 -177.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 76.8 mt 62.3 27.32 16.34 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.072 0.463 . . . . 71.54 110.946 175.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 13.6 t -88.74 16.86 6.13 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.896 -0.593 . . . . 55.33 110.929 -176.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 15.4 t -134.21 94.16 3.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.244 -0.434 . . . . 74.23 109.853 178.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -161.54 162.69 30.35 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.893 -0.594 . . . . 75.11 110.57 -179.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 94.6 m -157.9 121.53 4.04 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.411 -0.588 . . . . 64.24 109.411 177.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . 0.4 HD12 HG11 ' B' ' 183' ' ' VAL . 6.3 tt -106.81 115.24 29.85 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.601 -0.518 . . . . 73.24 109.601 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 122' ' ' ASP . . . . . 0.565 ' OD1' ' HB2' ' A' ' 24' ' ' SER . 1.3 p30 -136.79 163.71 30.0 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.658 -0.701 . . . . 74.42 110.193 -179.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 12.3 tt -151.62 141.13 15.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 120.907 0.384 . . . . 74.2 111.046 -177.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 124' ' ' SER . . . . . 0.59 ' HA ' ' OD2' ' A' ' 22' ' ' ASP . 4.5 p -112.23 156.01 23.06 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.242 -0.435 . . . . 71.12 110.255 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? -112.41 -25.74 9.06 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.091 0.472 . . . . 75.23 109.862 -179.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 126' ' ' GLN . . . . . 0.49 ' HB2' ' H ' ' A' ' 22' ' ' ASP . 2.8 mp0 -92.47 36.07 1.01 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.59 -0.732 . . . . 74.41 111.405 -178.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 62.1 t-105 -77.9 67.64 3.8 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.686 0.755 . . . . 75.11 109.324 175.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 15.4 p -118.1 -12.39 10.05 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.374 -0.83 . . . . 74.22 111.038 -178.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -68.05 108.41 3.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.268 -0.424 . . . . 73.12 110.757 -177.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 6.1 m -130.81 105.98 11.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.148 -0.478 . . . . 74.3 111.082 178.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 39.0 p90 45.76 28.21 0.54 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.168 0.987 . . . . 74.35 113.27 175.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.464 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 27.3 p-10 -58.55 -48.49 80.7 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.77 0.319 . . . . 74.51 111.431 -174.272 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 133' ' ' ILE . . . . . 0.766 HG22 ' HB3' ' A' ' 79' ' ' LEU . 43.0 mm -64.73 -41.21 91.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.101 0.477 . . . . 73.41 111.156 -177.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.432 HD22 HD21 ' A' ' 49' ' ' LEU . 9.8 mp -65.45 -35.87 82.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.737 -0.665 . . . . 75.44 110.613 179.535 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -69.92 -41.65 74.36 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.79 -0.641 . . . . 73.41 110.264 177.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 136' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 5.8 mm-40 -64.25 -42.2 96.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.964 -0.562 . . . . 75.44 111.456 178.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -94.17 7.43 45.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.328 -0.396 . . . . 73.15 111.672 -175.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 10.4 t70 60.97 43.32 11.69 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.794 -0.639 . . . . 74.21 112.233 172.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -74.05 -10.56 59.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.877 0.37 . . . . 73.22 110.66 172.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 58.09 78.26 0.37 Allowed Pre-proline 0 C--O 1.232 0.182 0 CA-C-N 115.325 -0.852 . . . . 71.12 110.313 -174.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . 0.407 ' HG3' ' HB3' ' B' ' 134' ' ' LEU . 10.9 Cg_endo -86.17 145.71 8.58 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 122.887 2.391 . . . . 55.22 112.418 -178.77 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -109.91 139.46 44.97 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.097 -0.502 . . . . 70.54 110.028 178.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -173.13 30.04 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.82 0.819 . . . . 73.4 109.098 -176.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 80.8 mt -80.73 112.27 17.95 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.252 -0.885 . . . . 72.12 110.536 -176.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 145' ' ' CYS . . . . . 0.618 ' HB3' HG11 ' A' ' 47' ' ' VAL . 17.4 p -158.83 138.95 12.17 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.861 -0.609 . . . . 75.32 110.721 -177.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -124.69 102.59 7.67 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.875 -0.602 . . . . 73.44 109.487 173.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 35.8 m -133.45 161.18 41.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.099 -0.5 . . . . 64.52 110.051 178.321 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -156.19 142.17 18.1 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.908 -0.587 . . . . 73.42 109.553 178.323 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.473 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.8 mp -68.42 75.76 0.26 Allowed 'General case' 0 C--O 1.219 -0.535 0 O-C-N 123.91 0.756 . . . . 72.22 109.558 174.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.494 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -81.98 59.25 4.26 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.202 0.525 . . . . 70.24 110.451 -179.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 151' ' ' PHE . . . . . 0.473 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 44.2 p90 -86.84 162.78 17.58 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.662 -0.699 . . . . 71.32 110.588 -177.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 152' ' ' LYS . . . . . 0.416 ' HD3' ' CD1' ' B' ' 157' ' ' ILE . 21.6 tptt -92.76 113.47 25.75 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.518 -0.765 . . . . 75.21 109.659 -177.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 153' ' ' CYS . . . . . 0.536 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 29.9 t -123.29 96.12 4.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.01 0.433 . . . . 62.43 110.44 -176.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 57.91 55.05 5.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.174 -0.921 . . . . 70.45 111.628 179.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 95.17 -35.85 4.08 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.596 -0.729 . . . . 73.14 113.054 172.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -107.31 141.13 39.13 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.22 0.533 . . . . 74.32 111.277 -175.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . 0.416 ' CD1' ' HD3' ' B' ' 152' ' ' LYS . 43.3 mm -76.01 119.51 24.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.522 -0.763 . . . . 74.41 109.525 174.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 158' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -106.28 97.79 7.55 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.909 -0.316 . . . . 75.44 110.386 -177.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 2.6 p -76.47 124.24 27.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.221 -0.445 . . . . 73.42 111.815 -177.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 86.9 m-85 -125.37 107.32 10.57 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.27 -0.423 . . . . 73.21 111.206 176.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 39.6 m -97.21 -0.67 46.39 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.748 -0.66 . . . . 75.21 109.448 172.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -129.56 131.84 46.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.198 -0.91 . . . . 75.01 109.797 -179.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 51.0 tp -76.49 -35.35 58.44 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.354 -0.385 . . . . 73.13 110.79 -175.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -62.27 -44.64 96.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.936 0.398 . . . . 72.24 110.491 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 165' ' ' SER . . . . . 0.644 ' HA ' ' HE2' ' B' ' 168' ' ' LYS . 32.0 m -61.55 -32.14 72.2 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.976 -0.557 . . . . 72.53 110.932 178.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 49.5 tp -68.09 -40.16 82.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 75.42 110.414 179.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . 0.547 ' HG3' HD23 ' B' ' 184' ' ' LEU . 24.2 ttt180 -57.22 -45.65 83.67 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.047 0.451 . . . . 74.41 110.543 175.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 168' ' ' LYS . . . . . 0.644 ' HE2' ' HA ' ' B' ' 165' ' ' SER . 52.0 mtmt -63.34 -36.46 83.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.519 -0.764 . . . . 73.43 111.195 -179.086 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -71.26 -44.95 64.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.092 -0.504 . . . . 74.5 110.736 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.08 -28.65 69.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.212 -0.449 . . . . 72.51 110.972 -179.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 33.2 t -66.29 -30.92 71.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.96 -0.564 . . . . 64.31 111.29 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -100.53 10.93 40.52 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.098 0.475 . . . . 74.21 110.695 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 173' ' ' LYS . . . . . 0.536 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 30.7 mmmt -108.05 117.88 35.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.939 -0.573 . . . . 75.25 110.738 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 39.8 t -64.27 -37.13 86.38 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.956 -0.565 . . . . 73.03 110.456 -178.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 16.9 p -78.25 -35.75 47.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.748 -0.66 . . . . 75.13 111.778 -177.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 76.9 mtp -90.7 -16.64 28.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.317 -0.401 . . . . 74.23 111.824 -172.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -56.68 -37.73 71.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.495 -0.321 . . . . 72.44 111.558 -177.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -96.73 0.15 49.13 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.305 0.574 . . . . 74.53 110.529 -174.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 179' ' ' LEU . . . . . 0.496 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 59.6 mt -88.72 -51.97 5.38 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.245 -0.889 . . . . 64.34 109.408 176.076 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.0 -19.64 59.99 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.368 -0.833 . . . . 74.22 111.797 -176.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -60.34 -15.08 22.25 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.057 0.391 . . . . 63.22 112.057 -177.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -75.05 -32.54 61.56 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.086 0.47 . . . . 70.04 110.659 -173.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 183' ' ' VAL . . . . . 0.4 HG11 HD12 ' B' ' 121' ' ' LEU . 27.0 m -117.05 -15.39 9.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.811 -0.631 . . . . 71.45 110.997 -179.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 184' ' ' LEU . . . . . 0.547 HD23 ' HG3' ' B' ' 167' ' ' ARG . 42.5 tp -114.56 111.49 46.33 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.024 -0.534 . . . . 71.15 109.969 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -62.44 114.68 2.47 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.959 2.439 . . . . 73.03 112.121 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -109.45 107.2 17.26 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.075 -0.511 . . . . 75.55 110.734 -178.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 187' ' ' LYS . . . . . 0.964 ' HA ' ' HE2' ' B' ' 187' ' ' LYS . 11.1 mmpt? 56.09 83.89 0.09 Allowed 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 122.058 0.933 . . . . 72.31 112.201 178.558 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 . . . . . 0 C--N 1.31 -1.148 0 CA-C-N 114.281 -1.327 . . . . 75.12 109.072 174.603 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.88 0 N-CA-C 112.082 -0.407 . . . . 74.11 112.082 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.6 p -106.42 122.82 60.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.153 0.502 . . . . 73.42 110.774 -178.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 86.4 mt -90.65 -6.93 53.93 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.226 -0.443 . . . . 75.3 111.009 -178.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 90.5 mtp -77.64 95.16 4.52 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.29 -0.414 . . . . 73.14 110.604 -178.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -82.43 137.55 34.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.92 -0.582 . . . . 61.44 110.233 175.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.407 ' HA ' HD12 ' A' ' 10' ' ' LEU . 48.2 mt-10 -89.81 -85.84 0.2 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.563 0.697 . . . . 74.43 111.583 -177.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 75.7 21.21 77.31 Favored Glycine 0 C--N 1.316 -0.582 0 N-CA-C 110.505 -1.038 . . . . 72.53 110.505 -172.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -173.1 177.74 2.65 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.655 -0.868 . . . . 73.1 108.655 -178.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.0 t -84.26 102.19 9.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.578 -0.527 . . . . 72.24 109.578 177.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.407 HD12 ' HA ' ' A' ' 6' ' ' GLU . 91.0 mt -120.9 -178.09 3.65 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.144 -0.48 . . . . 74.54 110.745 -177.445 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.6 t -143.09 160.65 39.99 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.897 -0.592 . . . . 75.12 109.457 -179.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 44.4 tp -97.83 125.47 42.7 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.031 0.444 . . . . 75.44 110.924 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.785 ' HB1' ' HB2' ' A' ' 16' ' ' LEU . . . -83.54 116.34 22.52 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.661 -0.699 . . . . 74.44 110.629 174.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.31 95.39 1.71 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.045 0.45 . . . . 65.12 110.978 179.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 1.01 ' HA ' ' HA ' ' A' ' 19' ' ' ALA . 9.5 m-20 76.07 0.23 3.26 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.916 -1.038 . . . . 63.22 111.658 172.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.785 ' HB2' ' HB1' ' A' ' 13' ' ' ALA . 62.9 mt -83.29 -19.46 36.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.388 0.613 . . . . 70.13 110.557 -178.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 40.8 m -145.53 -62.37 0.34 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.773 -0.825 . . . . 72.33 108.773 175.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 66.3 m -90.17 100.14 13.03 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.143 -0.688 . . . . 74.35 109.143 169.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 1.01 ' HA ' ' HA ' ' A' ' 15' ' ' ASP . . . -77.1 169.77 17.73 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.823 -0.626 . . . . 75.21 110.904 -177.466 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 19.8 m -63.08 98.14 0.13 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.255 0.55 . . . . 75.0 110.536 178.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.586 ' O ' HD22 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -82.37 101.97 10.94 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 122.011 0.91 . . . . 64.4 109.124 176.33 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -146.19 172.67 13.09 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.116 -0.947 . . . . 52.54 109.888 -175.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.715 ' HB ' ' HG3' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -144.02 123.09 7.37 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 CA-C-N 115.689 -0.687 . . . . 73.25 111.994 -166.948 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 m -84.31 34.09 0.51 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.065 -0.97 . . . . 73.05 110.468 -177.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.715 ' HG3' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -81.44 42.96 0.71 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.399 0.619 . . . . 74.12 112.177 -174.657 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -124.09 -168.89 1.86 Allowed 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.853 -0.612 . . . . 71.24 110.508 -175.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 45.0 m95 -68.64 97.39 0.79 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.36 0.6 . . . . 72.32 110.252 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.7 m -88.88 -2.86 58.8 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.785 0.802 . . . . 74.32 109.425 -178.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -70.48 -25.81 63.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.56 -1.2 . . . . 72.21 110.945 -176.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.467 HG21 ' HG ' ' B' ' 163' ' ' LEU . 21.8 t -51.67 -56.07 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 115.754 -0.657 . . . . 71.2 112.02 -174.519 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.447 ' HB2' ' HB2' ' A' ' 41' ' ' PRO . 14.0 p90 -97.13 -7.64 32.1 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.587 -0.278 . . . . 74.35 110.991 -176.105 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.409 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 12.1 t30 -61.58 -53.68 53.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.454 -0.339 . . . . 73.42 111.114 -173.387 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.428 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 3.6 mp -62.77 -39.73 85.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.134 0.493 . . . . 72.4 110.378 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.483 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 88.8 mt -62.49 -34.79 77.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.014 -0.539 . . . . 73.51 110.736 178.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -69.88 -38.67 76.46 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.141 -0.481 . . . . 75.1 110.441 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 34.1 mm-40 -65.93 -31.3 72.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.052 -0.522 . . . . 73.13 111.08 178.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -100.39 4.35 43.82 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.13 -0.486 . . . . 74.44 111.281 -177.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.5 t0 67.69 47.09 1.21 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.617 -0.719 . . . . 74.02 112.054 171.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.483 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 28.7 m-85 -81.21 -7.63 59.6 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.525 -0.307 . . . . 73.0 111.608 173.215 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.93 69.53 1.35 Allowed Pre-proline 0 CA--C 1.538 0.515 0 CA-C-O 121.321 0.581 . . . . 71.14 110.076 -175.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.577 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 87.2 Cg_endo -89.07 175.75 3.38 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 123.017 2.478 . . . . 75.55 112.637 -177.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.702 ' HZ3' ' N ' ' B' ' 101' ' ' GLY . 12.7 mptt -109.7 -178.48 3.55 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.276 -0.42 . . . . 75.1 111.125 -178.03 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -90.39 178.01 6.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.141 -0.482 . . . . 73.12 111.596 -168.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -82.62 151.91 26.13 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.771 -0.649 . . . . 75.44 109.938 178.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 35.9 m -85.94 70.59 10.64 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.007 0.432 . . . . 62.25 110.036 177.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -83.63 63.78 7.59 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.466 0.651 . . . . 72.11 110.8 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.881 HG23 ' HB2' ' B' ' 145' ' ' CYS . 1.2 m -156.86 119.97 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 114.525 -1.216 . . . . 74.52 109.423 174.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.479 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER -139.92 166.94 23.29 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.381 -0.372 . . . . 74.53 111.022 179.919 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.646 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.9 mp -73.67 92.18 1.95 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.904 -0.589 . . . . 72.02 110.889 -177.859 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -94.11 68.18 3.7 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.272 -0.64 . . . . 73.2 109.272 171.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.646 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 44.9 p90 -91.68 165.12 13.47 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.994 -0.548 . . . . 75.41 111.132 -173.288 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.2 tptm -92.24 116.61 29.11 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.568 -0.742 . . . . 65.5 110.338 -176.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.509 ' HB3' ' HG2' ' A' ' 58' ' ' LYS . 47.3 t -120.06 100.49 7.24 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.993 0.425 . . . . 65.31 110.362 178.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 64.41 15.9 9.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.265 -0.88 . . . . 64.22 112.317 174.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.63 -32.26 3.92 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.297 -0.954 . . . . 74.14 112.638 177.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -100.66 153.74 19.17 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 110.117 -0.327 . . . . 75.53 110.117 -179.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 48.1 mm -83.9 116.48 27.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.401 -0.363 . . . . 72.33 110.166 177.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.722 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 31.8 mmmt -101.01 115.9 31.56 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.381 -0.6 . . . . 73.23 109.381 177.006 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.504 ' HA ' ' O ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -97.8 112.06 24.11 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.864 -0.607 . . . . 73.11 111.16 -174.716 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.722 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 23.8 m-85 -121.6 140.72 51.89 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.839 -0.619 . . . . 64.22 111.228 -178.239 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.479 ' HB3' ' HB3' ' A' ' 48' ' ' LYS . 17.1 p -137.08 15.55 3.04 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.811 -0.631 . . . . 74.22 109.75 175.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.459 ' OD2' ' HB3' ' A' ' 64' ' ' GLN . 4.9 t70 -148.1 127.55 13.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.488 -0.778 . . . . 73.32 110.692 -177.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.529 HD13 HG23 ' B' ' 130' ' ' VAL . 56.1 tp -68.25 -29.61 68.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.915 -0.584 . . . . 74.45 111.144 -177.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.459 ' HB3' ' OD2' ' A' ' 62' ' ' ASP . 44.3 tt0 -62.1 -47.92 82.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.26 0.552 . . . . 70.32 109.674 178.339 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 42.6 m -58.03 -45.05 87.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.389 -0.823 . . . . 75.04 111.109 177.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 37.1 tp -68.71 -34.63 75.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.285 -0.416 . . . . 73.41 110.977 -177.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 46.4 ttp180 -61.96 -31.91 72.29 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.143 0.497 . . . . 71.45 110.463 177.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.8 mtmp? -75.71 -42.62 50.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.988 -0.551 . . . . 74.32 110.343 176.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.446 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 63.7 t80 -65.98 -41.98 90.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.652 -0.703 . . . . 74.34 111.011 -176.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.38 -26.89 64.88 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.524 -0.307 . . . . 74.22 111.009 177.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.7 t -75.58 -28.6 59.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.915 0.388 . . . . 74.13 110.522 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.446 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 19.9 pt20 -87.69 -10.53 50.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.383 0.611 . . . . 72.3 109.847 176.059 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.445 ' O ' ' HE3' ' A' ' 77' ' ' LYS . 26.9 mmmt -94.03 163.33 13.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.334 -0.848 . . . . 72.2 109.431 173.016 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.1 t -105.42 -44.86 4.61 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.645 -0.502 . . . . 65.41 109.645 176.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.58 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 17.7 p -65.91 -53.35 40.57 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.969 -0.56 . . . . 70.51 110.891 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 81.3 mtp -64.87 -26.63 68.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.786 -0.643 . . . . 74.12 111.383 -177.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.445 ' HE3' ' O ' ' A' ' 73' ' ' LYS . 37.1 ttmt -61.12 -34.12 74.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.268 0.556 . . . . 74.01 110.47 178.468 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -102.88 8.08 39.25 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.631 0.729 . . . . 72.31 109.799 -176.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 75' ' ' SER . 45.6 mt -94.14 -52.87 4.19 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.063 -0.971 . . . . 75.03 108.912 172.041 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.467 ' HA ' HG13 ' B' ' 133' ' ' ILE . 9.1 mt -80.25 6.67 11.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.427 -0.806 . . . . 75.31 111.306 -173.319 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -54.36 -20.81 8.0 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.628 0.58 . . . . 74.45 112.481 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.558 ' HB3' HD11 ' B' ' 133' ' ' ILE . 27.6 t70 -67.69 -41.99 82.78 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.972 0.415 . . . . 72.4 110.365 175.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 35.6 t -91.33 -42.55 13.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.069 -0.514 . . . . 74.25 110.405 -178.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.1 mp -79.94 122.55 83.37 Favored Pre-proline 0 C--N 1.322 -0.597 0 CA-C-N 116.107 -0.497 . . . . 74.32 110.495 -179.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -59.7 119.51 6.76 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.947 2.431 . . . . 64.43 112.266 -177.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -108.3 148.05 30.59 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 121.405 0.621 . . . . 74.34 110.456 -178.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -102.43 -34.74 9.04 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.225 -0.898 . . . . 75.43 110.049 178.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 115.7 -0.682 . . . . 72.3 110.518 179.152 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . 0.702 ' N ' ' HZ3' ' A' ' 42' ' ' LYS . . . . . . . . 0 N--CA 1.45 -0.41 0 N-CA-C 111.551 -0.62 . . . . 51.21 111.551 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 7.6 p 30.03 82.07 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.738 1.215 . . . . 74.11 113.323 -179.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 95.8 mt -91.76 -21.71 20.56 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 115.458 -0.792 . . . . 72.15 110.138 177.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 85.1 mtp -56.08 112.26 1.16 Allowed 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.556 -0.747 . . . . 73.12 110.131 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -31.23 119.36 0.21 Allowed 'General case' 0 N--CA 1.47 0.543 0 O-C-N 124.946 1.404 . . . . 75.11 112.94 -178.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -75.46 146.71 40.44 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.006 -0.997 . . . . 72.45 111.583 -172.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -159.41 -65.09 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.685 0 N-CA-C 111.332 -0.707 . . . . 74.13 111.332 177.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -141.22 -173.56 3.77 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.397 -0.594 . . . . 73.53 109.397 177.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 94.7 t -68.49 114.96 5.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.244 0.545 . . . . 75.23 110.044 176.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 84.7 mt -120.45 176.33 5.54 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.435 -0.802 . . . . 71.25 109.755 -178.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 4.7 t -81.18 153.27 27.3 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.373 -0.603 . . . . 73.41 109.373 176.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 43.9 tp -137.04 111.75 8.76 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.226 0.536 . . . . 71.34 110.79 177.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 113' ' ' ALA . . . . . 0.596 ' HB3' ' HB2' ' B' ' 116' ' ' LEU . . . -94.54 82.9 4.03 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.594 -0.73 . . . . 75.53 110.113 177.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . 0.656 ' HA ' ' OG ' ' B' ' 118' ' ' SER . . . -71.08 -20.51 62.34 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.245 -0.889 . . . . 65.22 110.558 -178.441 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -97.53 -2.34 42.05 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.347 -0.842 . . . . 62.14 110.636 -177.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.596 ' HB2' ' HB3' ' B' ' 113' ' ' ALA . 98.0 mt -133.63 -66.7 0.63 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.016 0.376 . . . . 72.05 112.016 -174.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 20.6 m -75.16 -47.39 28.7 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.29 0.478 . . . . 73.41 112.29 -171.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 118' ' ' SER . . . . . 0.656 ' OG ' ' HA ' ' B' ' 114' ' ' ALA . 34.6 p -78.89 110.31 13.97 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.828 0.347 . . . . 62.45 110.621 -179.473 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -80.85 147.5 30.37 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.115 -0.493 . . . . 64.02 110.625 -179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 1.6 p -72.44 153.58 41.33 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.04 -0.527 . . . . 73.31 111.436 -179.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . 0.55 HD11 ' N ' ' B' ' 121' ' ' LEU . 0.0 OUTLIER -130.35 6.93 4.91 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.787 0.803 . . . . 75.35 109.293 177.967 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -68.98 147.88 50.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.199 -1.364 . . . . 74.11 111.059 -174.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -148.17 143.62 19.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-N 114.479 -1.237 . . . . 75.11 110.575 -171.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 124' ' ' SER . . . . . 0.602 ' HA ' ' OE2' ' B' ' 146' ' ' GLU . 66.5 m -78.78 85.17 4.8 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.183 0.516 . . . . 73.51 110.704 -179.446 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . 0.488 ' HD2' ' HG3' ' B' ' 126' ' ' GLN . 0.0 OUTLIER -115.64 20.52 14.6 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.686 -0.688 . . . . 74.2 110.996 177.959 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 126' ' ' GLN . . . . . 0.488 ' HG3' ' HD2' ' B' ' 125' ' ' LYS . 22.1 mt-30 -115.4 -163.8 0.91 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.515 -0.766 . . . . 71.21 110.048 -178.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -80.24 65.17 5.31 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.131 0.491 . . . . 72.05 109.857 176.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 128' ' ' SER . . . . . 0.404 ' C ' ' H ' ' B' ' 130' ' ' VAL . 11.7 m -99.95 11.72 38.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.64 -0.709 . . . . 71.05 110.25 -174.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -78.36 23.45 0.29 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.509 -0.769 . . . . 74.23 111.197 -175.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.529 HG23 HD13 ' A' ' 63' ' ' LEU . 21.9 t -84.31 -36.22 11.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.113 -0.494 . . . . 74.15 111.848 -172.271 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 26.0 p90 -88.47 -17.22 30.84 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.219 0.451 . . . . 74.52 112.219 -171.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.458 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 54.7 t30 -55.52 -60.14 3.84 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.142 0.276 . . . . 75.51 111.661 -171.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 133' ' ' ILE . . . . . 0.558 HD11 ' HB3' ' A' ' 82' ' ' ASP . 39.5 mm -59.52 -46.52 92.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.27 0.557 . . . . 75.42 111.482 -176.007 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.412 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 88.0 mt -58.22 -30.71 66.71 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.587 -0.733 . . . . 63.43 111.613 -179.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -77.73 -33.61 52.91 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.751 0.31 . . . . 71.52 110.599 -178.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 136' ' ' GLU . . . . . 0.465 ' OE1' ' HA ' ' B' ' 133' ' ' ILE . 33.5 mt-10 -64.72 -46.56 81.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.406 0.622 . . . . 71.22 110.296 177.609 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 39.3 m-80 -90.83 5.25 49.19 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.363 -0.835 . . . . 75.0 110.796 -175.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 31.5 t70 60.2 65.13 1.12 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.982 -1.008 . . . . 70.2 112.754 173.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 139' ' ' PHE . . . . . 0.412 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 9.7 m-85 -95.92 1.29 52.82 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.667 -0.697 . . . . 65.21 109.938 169.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 60.34 76.5 0.42 Allowed Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.647 -0.706 . . . . 73.13 110.796 -178.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -79.86 157.19 24.15 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.814 2.342 . . . . 75.21 112.087 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 11.8 mptt -93.44 -172.65 2.98 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.925 0.393 . . . . 75.21 111.766 -176.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -70.83 150.53 45.73 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.43 -0.805 . . . . 74.41 111.468 -170.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -109.51 87.0 2.4 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.063 -0.517 . . . . 70.44 110.274 -179.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 145' ' ' CYS . . . . . 0.881 ' HB2' HG23 ' A' ' 47' ' ' VAL . 60.5 m -116.53 82.95 1.88 Allowed 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.17 0.509 . . . . 71.02 109.978 177.471 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . 0.602 ' OE2' ' HA ' ' B' ' 124' ' ' SER . 6.7 pt-20 -83.25 95.01 8.02 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.742 0.782 . . . . 75.44 110.281 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 3.5 t -96.11 163.69 2.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.142 -0.935 . . . . 75.14 109.527 -178.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.68 158.55 38.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.736 -0.211 . . . . 65.02 110.504 178.406 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.563 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.9 mp -73.04 88.2 1.39 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.294 -0.412 . . . . 72.01 110.576 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -91.69 72.06 5.82 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.424 -0.584 . . . . 74.14 109.424 174.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 151' ' ' PHE . . . . . 0.577 ' HB3' ' HA ' ' A' ' 41' ' ' PRO . 50.3 p90 -102.09 166.08 10.8 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.04 -0.527 . . . . 74.32 110.584 -176.102 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.8 tppp? -94.69 124.36 38.68 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.014 -0.539 . . . . 73.23 110.212 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 153' ' ' CYS . . . . . 0.521 ' HB3' ' CG ' ' B' ' 158' ' ' LYS . 32.5 t -138.64 117.09 12.02 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.321 -0.399 . . . . 73.21 110.194 178.158 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 73.2 4.51 4.91 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.235 -0.893 . . . . 63.13 112.087 174.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 119.6 -19.46 9.75 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.439 -0.886 . . . . 55.13 112.822 178.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -114.51 156.1 25.22 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.984 -0.376 . . . . 75.41 109.984 177.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 46.4 mm -78.35 117.55 23.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 110.039 -0.356 . . . . 74.32 110.039 177.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 158' ' ' LYS . . . . . 0.687 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 29.0 mmmt -100.34 103.62 15.03 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.192 -0.67 . . . . 72.34 109.192 178.622 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 159' ' ' THR . . . . . 0.445 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.2 OUTLIER -89.51 113.39 24.77 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.048 -0.523 . . . . 75.53 111.165 -176.228 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 160' ' ' PHE . . . . . 0.687 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 34.3 m-85 -115.17 134.3 55.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.115 0.484 . . . . 75.22 110.989 -179.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 16.6 p -114.38 1.68 14.47 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.692 -0.686 . . . . 74.41 110.616 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 162' ' ' ASP . . . . . 0.563 ' HB2' ' CB ' ' B' ' 165' ' ' SER . 4.1 m-20 -134.65 150.17 50.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.891 -0.595 . . . . 74.01 110.077 -174.475 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . 0.467 ' HG ' HG21 ' A' ' 30' ' ' VAL . 5.6 tt -79.12 -51.03 10.08 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.006 -0.739 . . . . 72.22 109.006 177.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 61.4 tt0 -60.82 -35.78 77.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.515 -0.766 . . . . 74.34 110.771 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 165' ' ' SER . . . . . 0.645 ' HA ' ' HE3' ' B' ' 168' ' ' LYS . 13.4 t -65.02 -36.27 83.85 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.732 -0.667 . . . . 72.55 110.624 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . 0.506 ' HA ' ' CE2' ' B' ' 160' ' ' PHE . 52.4 tp -71.25 -31.8 67.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.797 0.332 . . . . 72.51 110.408 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . 0.416 ' HG3' HD12 ' B' ' 184' ' ' LEU . 56.5 ttp180 -61.54 -36.12 79.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.964 -0.562 . . . . 75.52 110.124 177.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 168' ' ' LYS . . . . . 0.645 ' HE3' ' HA ' ' B' ' 165' ' ' SER . 9.8 mtmp? -59.63 -43.62 93.76 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.903 -0.59 . . . . 74.0 110.558 176.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 169' ' ' PHE . . . . . 0.459 ' O ' ' HG2' ' B' ' 172' ' ' GLN . 40.4 t80 -70.7 -40.76 72.69 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.453 -0.794 . . . . 65.23 110.007 -178.34 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 170' ' ' ALA . . . . . 0.476 ' HB3' HD11 ' B' ' 180' ' ' LEU . . . -61.88 -31.44 71.72 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.995 -0.548 . . . . 73.43 111.179 177.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 9.1 t -78.33 -28.95 47.42 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 121.062 -0.255 . . . . 72.44 111.233 -176.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . 0.459 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 21.0 pt20 -85.82 -5.94 59.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.468 0.651 . . . . 71.24 109.937 177.563 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 10.7 mmmm -118.41 98.09 6.09 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.232 -0.894 . . . . 74.52 110.101 -179.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 16.8 t -51.35 -34.85 35.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.083 0.468 . . . . 74.22 110.454 -179.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 175' ' ' SER . . . . . 0.568 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 3.9 m -62.06 -47.29 85.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.799 -0.637 . . . . 65.44 111.059 178.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 86.3 mtp -82.89 -21.65 34.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.929 -0.578 . . . . 71.11 111.224 -175.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 20.5 ttmm -66.57 -23.73 66.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.678 0.752 . . . . 75.34 109.296 175.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -100.15 4.28 44.36 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.947 -1.024 . . . . 72.34 109.655 -177.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 179' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' B' ' 175' ' ' SER . 57.7 mt -103.16 -49.96 3.61 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.293 -0.867 . . . . 75.03 109.325 175.525 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 180' ' ' LEU . . . . . 0.476 HD11 ' HB3' ' B' ' 170' ' ' ALA . 9.8 mt -86.91 5.74 35.45 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.821 -0.627 . . . . 74.13 110.477 -176.461 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 181' ' ' LYS . . . . . 0.486 ' HB2' ' HG3' ' B' ' 186' ' ' GLN . 63.4 pttt -59.7 -11.84 5.85 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.474 -0.784 . . . . 73.23 111.673 178.317 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -63.54 -35.02 79.09 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.368 0.604 . . . . 73.15 109.683 175.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 23.9 t -102.76 -37.74 5.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.048 -0.978 . . . . 74.22 110.098 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 184' ' ' LEU . . . . . 0.416 HD12 ' HG3' ' B' ' 167' ' ' ARG . 10.7 mp -71.81 134.29 83.8 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.617 -0.72 . . . . 72.43 110.497 -178.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -61.78 123.67 13.08 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.759 2.306 . . . . 73.31 112.486 -177.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 186' ' ' GLN . . . . . 0.486 ' HG3' ' HB2' ' B' ' 181' ' ' LYS . 29.5 mm-40 -123.99 136.78 54.52 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.707 -0.678 . . . . 65.24 109.974 -179.25 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 187' ' ' LYS . . . . . 0.48 ' HB2' ' OE2' ' B' ' 188' ' ' GLU . 67.0 mttm -79.74 -26.75 40.66 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.227 -0.657 . . . . 75.05 109.227 173.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 188' ' ' GLU . . . . . 0.48 ' OE2' ' HB2' ' B' ' 187' ' ' LYS . 1.5 mp0 . . . . . 0 C--O 1.253 1.24 0 CA-C-O 118.263 -0.875 . . . . 74.34 110.144 178.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.649 0 N-CA-C 111.817 -0.513 . . . . 73.44 111.817 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 27.5 m -72.73 -36.63 53.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.724 0.297 . . . . 73.34 111.017 -179.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 32.7 tp -128.9 -41.74 1.44 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.412 -0.358 . . . . 75.2 110.223 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 24.4 ptm 41.48 91.9 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.639 1.176 . . . . 75.2 113.614 177.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -66.32 142.2 57.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.466 -0.788 . . . . 75.34 109.405 176.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -72.46 152.0 42.2 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.193 0.521 . . . . 71.44 111.632 -173.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 166.35 -143.91 8.73 Favored Glycine 0 N--CA 1.439 -1.133 0 N-CA-C 110.835 -0.906 . . . . 74.21 110.835 179.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -95.18 101.23 12.96 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 110.176 -0.305 . . . . 75.01 110.176 178.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 41.3 t -74.62 -46.72 41.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 121.391 0.615 . . . . 72.22 111.141 -178.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -144.69 134.37 23.51 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.367 -0.833 . . . . 74.22 110.42 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 m -106.02 143.77 33.68 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.875 -0.602 . . . . 74.03 110.312 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.516 ' HA ' ' OG ' ' A' ' 17' ' ' SER . 0.5 OUTLIER -99.74 120.42 39.7 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.454 -0.943 . . . . 73.15 108.454 175.692 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.608 ' HB2' ' O ' ' A' ' 16' ' ' LEU . . . -54.79 -69.45 0.13 Allowed 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.502 0.501 . . . . 73.43 112.242 -175.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -152.21 -75.41 0.14 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.064 -0.516 . . . . 71.44 109.851 178.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -90.9 -46.62 8.08 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.192 -1.04 . . . . 72.02 108.192 172.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.608 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 95.8 mt -141.02 158.17 44.31 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.387 -1.279 . . . . 55.14 107.91 173.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.533 ' HA ' ' HB3' ' A' ' 13' ' ' ALA . 39.8 m -81.75 30.54 0.37 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.514 0.673 . . . . 73.15 110.812 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.423 ' H ' ' C ' ' A' ' 16' ' ' LEU . 42.8 t -120.53 107.0 12.33 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.4 -0.818 . . . . 70.22 109.715 -178.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.82 113.11 10.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.296 -0.411 . . . . 72.02 110.444 179.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 18.5 m -80.5 105.81 12.03 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.086 -0.506 . . . . 71.15 110.346 178.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 87.9 mt -99.37 -163.98 1.09 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.93 -0.577 . . . . 55.3 109.811 177.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -59.72 106.47 0.48 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.441 -0.345 . . . . 74.43 110.612 -179.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 13.5 tt -63.88 -38.84 83.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.978 -0.555 . . . . 73.23 110.949 -177.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.9 m -127.66 126.37 41.83 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.43 -0.582 . . . . 73.31 109.43 176.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -96.3 -5.57 39.83 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.962 0.41 . . . . 73.02 110.203 -178.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -107.67 99.24 8.74 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.042 -0.526 . . . . 70.23 110.568 -172.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -123.66 94.67 4.31 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.003 0.43 . . . . 74.1 110.772 178.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.2 m -124.85 10.76 8.33 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.944 -0.571 . . . . 75.42 110.384 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.671 HD21 HG21 ' B' ' 183' ' ' VAL . 17.9 p-10 -77.22 -54.56 6.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.727 -0.669 . . . . 75.12 110.618 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.656 HG22 ' H ' ' A' ' 31' ' ' PHE . 3.7 m 32.57 -98.54 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 N-CA-C 114.214 1.19 . . . . 71.12 114.214 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.656 ' H ' HG22 ' A' ' 30' ' ' VAL . 32.4 p90 -117.49 12.86 14.28 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 111.895 0.332 . . . . 74.3 111.895 -173.038 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.542 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 50.1 t30 -54.62 -54.91 35.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.052 0.453 . . . . 73.34 111.046 -176.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.735 HG22 ' HB3' ' B' ' 179' ' ' LEU . 36.1 mm -58.55 -38.47 70.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.678 -0.692 . . . . 75.12 111.489 -176.324 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.6 mt -62.66 -34.51 77.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.84 -0.618 . . . . 74.14 111.771 -177.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 74.8 ttt180 -81.02 -36.72 30.25 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.492 -0.483 . . . . 73.21 110.366 178.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 8.5 mm-40 -67.04 -31.4 71.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.76 0.314 . . . . 71.23 111.139 -178.486 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -98.33 -1.15 42.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.9 0.381 . . . . 65.11 111.003 178.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 19.5 t70 59.84 74.95 0.42 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.926 0.87 . . . . 73.04 111.749 176.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.466 ' HB3' ' HB2' ' B' ' 151' ' ' PHE . 3.7 m-85 -94.54 -4.21 48.42 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.986 -1.007 . . . . 72.21 109.865 169.002 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 59.39 74.7 0.56 Allowed Pre-proline 0 N--CA 1.463 0.22 0 O-C-N 124.178 0.924 . . . . 74.01 110.252 -174.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -80.32 -165.2 0.32 Allowed 'Trans proline' 0 N--CA 1.458 -0.599 0 C-N-CA 123.277 2.651 . . . . 74.41 112.221 -177.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.928 ' HD3' ' HB3' ' B' ' 150' ' ' ALA . 6.9 tptp -116.24 168.7 9.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.134 -0.485 . . . . 73.13 110.327 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.685 ' HB3' ' HZ ' ' B' ' 143' ' ' PHE . 57.5 m-85 -163.59 71.59 0.25 Allowed 'General case' 0 C--N 1.327 -0.387 0 O-C-N 123.653 0.596 . . . . 74.14 109.969 -170.04 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 45.9 tp -167.74 97.69 0.47 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.194 -0.457 . . . . 75.41 109.919 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.504 ' SG ' ' HA ' ' B' ' 147' ' ' VAL . 84.3 m -155.86 -179.97 8.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.948 -0.569 . . . . 75.24 110.326 -178.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -70.01 89.19 0.6 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.395 0.617 . . . . 75.21 110.376 176.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.899 HG12 ' HA ' ' B' ' 143' ' ' PHE . 48.7 t -90.57 155.21 3.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.548 -0.751 . . . . 71.42 109.779 179.471 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.51 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER -93.38 103.05 15.3 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.398 0.618 . . . . 72.21 109.802 179.349 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.517 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 9.3 mp -67.33 91.15 0.24 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.997 -1.001 . . . . 74.24 111.171 -176.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.843 ' HB3' ' HD3' ' B' ' 142' ' ' LYS . . . -90.38 96.72 10.79 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.911 -0.774 . . . . 73.41 108.911 170.281 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.677 ' HB3' ' HA ' ' B' ' 141' ' ' PRO . 49.5 p90 -129.93 170.01 14.49 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.71 -0.677 . . . . 71.41 110.34 -176.185 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.7 tppp? -85.08 131.22 34.48 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.257 -0.429 . . . . 73.4 110.65 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 39.4 t -146.89 119.31 8.42 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.646 -0.502 . . . . 62.43 109.646 174.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 31.4 t70 71.39 2.74 4.38 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.668 -0.696 . . . . 54.14 112.404 175.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 117.76 -20.06 11.04 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.415 -0.898 . . . . 74.42 112.15 -179.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -107.77 163.83 12.76 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.819 -0.437 . . . . 64.13 109.819 178.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.7 mm -93.03 125.41 45.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.734 -0.469 . . . . 74.34 109.734 177.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.562 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 30.6 mmmt -107.46 141.13 39.36 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.337 -0.392 . . . . 74.42 110.023 -179.295 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -112.63 115.67 28.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.0 0.428 . . . . 74.32 111.169 176.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -120.75 106.28 11.55 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.162 -0.472 . . . . 73.44 110.834 178.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.51 ' HB3' ' HB3' ' A' ' 48' ' ' LYS . 5.4 p -96.96 -2.42 43.67 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.102 -0.499 . . . . 53.31 110.944 178.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -131.14 138.69 49.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.033 -0.53 . . . . 72.3 110.775 179.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.401 HD21 ' HE3' ' B' ' 127' ' ' TRP . 46.4 tp -70.36 -31.03 68.13 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.282 -0.636 . . . . 74.34 109.282 175.59 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -56.94 -47.17 81.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.782 -0.644 . . . . 74.52 110.389 174.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.6 m -63.77 -43.18 97.15 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.928 -0.578 . . . . 74.23 110.952 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.44 HD12 ' HE2' ' A' ' 76' ' ' MET . 33.6 tp -72.94 -32.08 65.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.414 . . . . 72.24 110.862 -177.135 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 55.4 ttp180 -59.29 -44.45 92.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.055 -0.52 . . . . 75.1 110.19 178.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -62.79 -46.82 86.23 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.728 -0.669 . . . . 74.53 110.827 178.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.443 ' CE2' ' HE3' ' A' ' 73' ' ' LYS . 46.5 t80 -63.72 -45.42 90.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.249 -0.887 . . . . 73.05 110.883 -176.388 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.73 -24.98 64.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.134 -0.484 . . . . 73.32 112.018 -176.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.1 m -65.05 -38.11 89.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.813 0.34 . . . . 75.2 111.231 -179.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -92.27 0.11 57.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.09 0.472 . . . . 74.03 111.217 -178.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.484 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 66.4 mmtt -97.5 116.91 30.61 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.909 -0.587 . . . . 75.0 110.247 177.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.2 m -64.61 -35.0 79.59 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.093 0.473 . . . . 75.55 110.561 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 23.3 t -78.78 -34.05 45.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.689 -0.687 . . . . 64.03 110.916 -179.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.484 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 82.4 mtp -92.15 -12.47 32.77 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.652 0.263 . . . . 63.22 111.64 -175.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.574 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 40.4 tttp -52.27 -43.11 64.24 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.04 -0.527 . . . . 61.11 110.972 174.406 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.457 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 28.7 mm-40 -90.88 -2.53 57.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.485 0.66 . . . . 63.1 110.444 -172.037 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.524 ' HB2' HD23 ' A' ' 80' ' ' LEU . 36.1 mt -90.48 -53.7 4.32 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.162 -0.926 . . . . 73.14 109.872 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.524 HD23 ' HB2' ' A' ' 79' ' ' LEU . 3.0 mm? -94.93 3.45 54.95 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.768 -0.651 . . . . 75.22 111.515 -176.15 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.574 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 65.3 pttt -55.98 -16.41 4.81 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.274 0.472 . . . . 70.24 112.274 178.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -58.63 -30.56 67.38 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.935 0.398 . . . . 74.13 111.228 177.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 19.7 m -123.18 10.34 5.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.215 0.531 . . . . 75.35 111.01 178.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.748 HD22 ' HD2' ' A' ' 85' ' ' PRO . 3.1 mt -112.98 129.89 24.07 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.903 -0.59 . . . . 64.43 110.602 -177.476 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.748 ' HD2' HD22 ' A' ' 84' ' ' LEU . 19.8 Cg_endo -59.52 117.8 4.59 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.844 2.363 . . . . 74.35 111.958 177.369 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.47 ' HG3' ' HB2' ' A' ' 81' ' ' LYS . 77.6 mm-40 -117.61 155.77 29.28 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.052 -0.522 . . . . 75.53 109.846 -177.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 55.0 pttt -84.42 -12.06 55.08 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.501 -0.772 . . . . 71.31 109.695 176.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 . . . . . 0 C--O 1.238 0.488 0 CA-C-N 115.167 -0.924 . . . . 75.31 110.77 176.35 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . 0.483 ' O ' ' HG2' ' B' ' 104' ' ' MET . . . . . . . . 0 N--CA 1.45 -0.388 0 N-CA-C 111.872 -0.491 . . . . 71.44 111.872 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 9.9 p -84.48 -11.97 11.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.571 0.7 . . . . 75.2 109.628 176.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 103' ' ' LEU . . . . . 0.496 HD12 ' N ' ' B' ' 104' ' ' MET . 1.2 pp -88.45 -21.4 24.24 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.618 -0.719 . . . . 73.22 111.888 -178.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 104' ' ' MET . . . . . 0.496 ' N ' HD12 ' B' ' 103' ' ' LEU . 22.6 ptm -75.34 96.27 3.36 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.889 0.852 . . . . 75.23 110.876 -175.371 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -70.15 179.49 2.35 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.895 -1.048 . . . . 64.42 109.497 175.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -79.41 136.1 36.87 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.069 0.461 . . . . 54.21 111.036 -175.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -167.8 -170.94 33.21 Favored Glycine 0 N--CA 1.435 -1.419 0 N-CA-C 110.761 -0.936 . . . . 71.15 110.761 178.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -79.76 79.03 6.31 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 121.024 0.44 . . . . 72.34 110.884 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 59.5 t -72.88 -53.24 19.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.586 0.708 . . . . 72.33 109.806 177.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 110' ' ' LEU . . . . . 0.596 ' H ' HD23 ' B' ' 110' ' ' LEU . 2.3 pt? -120.29 124.37 45.43 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 114.796 -1.093 . . . . 75.31 109.655 177.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 19.0 m -122.71 111.28 16.53 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.962 -0.295 . . . . 60.14 110.558 -178.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . 0.49 ' HA ' ' OG ' ' B' ' 117' ' ' SER . 0.1 OUTLIER -99.51 128.55 45.62 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.372 -0.603 . . . . 73.05 109.372 177.448 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 113' ' ' ALA . . . . . 0.673 ' HB3' ' O ' ' B' ' 116' ' ' LEU . . . -87.13 -170.99 3.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.175 -0.466 . . . . 73.11 110.65 -178.749 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -57.75 -76.69 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.338 0.495 . . . . 71.44 112.338 -176.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -68.94 -60.64 2.23 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.828 -0.805 . . . . 74.12 108.828 175.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.673 ' O ' ' HB3' ' B' ' 113' ' ' ALA . 93.6 mt -149.24 160.61 43.23 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 106.756 -1.572 . . . . 72.12 106.756 178.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.49 ' OG ' ' HA ' ' B' ' 112' ' ' LEU . 18.2 m -57.23 -21.97 37.77 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.404 0.621 . . . . 74.42 110.587 179.021 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 33.0 t -114.43 94.22 4.69 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.151 -0.931 . . . . 73.13 109.08 178.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -72.36 146.23 47.21 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.914 -0.585 . . . . 65.5 111.172 -175.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 26.7 m -74.86 101.23 4.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.309 0.576 . . . . 63.32 110.422 179.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 85.8 mt -90.63 -163.34 1.01 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.36 -0.837 . . . . 71.22 110.021 178.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -74.77 73.52 2.06 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.131 -0.322 . . . . 63.4 110.131 176.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 14.8 tt -59.65 -30.75 45.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.919 -0.582 . . . . 71.33 110.872 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 20.2 m -117.78 116.03 26.18 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.889 -0.596 . . . . 72.13 109.828 177.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.08 1.77 39.68 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.262 0.553 . . . . 74.3 109.577 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -99.91 124.4 45.19 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.591 -0.732 . . . . 72.23 111.245 -173.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 127' ' ' TRP . . . . . 0.401 ' HE3' HD21 ' A' ' 63' ' ' LEU . 76.2 m95 -129.03 40.69 3.59 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.146 -0.687 . . . . 75.43 109.146 178.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 4.9 p -81.46 8.31 9.74 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 112.909 0.707 . . . . 74.31 112.909 -171.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -95.34 97.53 9.91 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.679 -0.489 . . . . 65.4 109.679 178.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.496 ' C ' ' H ' ' B' ' 132' ' ' ASN . 18.7 m -105.54 -157.01 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.932 -0.576 . . . . 72.11 110.518 -179.435 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -68.48 11.08 0.19 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.456 -0.338 . . . . 74.22 111.76 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.496 ' H ' ' C ' ' B' ' 130' ' ' VAL . 8.7 t30 -54.92 -48.47 73.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.082 -0.508 . . . . 75.53 110.959 179.258 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 133' ' ' ILE . . . . . 0.499 HG23 ' HB3' ' A' ' 79' ' ' LEU . 43.2 mm -61.99 -42.54 95.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.339 0.59 . . . . 74.31 110.777 -179.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.51 HD11 HD22 ' A' ' 49' ' ' LEU . 98.9 mt -70.29 -26.31 63.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.613 -0.722 . . . . 74.42 111.784 -174.267 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -76.37 -35.18 58.81 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.336 -0.546 . . . . 75.13 109.875 176.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -63.83 -30.24 71.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.838 -0.619 . . . . 72.23 110.723 176.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -102.62 5.74 39.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.045 -0.525 . . . . 63.13 111.263 -179.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 57.41 51.3 10.05 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.708 -0.678 . . . . 73.43 112.317 174.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 139' ' ' PHE . . . . . 0.469 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 7.6 m-85 -82.72 -8.0 59.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.109 -0.496 . . . . 74.44 110.221 172.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 58.42 75.89 0.5 Allowed Pre-proline 0 N--CA 1.464 0.232 0 CA-C-N 115.487 -0.779 . . . . 71.2 110.785 -176.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . 0.677 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 78.1 Cg_endo -80.2 173.61 12.36 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.669 2.246 . . . . 75.25 112.491 -178.39 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 142' ' ' LYS . . . . . 0.843 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 11.5 tptp -99.1 -179.76 4.35 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.091 -0.504 . . . . 70.03 109.795 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 143' ' ' PHE . . . . . 0.899 ' HA ' HG12 ' A' ' 47' ' ' VAL . 44.1 t80 175.92 79.23 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.133 0.492 . . . . 74.42 109.921 -174.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 41.4 tp -165.83 91.88 0.5 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.885 -0.598 . . . . 73.14 110.098 177.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 145' ' ' CYS . . . . . 0.636 ' SG ' ' HA ' ' A' ' 47' ' ' VAL . 92.6 m -145.32 176.16 9.76 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.26 -0.882 . . . . 74.44 109.049 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -80.9 91.64 6.03 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.397 0.618 . . . . 74.44 110.689 178.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 147' ' ' VAL . . . . . 0.504 ' HA ' ' SG ' ' A' ' 45' ' ' CYS . 18.7 t -77.49 161.15 4.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.138 -0.937 . . . . 74.21 110.001 178.78 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . 0.744 ' HB3' ' HB3' ' B' ' 161' ' ' SER . 0.0 OUTLIER -92.74 90.48 7.08 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.911 -0.774 . . . . 74.05 108.911 179.99 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.59 ' O ' ' HA ' ' B' ' 159' ' ' THR . 1.5 mm? -60.72 107.92 0.77 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.316 -0.857 . . . . 73.44 111.298 -171.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.928 ' HB3' ' HD3' ' A' ' 42' ' ' LYS . . . -97.08 87.47 4.22 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.835 -0.802 . . . . 74.41 108.835 171.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 151' ' ' PHE . . . . . 0.507 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 45.4 p90 -119.85 167.05 12.5 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.704 -0.68 . . . . 71.53 110.593 -175.544 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -93.65 122.25 35.91 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.997 -0.547 . . . . 74.32 110.079 177.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 153' ' ' CYS . . . . . 0.429 ' HB2' ' HE1' ' B' ' 151' ' ' PHE . 20.8 t -137.13 121.61 18.31 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.067 -0.515 . . . . 75.32 110.097 177.686 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 20.9 t70 73.54 1.8 4.07 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.874 -0.603 . . . . 61.32 111.545 171.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 116.3 -11.59 16.79 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.782 -0.723 . . . . 72.12 112.495 -179.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 156' ' ' GLU . . . . . 0.824 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 10.4 pt-20 -117.31 145.32 44.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.838 0.351 . . . . 71.32 110.667 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 46.2 mm -77.28 127.03 38.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 109.361 -0.607 . . . . 73.12 109.361 175.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 158' ' ' LYS . . . . . 0.824 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 30.6 mmmt -120.57 126.94 51.59 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.005 -0.543 . . . . 73.21 110.279 -176.379 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 159' ' ' THR . . . . . 0.59 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.9 OUTLIER -103.01 115.42 30.57 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 123.249 0.343 . . . . 72.0 110.169 172.749 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 160' ' ' PHE . . . . . 0.404 ' CE2' ' HB3' ' B' ' 158' ' ' LYS . 59.9 m-85 -115.28 102.84 10.24 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.349 0.595 . . . . 63.14 111.758 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 161' ' ' SER . . . . . 0.744 ' HB3' ' HB3' ' B' ' 148' ' ' LYS . 34.1 p -108.12 12.35 26.83 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.174 -0.921 . . . . 65.43 108.714 168.717 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -132.0 108.12 9.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.766 -1.106 . . . . 72.53 110.243 -179.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 50.9 tp -66.25 -26.33 67.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.656 -0.702 . . . . 73.34 110.66 -178.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.09 -52.1 65.26 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.093 -0.503 . . . . 73.3 110.67 -179.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 30.9 m -72.32 -28.71 63.24 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.645 -0.252 . . . . 73.51 110.743 178.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 60.6 tp -64.98 -39.88 94.14 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.054 -0.351 . . . . 73.03 110.054 178.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . 0.537 ' HG3' ' HG ' ' B' ' 184' ' ' LEU . 29.1 ttp180 -61.73 -36.56 81.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.12 0.486 . . . . 74.53 110.3 177.747 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -66.08 -51.45 57.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.856 -0.611 . . . . 74.21 110.882 175.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -68.56 -46.06 70.45 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.787 -0.642 . . . . 75.33 111.651 -174.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -60.9 -37.43 82.19 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.147 0.425 . . . . 73.22 112.147 -176.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 171' ' ' SER . . . . . 0.456 ' HB3' HD22 ' B' ' 184' ' ' LEU . 22.8 p -73.02 -23.51 60.62 Favored 'General case' 0 C--N 1.323 -0.543 0 N-CA-C 112.054 0.391 . . . . 72.21 112.054 -174.649 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -95.89 -8.71 33.3 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.839 0.352 . . . . 75.21 111.138 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 173' ' ' LYS . . . . . 1.085 ' HE2' ' HA ' ' B' ' 173' ' ' LYS . 7.2 mmpt? -86.61 129.88 34.7 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 110.049 -0.352 . . . . 74.02 110.049 177.188 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 19.2 m -58.31 -43.17 88.01 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.841 0.353 . . . . 75.55 111.541 -176.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 175' ' ' SER . . . . . 0.581 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 47.1 t -77.21 -49.29 15.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.049 0.452 . . . . 74.44 110.143 -179.484 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 176' ' ' MET . . . . . 0.786 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 73.0 mtp -66.11 -23.94 66.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.757 -0.656 . . . . 72.21 111.789 -175.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . 0.642 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 28.5 tttp -59.26 -35.94 74.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 65.53 110.788 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -88.86 -21.38 23.71 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 121.519 0.676 . . . . 72.12 110.314 -176.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 179' ' ' LEU . . . . . 0.735 ' HB3' HG22 ' A' ' 33' ' ' ILE . 35.8 mt -75.88 -46.24 31.24 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.845 -1.07 . . . . 74.5 110.466 -178.093 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 180' ' ' LEU . . . . . 0.814 ' HB3' HD12 ' B' ' 184' ' ' LEU . 3.7 mm? -98.57 -3.35 36.5 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.532 -0.758 . . . . 75.51 112.027 -174.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 181' ' ' LYS . . . . . 0.642 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 64.9 pttt -56.12 -18.24 9.35 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.904 0.705 . . . . 75.44 112.904 -177.459 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -70.04 -38.62 75.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.002 0.43 . . . . 63.45 110.937 179.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 183' ' ' VAL . . . . . 0.671 HG21 HD21 ' A' ' 29' ' ' ASN . 18.7 m -108.63 -9.01 11.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.996 -0.547 . . . . 75.14 111.605 -175.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 184' ' ' LEU . . . . . 0.814 HD12 ' HB3' ' B' ' 180' ' ' LEU . 8.6 mp -94.64 139.69 22.36 Favored Pre-proline 0 C--N 1.325 -0.488 0 N-CA-C 110.221 -0.289 . . . . 73.33 110.221 177.208 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.55 116.42 3.28 Favored 'Trans proline' 0 CA--C 1.529 0.238 0 C-N-CA 122.985 2.457 . . . . 64.25 112.87 -178.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -117.34 -171.72 2.09 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.427 -0.583 . . . . 74.33 109.427 177.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -121.56 -0.27 9.77 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.466 0.651 . . . . 70.4 110.257 179.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 18.3 mp0 . . . . . 0 C--O 1.25 1.126 0 CA-C-N 115.055 -0.975 . . . . 74.51 110.642 178.985 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.749 0 N-CA-C 112.234 -0.346 . . . . 73.31 112.234 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 29.3 m -87.45 156.34 3.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.586 0.193 . . . . 73.12 110.925 -178.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.489 HD12 ' O ' ' A' ' 3' ' ' LEU . 2.1 tm? -164.02 -27.88 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.141 0.496 . . . . 72.33 110.327 -176.678 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 67.3 mtt -88.99 0.87 56.29 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.221 -0.445 . . . . 74.5 111.243 -177.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -83.97 160.27 21.07 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.209 -0.45 . . . . 73.41 110.176 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -114.57 -174.1 2.42 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.063 -0.517 . . . . 75.24 111.127 -172.019 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.95 -117.99 2.06 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 121.084 -0.579 . . . . 74.22 112.171 178.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -147.99 133.42 18.61 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.728 -0.277 . . . . 75.31 111.009 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 42.0 t -123.64 143.03 38.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.731 -0.47 . . . . 74.54 109.731 178.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 86.7 mt -77.16 115.11 16.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.695 0.283 . . . . 75.02 110.742 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.7 m -79.45 110.44 14.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.996 0.427 . . . . 75.31 110.71 178.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -117.24 121.59 41.61 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.465 -0.568 . . . . 54.35 109.465 178.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.463 ' HB2' ' CA ' ' A' ' 17' ' ' SER . . . -77.5 127.61 32.8 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.853 -0.612 . . . . 55.45 110.898 -178.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.77 -56.55 3.77 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.308 -0.406 . . . . 72.2 110.823 -178.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -79.24 -50.12 11.44 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.159 -0.473 . . . . 65.01 110.904 -177.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 76.1 mt -75.79 -40.36 55.3 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.496 -0.774 . . . . 62.24 111.516 -175.339 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.463 ' CA ' ' HB2' ' A' ' 13' ' ' ALA . 33.5 m 50.32 57.92 6.07 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.366 0.603 . . . . 71.43 110.581 -172.115 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.514 ' HB2' ' HB2' ' B' ' 118' ' ' SER . 13.5 m -75.97 -1.4 25.48 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.508 -0.769 . . . . 62.21 112.243 -173.73 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.73 87.5 4.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.03 0.443 . . . . 74.32 110.097 178.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 14.3 t -103.87 -163.66 1.0 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.675 -0.693 . . . . 72.13 110.533 -176.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -78.28 98.21 5.83 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.661 0.615 . . . . 75.15 112.661 -173.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.405 ' O ' ' HB3' ' B' ' 122' ' ' ASP . 17.1 t70 -159.51 121.66 3.41 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-N 115.094 -0.957 . . . . 75.4 108.53 170.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.413 HG21 ' H ' ' B' ' 124' ' ' SER . 6.5 pt -112.58 143.18 22.81 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.136 0 CA-C-N 114.584 -1.189 . . . . 75.01 113.811 -160.721 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.2 m -98.85 136.89 38.21 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.913 -1.04 . . . . 71.21 109.325 171.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.534 ' HD3' ' N ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -143.09 22.44 1.9 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.136 0.493 . . . . 74.15 111.214 -171.552 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.2 mp0 -80.24 92.93 5.79 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.933 -0.576 . . . . 74.24 110.627 -177.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -131.25 92.49 3.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.096 -0.502 . . . . 73.31 110.138 179.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.2 t -115.61 -29.77 6.37 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.621 -0.718 . . . . 65.34 110.241 -179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.449 ' OD1' ' HB3' ' A' ' 32' ' ' ASN . 36.4 t-20 -89.51 85.36 6.5 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.76 -0.654 . . . . 74.33 110.837 -176.186 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.8 m -119.99 126.59 75.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.431 -0.804 . . . . 71.13 109.575 174.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 35.3 p90 49.39 14.57 0.1 Allowed 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.395 1.078 . . . . 74.12 113.095 -177.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.449 ' HB3' ' OD1' ' A' ' 29' ' ' ASN . 34.4 t30 -65.11 -46.11 82.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.013 0.435 . . . . 74.21 110.437 -179.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.407 HG22 ' O ' ' B' ' 179' ' ' LEU . 40.6 mm -58.97 -34.35 52.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.718 -0.674 . . . . 74.13 110.769 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.47 ' CD1' HD22 ' B' ' 149' ' ' LEU . 80.2 mt -72.14 -28.41 63.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.795 -0.639 . . . . 74.13 110.524 -178.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.99 -44.3 63.7 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.497 -0.557 . . . . 74.25 109.497 174.381 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -60.32 -45.95 91.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.558 -0.746 . . . . 74.33 111.355 -179.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -85.36 0.54 51.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.445 -0.343 . . . . 75.41 111.16 -178.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 21.4 t70 58.1 69.09 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.475 -0.784 . . . . 75.24 111.609 178.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.6 m-30 -101.63 -2.21 30.93 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.906 -0.588 . . . . 72.22 110.861 174.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.623 ' HG3' ' HE2' ' A' ' 42' ' ' LYS . 7.5 tp10 62.59 80.87 0.24 Allowed Pre-proline 0 N--CA 1.466 0.35 0 O-C-N 123.68 0.613 . . . . 75.15 110.624 -174.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -88.92 138.0 3.4 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.048 2.499 . . . . 72.42 113.352 -176.398 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.684 ' O ' ' HA ' ' B' ' 149' ' ' LEU . 5.6 mptp? -117.82 136.87 53.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 73.13 109.758 177.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.654 ' HA ' HG12 ' B' ' 147' ' ' VAL . 12.1 t80 171.16 35.16 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.454 0.645 . . . . 61.0 109.385 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.8 mp -72.46 99.94 2.59 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.608 -0.724 . . . . 75.51 109.966 -178.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 1.5 p -97.35 85.14 3.59 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.427 -0.806 . . . . 62.1 110.653 -175.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.484 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.9 OUTLIER -89.52 -2.47 58.37 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.383 -0.826 . . . . 74.25 109.281 179.265 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.523 ' HB ' ' HA ' ' B' ' 143' ' ' PHE . 28.2 m -67.11 123.47 20.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.472 0.653 . . . . 60.52 110.645 177.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.484 ' HG3' ' O ' ' A' ' 46' ' ' GLU . 0.2 OUTLIER -147.72 154.56 40.71 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.533 -0.758 . . . . 73.21 110.028 -178.195 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.56 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.9 mp -71.52 82.41 0.81 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.001 0.429 . . . . 74.32 110.765 -178.55 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.09 58.19 4.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.792 -0.64 . . . . 75.14 109.343 173.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.56 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 52.3 p90 -89.24 169.42 11.46 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.674 -0.694 . . . . 72.41 110.723 -175.132 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.541 ' HE3' HD13 ' A' ' 57' ' ' ILE . 3.8 tppp? -100.95 124.27 46.4 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.86 -0.609 . . . . 72.44 111.035 -177.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.453 ' HB3' ' CG ' ' A' ' 58' ' ' LYS . 45.2 t -143.04 132.12 23.05 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.947 -0.57 . . . . 64.32 109.535 175.676 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 65.15 11.71 7.4 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.043 -0.526 . . . . 73.42 112.399 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 102.32 -6.35 53.13 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.74 -0.743 . . . . 61.13 112.734 177.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -123.72 159.05 30.25 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.841 0.353 . . . . 72.32 110.293 177.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.541 HD13 ' HE3' ' A' ' 52' ' ' LYS . 41.3 mm -78.43 123.97 36.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 109.787 -0.449 . . . . 75.14 109.787 176.406 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.453 ' CG ' ' HB3' ' A' ' 53' ' ' CYS . 27.7 mmmt -104.48 85.26 2.31 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.429 -0.582 . . . . 75.32 109.429 178.605 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.418 ' CG2' ' HD3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -74.07 112.08 9.86 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.021 -0.536 . . . . 73.51 111.525 -174.744 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -123.45 116.01 22.53 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.901 0.381 . . . . 74.42 110.992 178.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.5 m -91.1 -12.66 34.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.431 0.634 . . . . 63.44 109.451 172.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.45 ' OD2' ' HB3' ' A' ' 64' ' ' GLN . 33.4 t70 -115.6 118.87 34.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.34 -0.845 . . . . 72.42 109.923 -179.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -74.11 -25.61 59.88 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.018 0.437 . . . . 73.45 110.511 -176.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.455 ' O ' ' HB3' ' A' ' 67' ' ' ARG . 28.5 tt0 -63.23 -39.72 95.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.962 -0.563 . . . . 72.53 109.963 176.267 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.7 m -70.98 -29.05 64.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.641 -0.709 . . . . 75.11 110.77 177.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 69.4 tp -64.74 -38.75 92.06 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.768 -0.456 . . . . 74.02 109.768 175.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.455 ' HB3' ' O ' ' A' ' 64' ' ' GLN . 16.5 ttt-85 -56.34 -40.95 75.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.706 -0.679 . . . . 74.0 110.647 174.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 60.4 mmtt -60.94 -48.83 79.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.164 -0.471 . . . . 75.31 110.913 177.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.491 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 63.3 t80 -67.23 -46.65 73.18 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.673 -0.694 . . . . 75.34 111.194 -177.489 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.5 -29.76 70.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.338 -0.392 . . . . 73.53 111.818 -177.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.4 m -69.21 -25.82 64.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.518 -0.31 . . . . 74.11 111.608 -178.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 11.6 pt20 -99.37 -0.68 40.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.141 0.496 . . . . 74.24 110.524 -179.335 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.753 ' HE2' ' HA ' ' A' ' 73' ' ' LYS . 9.1 mmpt? -95.96 120.02 35.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.776 -0.647 . . . . 72.24 109.984 177.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.6 m -57.0 -42.96 81.25 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.933 0.396 . . . . 62.01 110.813 179.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.464 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 4.7 m -78.35 -42.61 30.03 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.034 -0.53 . . . . 74.41 111.212 -176.374 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.713 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 86.9 mtp -74.28 -19.9 60.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.401 -0.363 . . . . 75.12 111.339 -175.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.43 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 1.8 tmtm? -56.23 -41.91 76.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.181 -0.463 . . . . 74.05 110.024 177.329 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.44 ' CD ' ' HZ1' ' A' ' 81' ' ' LYS . 12.8 mm-40 -85.13 -20.72 29.86 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.621 0.724 . . . . 61.44 110.041 -174.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.691 ' HB3' HG22 ' B' ' 133' ' ' ILE . 83.6 mt -75.3 -53.04 9.44 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.734 -1.121 . . . . 73.03 110.235 179.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.489 ' HB3' HD13 ' A' ' 84' ' ' LEU . 4.1 mm? -82.62 -16.07 49.74 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.564 -0.744 . . . . 74.55 112.516 -173.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.44 ' HZ1' ' CD ' ' A' ' 78' ' ' GLU . 63.7 pttt -62.79 -14.69 48.31 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 120.755 0.312 . . . . 73.24 111.636 -178.102 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -68.51 -42.94 77.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.128 0.49 . . . . 65.42 110.37 179.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.499 HG11 ' HG ' ' A' ' 84' ' ' LEU . 7.7 p -99.09 -37.1 5.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.94 -0.573 . . . . 74.01 111.102 -178.492 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.499 ' HG ' HG11 ' A' ' 83' ' ' VAL . 90.7 mt -92.52 118.81 68.18 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.473 -0.33 . . . . 75.42 110.946 -177.059 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -62.86 127.62 20.96 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.974 2.449 . . . . 75.11 112.314 179.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.496 ' HB3' ' OE1' ' A' ' 88' ' ' GLU . 85.3 mm-40 -100.51 -169.84 1.78 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.663 -0.699 . . . . 75.25 110.02 -178.42 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -118.16 -31.6 4.96 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.248 0.547 . . . . 70.14 110.639 -177.268 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.496 ' OE1' ' HB3' ' A' ' 86' ' ' GLN . 1.4 pm0 . . . . . 0 C--N 1.321 -0.647 0 CA-C-N 115.487 -0.779 . . . . 74.24 110.855 -178.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.544 0 N-CA-C 112.218 -0.353 . . . . 75.5 112.218 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 15.6 m -90.35 113.04 25.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.137 0.494 . . . . 71.22 110.901 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -102.52 -13.18 17.31 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.059 -0.518 . . . . 65.25 110.598 178.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 65.5 mtt -90.68 24.53 2.65 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.044 -0.526 . . . . 74.11 111.069 -176.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -89.44 166.47 13.68 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.607 -0.516 . . . . 72.55 109.607 177.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -135.66 179.5 6.3 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.817 0.341 . . . . 61.41 110.953 -177.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -99.05 -144.97 17.72 Favored Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.969 -0.634 . . . . 72.0 111.796 -179.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -125.07 108.48 11.86 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.749 0.309 . . . . 63.51 110.663 -178.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 48.0 t -86.71 94.78 4.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.244 -0.434 . . . . 74.43 110.006 178.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 88.7 mt -60.81 107.96 0.78 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.999 -0.546 . . . . 75.44 110.214 179.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 95.4 m -109.61 125.49 52.62 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.97 -0.559 . . . . 65.45 111.144 -176.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . 0.462 HD13 ' N ' ' B' ' 113' ' ' ALA . 0.5 OUTLIER -73.9 132.83 42.89 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.246 -1.02 . . . . 71.13 108.246 175.074 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 113' ' ' ALA . . . . . 0.6 ' HB2' ' N ' ' B' ' 117' ' ' SER . . . -45.25 126.18 6.07 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 123.888 0.742 . . . . 71.24 112.686 -175.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . 0.454 ' O ' ' HB2' ' B' ' 115' ' ' ASP . . . -70.17 97.01 1.14 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.125 -0.488 . . . . 73.13 110.29 176.51 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 115' ' ' ASP . . . . . 0.454 ' HB2' ' O ' ' B' ' 114' ' ' ALA . 23.9 m-20 82.91 -36.92 0.08 Allowed 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 114.558 -1.201 . . . . 74.45 111.564 173.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.541 ' HB2' ' HB1' ' B' ' 113' ' ' ALA . 58.2 mt -61.02 -43.74 98.43 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.716 -0.475 . . . . 74.42 109.716 176.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.6 ' N ' ' HB2' ' B' ' 113' ' ' ALA . 14.4 t 56.34 24.89 8.81 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.42 -0.809 . . . . 63.35 112.174 172.608 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 118' ' ' SER . . . . . 0.514 ' HB2' ' HB2' ' A' ' 18' ' ' SER . 4.2 m -83.53 25.09 0.79 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.331 -0.395 . . . . 74.14 111.518 -176.437 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.459 ' O ' ' HB ' ' B' ' 120' ' ' THR . . . -112.18 107.93 17.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.539 -0.3 . . . . 72.12 110.926 -177.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 120' ' ' THR . . . . . 0.459 ' HB ' ' O ' ' B' ' 119' ' ' ALA . 10.9 t 170.81 -23.84 0.0 OUTLIER 'General case' 0 N--CA 1.461 0.119 0 O-C-N 123.835 0.709 . . . . 75.33 110.126 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.69 79.17 6.09 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.469 -0.787 . . . . 73.15 109.826 -177.37 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 122' ' ' ASP . . . . . 0.405 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 18.3 t70 -159.45 149.5 18.87 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.771 -0.649 . . . . 73.01 109.529 177.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 10.9 tt -138.79 79.39 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.932 0.872 . . . . 75.54 110.332 176.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 124' ' ' SER . . . . . 0.413 ' H ' HG21 ' A' ' 23' ' ' ILE . 48.8 m -85.48 116.26 23.68 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.492 -0.777 . . . . 72.11 110.284 177.156 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . 0.415 ' HD3' ' H ' ' B' ' 125' ' ' LYS . 0.0 OUTLIER -119.52 30.06 7.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.536 0.684 . . . . 74.14 110.429 -177.613 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 26.6 mp0 -82.34 30.72 0.4 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.468 -0.787 . . . . 73.33 111.492 -177.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 53.0 m95 -100.68 86.77 3.18 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.348 -0.612 . . . . 73.5 109.348 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 31.7 t -100.25 -18.37 16.88 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.771 -0.65 . . . . 74.33 110.579 -173.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . 0.447 ' HB3' HG21 ' A' ' 83' ' ' VAL . 29.3 t-20 -88.47 101.39 13.87 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.935 -0.575 . . . . 75.31 110.32 -177.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.541 HG22 ' HD1' ' B' ' 131' ' ' PHE . 10.4 m -128.47 -46.25 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.464 -0.334 . . . . 74.4 111.822 -178.699 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 131' ' ' PHE . . . . . 0.541 ' HD1' HG22 ' B' ' 130' ' ' VAL . 52.3 p90 -120.31 0.24 10.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.793 0.33 . . . . 72.31 110.533 179.259 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.438 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 7.3 t30 -55.41 -55.08 35.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.761 -0.654 . . . . 73.3 111.226 -179.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 133' ' ' ILE . . . . . 0.691 HG22 ' HB3' ' A' ' 79' ' ' LEU . 49.0 mm -54.75 -46.89 74.42 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.155 -0.475 . . . . 74.42 111.201 -178.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.529 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 84.7 mt -62.82 -37.22 85.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.71 -0.677 . . . . 73.43 111.021 -177.503 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . 0.417 HH11 ' HG2' ' B' ' 136' ' ' GLU . 0.1 OUTLIER -65.61 -41.6 92.55 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.673 0.273 . . . . 75.33 110.53 177.944 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 136' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' B' ' 132' ' ' ASN . 16.6 mt-10 -69.75 -28.13 65.53 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.399 -0.364 . . . . 71.14 111.2 -176.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -101.48 8.13 42.17 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.157 0.503 . . . . 73.32 110.439 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 60.27 45.93 10.82 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.11 -0.95 . . . . 65.53 112.395 173.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 139' ' ' PHE . . . . . 0.529 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 8.1 m-85 -79.83 -8.92 59.56 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.12 -0.491 . . . . 74.25 109.926 172.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 140' ' ' GLU . . . . . 0.426 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 10.5 tp10 63.21 70.69 0.71 Allowed Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 115.306 -0.861 . . . . 74.1 110.679 179.386 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -87.93 151.11 7.15 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.792 2.328 . . . . 75.31 112.348 -179.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 142' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' B' ' 143' ' ' PHE . 4.2 mptp? -116.9 131.52 56.93 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.562 -0.533 . . . . 72.33 109.562 179.354 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 143' ' ' PHE . . . . . 0.523 ' HA ' ' HB ' ' A' ' 47' ' ' VAL . 27.8 t80 177.59 60.85 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.351 0.596 . . . . 74.24 109.481 179.298 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 32.1 tp -78.42 93.35 4.71 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.367 -0.605 . . . . 73.21 109.367 176.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 11.8 p -80.96 72.28 7.96 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.889 -0.596 . . . . 72.31 112.046 -173.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -128.59 90.01 2.99 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.922 -0.581 . . . . 74.23 110.304 172.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 147' ' ' VAL . . . . . 0.654 HG12 ' HA ' ' A' ' 43' ' ' PHE . 3.2 t -131.73 154.73 40.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 108.032 -1.099 . . . . 74.42 108.032 173.667 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.8 132.25 26.89 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 120.636 -0.425 . . . . 74.42 110.041 179.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.684 ' HA ' ' O ' ' A' ' 42' ' ' LYS . 61.7 tp -71.81 79.32 0.87 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.672 -0.694 . . . . 65.2 109.488 176.682 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.576 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -83.81 74.93 10.14 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.941 -0.572 . . . . 73.41 110.997 -177.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 151' ' ' PHE . . . . . 0.584 ' CD1' ' HG ' ' B' ' 149' ' ' LEU . 15.0 p90 -107.09 161.63 14.58 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.986 -0.552 . . . . 73.23 110.229 179.131 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 152' ' ' LYS . . . . . 0.406 ' HE3' ' CD1' ' B' ' 157' ' ' ILE . 4.8 tppp? -90.94 117.36 29.48 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.413 -0.812 . . . . 73.23 110.325 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 153' ' ' CYS . . . . . 0.55 ' HB2' ' CE2' ' B' ' 151' ' ' PHE . 42.6 t -135.83 122.65 21.15 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.657 -0.701 . . . . 71.55 110.035 179.013 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.7 t70 73.64 4.27 4.7 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.757 -0.656 . . . . 72.01 111.182 172.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 109.12 -4.02 31.63 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.826 -0.702 . . . . 74.34 112.351 179.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -125.45 155.82 39.86 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 110.017 -0.364 . . . . 73.14 110.017 176.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . 0.406 ' CD1' ' HE3' ' B' ' 152' ' ' LYS . 44.5 mm -84.76 115.52 26.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 109.358 -0.608 . . . . 75.34 109.358 177.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 158' ' ' LYS . . . . . 0.483 ' HE2' ' CE1' ' B' ' 169' ' ' PHE . 31.9 mmmt -100.24 94.63 6.31 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.555 0.217 . . . . 74.13 111.025 -175.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 1.2 p -78.09 111.88 14.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.007 0.432 . . . . 72.03 111.941 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 160' ' ' PHE . . . . . 0.42 ' CD2' HD12 ' B' ' 166' ' ' LEU . 64.1 m-85 -121.16 126.66 50.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.899 -0.591 . . . . 72.12 110.623 175.3 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 54.1 m -99.92 9.86 42.26 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.025 0.44 . . . . 73.52 110.453 174.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -143.51 138.75 29.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.93 -0.577 . . . . 71.4 110.943 -175.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . 0.471 ' O ' HD11 ' B' ' 163' ' ' LEU . 2.0 tm? -81.35 -33.41 32.44 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.781 -0.452 . . . . 74.01 109.781 -176.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 164' ' ' GLN . . . . . 0.436 ' O ' ' HB3' ' B' ' 167' ' ' ARG . 22.1 tt0 -57.97 -47.33 83.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.823 -0.626 . . . . 75.15 110.838 179.516 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 165' ' ' SER . . . . . 0.475 ' O ' ' HB2' ' B' ' 168' ' ' LYS . 18.5 m -70.02 -31.73 69.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.933 -0.576 . . . . 74.42 111.193 179.426 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . 0.42 HD12 ' CD2' ' B' ' 160' ' ' PHE . 54.9 tp -67.53 -33.64 75.47 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.709 -0.478 . . . . 73.32 109.709 175.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . 0.436 ' HB3' ' O ' ' B' ' 164' ' ' GLN . 50.5 ttp180 -59.87 -36.76 77.58 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.693 -0.685 . . . . 75.53 109.879 173.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 168' ' ' LYS . . . . . 0.475 ' HB2' ' O ' ' B' ' 165' ' ' SER . 67.2 mmtt -63.76 -51.69 63.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.761 -0.654 . . . . 75.02 110.522 176.287 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 169' ' ' PHE . . . . . 0.483 ' CE1' ' HE2' ' B' ' 158' ' ' LYS . 41.0 t80 -59.47 -41.6 90.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.797 -0.638 . . . . 74.32 110.509 -178.14 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 170' ' ' ALA . . . . . 0.506 ' HB3' HD11 ' B' ' 180' ' ' LEU . . . -62.79 -42.56 99.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.214 -0.448 . . . . 74.11 111.591 178.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 49.3 m -67.22 -28.81 68.38 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.492 -0.322 . . . . 73.34 111.598 -176.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -95.51 9.57 39.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.091 0.472 . . . . 75.03 110.731 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 55.6 mmtt -118.21 156.68 28.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.84 -0.618 . . . . 74.23 110.757 179.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.2 p -87.13 -56.18 3.49 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.17 0.509 . . . . 72.03 109.681 172.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 175' ' ' SER . . . . . 0.525 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 3.4 m -55.95 -53.74 53.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.449 -0.796 . . . . 73.02 111.427 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 19.0 mtp -74.7 -20.04 60.01 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.041 -0.527 . . . . 73.55 112.163 -172.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -64.36 -36.38 83.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.09 0.472 . . . . 74.23 110.671 178.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -94.21 -11.52 30.15 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 115.792 -0.64 . . . . 73.43 109.905 -173.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 179' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' B' ' 175' ' ' SER . 62.8 mt -76.03 -51.4 12.4 Favored 'General case' 0 N--CA 1.437 -1.101 0 N-CA-C 108.971 -0.752 . . . . 74.21 108.971 174.575 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 180' ' ' LEU . . . . . 0.506 HD11 ' HB3' ' B' ' 170' ' ' ALA . 8.5 mt -92.42 -1.48 56.98 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.524 -0.762 . . . . 71.42 111.574 -171.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -60.18 -13.22 11.15 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.769 0.319 . . . . 70.55 111.729 178.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -70.21 -29.44 66.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.991 0.424 . . . . 53.4 110.782 178.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 28.5 m -114.66 -19.9 6.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.185 -0.461 . . . . 73.1 111.355 179.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 184' ' ' LEU . . . . . . . . . . . . . 83.5 mt -98.06 118.01 64.27 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 109.877 -0.416 . . . . 74.1 109.877 178.398 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -62.29 109.92 0.94 Allowed 'Trans proline' 0 N--CA 1.464 -0.263 0 C-N-CA 122.899 2.399 . . . . 74.32 112.699 -176.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -84.42 121.5 27.64 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.904 -0.589 . . . . 74.14 109.658 176.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 24.8 mtmt -59.76 -59.13 5.93 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.66 -0.7 . . . . 71.54 109.536 177.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 . . . . . 0 C--O 1.251 1.163 0 CA-C-N 114.812 -1.086 . . . . 74.43 110.18 -175.405 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.454 ' CD2' HD11 ' B' ' 149' ' ' LEU . 41.3 p90 . . . . . 0 N--CA 1.477 0.916 0 N-CA-C 113.518 0.933 . . . . 70.32 113.518 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.505 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 54.0 t30 -59.53 -51.94 67.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.924 0.392 . . . . 73.24 111.334 -175.485 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.524 ' H ' HD12 ' A' ' 33' ' ' ILE . 3.4 mp -61.1 -39.51 82.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.822 -0.627 . . . . 63.23 111.25 -175.036 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.3 mt -62.19 -35.44 78.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.808 0.337 . . . . 74.14 110.964 179.352 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 47.8 ttt180 -69.46 -44.01 72.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.219 -0.446 . . . . 65.34 110.454 177.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.505 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 36.9 mt-10 -66.02 -26.19 67.42 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.136 -0.484 . . . . 64.23 111.263 -178.438 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -100.01 1.06 42.14 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.275 -0.421 . . . . 71.25 111.079 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 62.29 45.61 6.61 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 113.044 0.757 . . . . 72.13 113.044 173.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.458 ' HB3' ' HB2' ' B' ' 151' ' ' PHE . 13.5 m-85 -78.16 -8.01 57.77 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.287 -0.635 . . . . 74.14 109.287 169.434 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 54.24 79.4 0.34 Allowed Pre-proline 0 C--O 1.233 0.211 0 CA-C-N 114.706 -1.134 . . . . 73.32 111.286 -173.116 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.479 ' HB3' HD12 ' B' ' 149' ' ' LEU . 7.7 Cg_exo -72.45 165.72 31.86 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.48 2.12 . . . . 74.44 110.771 175.082 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.933 ' HD2' ' HB3' ' B' ' 150' ' ' ALA . 0.1 OUTLIER . . . . . 0 C--N 1.32 -0.716 0 C-N-CA 120.313 -0.555 . . . . 75.43 110.315 -179.511 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.613 ' HA ' ' HA ' ' A' ' 61' ' ' SER . 0.3 OUTLIER . . . . . 0 CA--C 1.507 -0.693 0 N-CA-C 108.884 -0.784 . . . . 73.23 108.884 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.555 ' HB3' ' CD1' ' A' ' 51' ' ' PHE . 8.5 mp -74.2 88.9 1.99 Allowed 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 109.705 -0.479 . . . . 70.13 109.705 172.327 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.936 ' HB3' ' HD2' ' B' ' 142' ' ' LYS . . . -90.62 86.66 6.45 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.709 -0.678 . . . . 71.14 109.337 173.632 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.555 ' CD1' ' HB3' ' A' ' 49' ' ' LEU . 44.9 p90 -124.03 167.23 14.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.343 -0.844 . . . . 71.32 110.741 -173.583 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.7 tppt? -90.85 112.36 24.16 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.934 -0.575 . . . . 73.25 110.448 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.533 ' HB2' ' CE2' ' A' ' 51' ' ' PHE . 46.1 t -124.76 113.71 18.31 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.032 -0.531 . . . . 73.21 110.162 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 t70 64.7 24.49 12.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.736 -0.666 . . . . 74.2 111.487 173.641 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 105.94 -19.3 38.45 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.239 -0.982 . . . . 72.13 113.381 177.075 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.461 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 10.3 pt-20 -115.68 147.48 40.8 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 117.262 0.531 . . . . 62.41 111.127 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 43.6 mm -81.31 120.48 33.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.057 -0.52 . . . . 73.34 110.033 176.397 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.737 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 28.9 mmmt -101.78 148.9 24.74 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.992 -0.549 . . . . 75.03 109.537 179.668 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -121.29 109.23 14.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.97 0.414 . . . . 74.54 110.927 173.675 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.421 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 69.0 m-85 -117.16 101.53 8.54 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.122 0.487 . . . . 54.21 111.027 177.834 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.613 ' HA ' ' HA ' ' A' ' 48' ' ' LYS . 3.2 p -85.58 -12.99 50.2 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.448 -0.797 . . . . 75.1 110.241 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.67 ' OD2' ' HB3' ' A' ' 64' ' ' GLN . 33.6 t70 -127.68 113.38 15.96 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.349 -0.841 . . . . 72.33 109.396 177.312 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.91 -23.01 62.19 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.088 -0.505 . . . . 50.33 111.113 -175.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.67 ' HB3' ' OD2' ' A' ' 62' ' ' ASP . 0.7 OUTLIER -58.27 -50.25 74.25 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.814 -0.81 . . . . 74.44 108.814 172.172 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.1 m -64.74 -27.8 69.15 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.335 -0.848 . . . . 51.53 110.855 177.708 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 64.1 tp -69.05 -32.47 71.99 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.78 0.324 . . . . 70.35 110.63 177.194 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 62.9 ttt180 -61.55 -34.61 75.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.938 0.399 . . . . 75.42 110.177 175.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.582 ' HE2' ' OE1' ' A' ' 64' ' ' GLN . 62.8 mttm -68.63 -26.09 65.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.204 0.526 . . . . 71.12 110.607 178.146 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.467 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 78.1 t80 -85.83 -52.9 5.45 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.691 -0.686 . . . . 71.14 111.257 -177.233 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.46 ' HA ' ' HB2' ' A' ' 73' ' ' LYS . . . -68.04 -14.56 63.06 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.282 0.475 . . . . 62.52 112.282 -175.346 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.0 p -78.55 -32.04 47.67 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.758 0.313 . . . . 62.22 110.723 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.467 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 10.5 pt20 -91.65 -21.62 20.7 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.092 0.473 . . . . 43.54 109.945 177.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.46 ' HB2' ' HA ' ' A' ' 70' ' ' ALA . 29.6 mmmt -79.97 106.3 11.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.784 -0.644 . . . . 75.21 110.375 175.189 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.8 t -58.22 -37.74 75.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.964 0.411 . . . . 74.23 110.351 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.4 m -58.8 -52.41 65.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.105 -0.498 . . . . 61.54 111.141 178.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 84.1 mtp -80.5 -17.07 52.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.197 -0.456 . . . . 72.5 111.11 -175.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.625 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 25.1 ttmm -62.66 -24.6 67.7 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-N 116.279 -0.419 . . . . 75.15 110.152 175.188 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -92.48 -9.23 42.2 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.301 0.572 . . . . 73.5 110.132 -177.212 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.61 ' HB3' HG21 ' B' ' 133' ' ' ILE . 78.5 mt -95.62 -50.87 4.77 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.857 -1.065 . . . . 51.22 109.978 178.556 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.9 mt -90.71 -5.52 55.63 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.967 -0.56 . . . . 62.44 111.94 -172.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.625 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 64.5 pttt -58.34 -19.01 31.73 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.228 0.455 . . . . 75.21 112.228 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -76.89 -29.54 55.81 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.784 0.326 . . . . 73.3 110.865 -178.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.464 HG23 ' HG ' ' A' ' 84' ' ' LEU . 27.6 m -108.35 -27.21 3.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.403 -0.362 . . . . 62.31 111.716 -178.423 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.464 ' HG ' HG23 ' A' ' 83' ' ' VAL . 93.9 mt . . . . . 0 C--N 1.326 -0.413 0 CA-C-N 116.658 -0.246 . . . . 65.11 110.418 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 131' ' ' PHE . . . . . 0.409 ' HB3' HD21 ' A' ' 49' ' ' LEU . 20.2 p90 . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 114.024 1.12 . . . . 74.34 114.024 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 132' ' ' ASN . . . . . 0.463 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 53.3 t30 -59.86 -55.23 36.78 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.713 0.292 . . . . 72.13 111.096 -176.32 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 133' ' ' ILE . . . . . 0.61 HG21 ' HB3' ' A' ' 79' ' ' LEU . 39.3 mm -58.84 -38.38 72.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.484 0.659 . . . . 73.32 110.771 -179.006 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.484 HD22 HD23 ' A' ' 49' ' ' LEU . 10.2 mp -66.3 -34.36 77.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.304 -0.862 . . . . 74.21 111.094 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -67.47 -40.38 85.31 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.036 -0.529 . . . . 72.12 110.152 178.028 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 136' ' ' GLU . . . . . 0.463 ' HG3' ' O ' ' B' ' 132' ' ' ASN . 27.2 mt-10 -69.16 -42.74 75.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.883 -0.599 . . . . 74.12 111.086 -178.773 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -87.1 1.18 53.79 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.324 -0.398 . . . . 72.13 111.396 -178.098 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 37.5 t70 53.78 66.99 1.08 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.681 0.753 . . . . 62.13 111.581 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -90.38 -1.35 57.9 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.281 -0.872 . . . . 73.5 109.838 171.454 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 57.34 67.33 2.52 Favored Pre-proline 0 C--O 1.234 0.283 0 CA-C-N 114.855 -1.066 . . . . 44.1 110.902 -176.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -74.94 161.14 39.42 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.244 1.963 . . . . 74.43 111.299 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 142' ' ' LYS . . . . . 0.936 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.602 0 C-N-CA 120.447 -0.501 . . . . 74.33 110.256 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.509 -0.613 0 N-CA-C 109.33 -0.618 . . . . 72.3 109.33 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.63 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 1.8 mm? -67.49 92.73 0.31 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.463 -0.79 . . . . 75.43 110.99 -178.264 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.933 ' HB3' ' HD2' ' A' ' 42' ' ' LYS . . . -88.89 78.76 7.5 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.116 -0.947 . . . . 33.33 109.368 173.742 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 151' ' ' PHE . . . . . 0.63 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 49.5 p90 -111.22 164.45 12.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.557 -0.747 . . . . 73.04 110.802 -176.358 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 6.8 tppt? -90.22 116.4 28.18 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.861 -0.609 . . . . 70.24 110.85 -177.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 153' ' ' CYS . . . . . . . . . . . . . 44.6 t -130.69 114.07 14.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.291 -0.413 . . . . 65.42 110.328 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 64.26 22.8 12.92 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.578 -0.737 . . . . 73.41 112.56 173.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 109.75 -24.52 19.32 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.143 -1.027 . . . . 70.01 112.988 176.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -112.73 149.89 32.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 117.163 0.482 . . . . 73.12 110.889 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 46.9 mm -79.81 130.91 35.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.074 -0.512 . . . . 71.52 109.953 176.168 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 158' ' ' LYS . . . . . 0.852 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 26.5 mmmt -100.71 157.3 16.79 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.068 -0.716 . . . . 72.1 109.068 178.212 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -132.58 109.32 9.67 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.94 0.4 . . . . 73.22 110.919 174.07 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 160' ' ' PHE . . . . . 0.441 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 80.2 m-85 -120.73 115.41 23.26 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.115 -0.493 . . . . 73.33 111.149 -179.606 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 33.9 m -98.03 4.6 49.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.187 0.518 . . . . 72.2 110.603 178.583 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -147.14 126.55 13.16 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.065 -0.516 . . . . 74.11 109.751 -177.327 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 92.5 mt -71.82 -21.27 61.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.515 -0.311 . . . . 73.34 110.859 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 164' ' ' GLN . . . . . 0.536 ' OE1' ' HE3' ' B' ' 168' ' ' LYS . 0.6 OUTLIER -69.73 -41.77 74.86 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.779 -0.822 . . . . 65.13 108.779 176.103 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 32.6 t -67.69 -42.38 82.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.295 -0.866 . . . . 63.22 109.895 175.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 64.9 tp -63.66 -31.52 72.72 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.041 -0.527 . . . . 65.33 110.489 178.262 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 167' ' ' ARG . . . . . 0.524 ' HD2' HD22 ' B' ' 184' ' ' LEU . 56.3 ttt180 -56.8 -45.86 81.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.226 -0.443 . . . . 74.15 110.868 176.282 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 168' ' ' LYS . . . . . 0.536 ' HE3' ' OE1' ' B' ' 164' ' ' GLN . 93.1 mttt -63.8 -30.56 71.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.123 -0.489 . . . . 34.21 110.864 -178.591 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -80.46 -47.88 13.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.947 -0.57 . . . . 62.5 110.61 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -66.18 -29.6 69.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.948 -0.569 . . . . 40.23 111.619 -175.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 34.2 p -68.68 -45.4 71.76 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 121.124 -0.23 . . . . 75.34 110.914 -179.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -82.88 -3.87 57.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.191 0.52 . . . . 63.41 110.858 -178.062 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 173' ' ' LYS . . . . . 0.423 ' HB3' ' HE3' ' B' ' 173' ' ' LYS . 24.2 mmmt -86.74 111.02 20.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.078 -0.51 . . . . 73.02 110.035 173.439 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 48.3 t -55.82 -37.48 68.72 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.797 0.332 . . . . 75.3 111.711 -177.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 8.6 p -78.26 -46.64 19.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.845 0.355 . . . . 51.13 111.602 -178.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 81.6 mtp -76.29 -12.79 60.14 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.352 -0.385 . . . . 61.24 111.688 -175.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 19.0 ttmm -57.24 -30.09 64.34 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.869 -0.605 . . . . 74.31 111.15 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -100.58 5.02 43.85 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.356 0.598 . . . . 75.44 110.716 -175.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 179' ' ' LEU . . . . . 0.493 ' HB3' HG21 ' A' ' 33' ' ' ILE . 63.4 mt -97.51 -53.59 3.4 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.578 -0.737 . . . . 74.24 110.217 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 180' ' ' LEU . . . . . 0.502 ' HB3' HD12 ' B' ' 184' ' ' LEU . 3.5 mm? -86.39 1.39 51.42 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.807 -0.633 . . . . 60.34 111.322 -176.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -49.33 -29.14 5.65 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.111 0.782 . . . . 75.31 113.111 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -73.12 -28.51 62.3 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.413 0.523 . . . . 64.14 112.413 -174.049 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 183' ' ' VAL . . . . . 0.748 HG23 ' HG ' ' B' ' 184' ' ' LEU . 31.5 m -112.01 -14.32 10.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.864 0.364 . . . . 51.52 111.122 179.437 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 184' ' ' LEU . . . . . 0.748 ' HG ' HG23 ' B' ' 183' ' ' VAL . 42.5 mt . . . . . 0 C--N 1.325 -0.484 0 CA-C-N 116.12 -0.491 . . . . 70.1 110.133 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 45.7 p90 . . . . . 0 N--CA 1.456 -0.145 0 CA-C-O 120.781 0.324 . . . . 75.14 110.838 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.519 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 6.8 t30 -62.42 -44.15 97.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.319 -0.4 . . . . 55.42 111.124 -178.217 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 39.5 mm -55.39 -46.22 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-O 121.332 0.587 . . . . 60.23 110.705 177.199 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.524 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 68.7 mt -65.46 -32.59 74.29 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.684 -0.689 . . . . 64.33 111.178 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -70.0 -38.99 76.15 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.798 0.332 . . . . 61.4 110.219 177.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 6.0 mm-40 -70.21 -23.08 62.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.172 -0.467 . . . . 75.43 110.819 179.133 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 28.9 m-80 -99.59 1.95 44.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.227 -0.442 . . . . 73.32 110.927 177.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 60.85 43.47 11.9 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.543 -0.753 . . . . 74.2 112.185 176.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.524 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 3.4 m-85 -80.06 -11.66 59.75 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.875 -0.602 . . . . 74.13 109.451 171.388 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 57.32 73.93 0.72 Allowed Pre-proline 0 C--O 1.231 0.108 0 CA-C-N 114.806 -1.088 . . . . 71.23 111.054 -175.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.558 ' C ' ' HE2' ' A' ' 42' ' ' LYS . 83.3 Cg_endo -86.42 147.27 8.66 Favored 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.735 2.29 . . . . 71.4 111.685 177.499 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.558 ' HE2' ' C ' ' A' ' 41' ' ' PRO . 1.4 mpmm? . . . . . 0 C--N 1.322 -0.614 0 CA-C-O 121.326 0.584 . . . . 72.04 111.072 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.449 -0.502 0 N-CA-C 108.867 -0.79 . . . . 75.11 108.867 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.858 ' H ' HD23 ' A' ' 49' ' ' LEU . 0.3 OUTLIER -76.15 91.47 3.16 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.32 0.581 . . . . 54.52 110.891 -175.404 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.638 ' HB2' HG23 ' A' ' 59' ' ' THR . . . -84.54 78.32 9.86 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.177 -0.92 . . . . 72.24 109.638 173.795 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.443 ' HB3' ' HA ' ' B' ' 141' ' ' PRO . 52.1 p90 -97.98 162.57 13.16 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.012 -0.54 . . . . 63.4 110.791 -174.277 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -93.17 119.73 32.69 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.118 -0.492 . . . . 73.35 110.078 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.479 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 45.4 t -128.7 108.96 10.9 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.372 -0.376 . . . . 54.15 110.621 178.45 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.5 t70 72.88 2.15 4.27 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.581 -0.736 . . . . 70.35 111.97 171.183 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 129.39 -25.87 4.46 Favored Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.184 -1.008 . . . . 63.21 112.587 179.539 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.493 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 11.2 pt-20 -106.07 149.18 26.96 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.643 -0.423 . . . . 63.44 110.788 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 44.6 mm -84.39 117.14 29.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.032 -0.531 . . . . 71.14 109.778 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.584 ' HB3' ' CE1' ' A' ' 60' ' ' PHE . 30.1 mmmt -99.2 102.43 14.08 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.328 -0.396 . . . . 64.44 110.362 -177.836 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.638 HG23 ' HB2' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -82.86 101.91 11.3 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.242 -0.435 . . . . 75.51 110.588 178.186 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.584 ' CE1' ' HB3' ' A' ' 58' ' ' LYS . 4.8 m-85 -108.25 136.1 48.47 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.43 -0.35 . . . . 64.41 111.576 -177.45 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.4 p -118.73 -0.46 11.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.996 -0.547 . . . . 71.33 111.006 174.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -130.43 135.58 48.14 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 120.853 0.359 . . . . 74.04 111.841 -177.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.9 tp -70.69 -34.96 72.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.713 -0.676 . . . . 74.24 109.594 174.011 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -57.45 -44.98 85.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.607 -0.724 . . . . 75.15 110.615 176.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.435 ' O ' ' HG3' ' A' ' 68' ' ' LYS . 50.9 m -69.75 -33.12 72.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.842 -0.617 . . . . 75.35 110.829 179.399 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 46.6 tp -68.22 -37.79 81.21 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.993 -0.373 . . . . 72.5 109.993 177.837 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 51.6 ttp180 -58.6 -50.16 74.82 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.874 -0.603 . . . . 73.42 111.0 178.227 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.528 ' HD3' ' N ' ' A' ' 69' ' ' PHE . 0.0 OUTLIER -67.7 -39.59 84.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.799 0.333 . . . . 65.31 111.396 -178.202 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.528 ' N ' ' HD3' ' A' ' 68' ' ' LYS . 74.0 t80 -67.11 -44.83 78.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.897 -0.592 . . . . 72.34 110.933 -178.58 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.74 -30.01 70.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.347 -0.388 . . . . 61.42 111.134 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.8 t -72.72 -35.16 67.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.34 -0.391 . . . . 53.03 110.818 -178.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -86.81 -11.9 49.57 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.035 0.445 . . . . 74.55 110.729 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.479 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 27.3 mmmt -89.82 122.77 33.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.095 -0.502 . . . . 74.02 110.2 175.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.5 m -63.99 -38.65 91.85 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.585 0.231 . . . . 65.14 111.344 -178.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.408 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 10.7 p -72.98 -40.23 65.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.882 0.372 . . . . 55.41 111.367 -179.544 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.469 ' HA ' HD12 ' A' ' 79' ' ' LEU . 74.3 mtp -85.18 -15.21 44.46 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.935 0.346 . . . . 53.32 111.935 -174.187 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 81.0 tttt -59.84 -37.47 79.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.217 -0.447 . . . . 65.25 111.79 -174.111 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.631 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 28.2 mt-10 -102.51 7.74 40.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.644 0.735 . . . . 54.12 110.651 -176.221 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.649 ' HB3' HG21 ' B' ' 133' ' ' ILE . 70.0 mt -87.3 -41.18 13.85 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.138 -0.937 . . . . 75.34 109.549 174.037 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -101.02 6.44 43.46 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.609 -0.723 . . . . 64.03 110.509 -178.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.631 ' HB3' ' HA ' ' A' ' 78' ' ' GLU . 18.8 ptmt -61.27 -12.83 14.86 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.447 -0.797 . . . . 74.33 112.124 -178.147 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -81.57 -46.08 14.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.751 0.31 . . . . 73.33 110.931 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 24.6 m -84.62 -18.83 9.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.1 0.476 . . . . 73.55 110.66 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 55.3 mt . . . . . 0 C--N 1.323 -0.555 0 N-CA-C 108.448 -0.945 . . . . 72.43 108.448 171.655 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 40.5 p90 . . . . . 0 N--CA 1.454 -0.241 0 CA-C-O 121.261 0.553 . . . . 74.12 109.604 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -63.02 -63.54 1.17 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.136 -0.938 . . . . 64.31 111.72 -173.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 133' ' ' ILE . . . . . 0.649 HG21 ' HB3' ' A' ' 79' ' ' LEU . 48.6 mm -60.45 -37.58 75.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.399 0.618 . . . . 64.23 110.609 -178.326 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.542 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 79.0 mt -60.94 -40.03 91.71 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.473 -0.785 . . . . 52.54 111.143 179.351 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' B' ' 135' ' ' ARG . 28.4 ttt180 -65.61 -42.93 91.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.733 0.301 . . . . 54.11 110.359 177.408 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -61.33 -35.62 77.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.867 -0.606 . . . . 64.24 111.317 -179.379 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -98.09 9.21 43.42 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.186 -0.461 . . . . 74.34 110.841 -179.401 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 63.1 41.09 8.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.422 -0.808 . . . . 74.22 112.619 171.308 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 139' ' ' PHE . . . . . 0.542 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 26.3 m-85 -74.01 -15.39 61.09 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.541 -0.54 . . . . 73.42 109.541 170.052 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 52.5 74.62 0.75 Allowed Pre-proline 0 C--O 1.234 0.262 0 CA-C-N 114.89 -1.05 . . . . 71.11 110.952 -176.165 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 141' ' ' PRO . . . . . 0.443 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 95.8 Cg_endo -88.22 178.42 3.04 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.875 2.383 . . . . 74.44 111.904 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 142' ' ' LYS . . . . . 0.476 ' H ' ' HA ' ' A' ' 49' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--N 1.325 -0.497 0 CA-C-O 121.33 0.586 . . . . 51.44 111.211 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.448 -0.57 0 CA-C-O 121.251 0.548 . . . . 74.14 109.756 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.787 ' H ' HD23 ' B' ' 149' ' ' LEU . 0.3 OUTLIER -76.96 90.11 3.54 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.273 -0.421 . . . . 71.23 110.692 -178.34 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.589 ' HA ' ' O ' ' B' ' 158' ' ' LYS . . . -80.15 85.0 5.76 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.531 -0.759 . . . . 71.3 109.831 174.358 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 151' ' ' PHE . . . . . 0.408 ' HB2' ' HB3' ' A' ' 39' ' ' PHE . 52.1 p90 -104.67 165.5 11.02 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.924 -0.58 . . . . 74.1 110.319 -177.579 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 2.4 tppp? -93.65 116.11 28.59 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.006 -0.543 . . . . 65.32 110.032 176.18 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 153' ' ' CYS . . . . . . . . . . . . . 23.1 t -88.85 -131.61 0.08 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.322 -0.854 . . . . 75.41 110.028 178.229 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -74.06 35.98 0.09 Allowed 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 123.962 0.905 . . . . 71.44 111.556 -179.068 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 110.59 -17.18 28.39 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.676 -0.773 . . . . 60.41 111.541 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 156' ' ' GLU . . . . . 0.431 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 13.1 pt-20 -106.06 140.85 38.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.879 0.371 . . . . 74.45 110.631 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 41.3 mm -82.93 120.65 34.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 109.494 -0.558 . . . . 64.44 109.494 176.325 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 158' ' ' LYS . . . . . 0.589 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 31.6 mmmt -103.99 132.75 49.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.682 0.277 . . . . 63.33 111.084 -176.292 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -112.58 103.7 11.76 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.212 -0.449 . . . . 74.43 111.377 177.133 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 160' ' ' PHE . . . . . 0.461 ' CD2' HD13 ' B' ' 166' ' ' LEU . 64.6 m-85 -120.01 143.69 47.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.135 -0.484 . . . . 63.45 110.722 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 18.9 p -118.57 -18.37 9.08 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.49 0.662 . . . . 50.33 109.481 173.064 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -111.16 138.66 47.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.293 -0.867 . . . . 63.33 109.206 178.217 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.9 pp -81.69 -10.96 59.25 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.858 -0.423 . . . . 72.35 109.858 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -65.49 -51.98 56.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.364 0.602 . . . . 72.14 109.83 175.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 165' ' ' SER . . . . . 0.519 ' O ' ' HG3' ' B' ' 168' ' ' LYS . 0.3 OUTLIER -70.42 -31.64 68.91 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.363 -0.835 . . . . 53.33 110.623 179.287 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 166' ' ' LEU . . . . . 0.461 HD13 ' CD2' ' B' ' 160' ' ' PHE . 68.7 tp -69.99 -41.36 74.51 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.179 -0.464 . . . . 72.13 110.593 177.325 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 167' ' ' ARG . . . . . 0.67 ' HG3' HD13 ' B' ' 184' ' ' LEU . 50.6 ttp180 -61.88 -47.63 84.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.364 -0.38 . . . . 74.31 110.772 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 168' ' ' LYS . . . . . 0.519 ' HG3' ' O ' ' B' ' 165' ' ' SER . 0.0 OUTLIER -65.22 -36.54 84.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.925 0.393 . . . . 40.44 110.879 -179.711 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -65.52 -48.62 71.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.738 -0.665 . . . . 74.12 110.606 175.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.02 -37.04 83.41 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.403 -0.362 . . . . 60.13 111.446 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 10.9 t -68.43 -22.31 64.61 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.401 -0.363 . . . . 50.42 111.26 -177.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -102.05 3.53 38.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.955 0.407 . . . . 73.41 110.633 178.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 173' ' ' LYS . . . . . 0.45 ' O ' ' HB2' ' B' ' 177' ' ' LYS . 27.4 mmmt -104.27 111.81 24.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.181 -0.463 . . . . 72.44 110.747 -179.528 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 25.2 m -52.8 -31.75 40.38 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 123.241 0.338 . . . . 43.43 111.898 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 11.0 p -81.84 -49.49 10.3 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.757 0.313 . . . . 63.42 111.622 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.457 ' HA ' HD12 ' B' ' 179' ' ' LEU . 82.1 mtp -80.78 -18.61 47.04 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.201 0.445 . . . . 72.11 112.201 -172.369 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 177' ' ' LYS . . . . . 0.45 ' HB2' ' O ' ' B' ' 173' ' ' LYS . 79.8 tttt -60.88 -31.31 70.79 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.183 -0.462 . . . . 74.43 110.936 -176.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 178' ' ' GLU . . . . . 0.925 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 44.4 mt-10 -99.15 3.28 46.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.457 0.646 . . . . 65.44 110.641 -174.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 179' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' B' ' 176' ' ' MET . 86.3 mt -93.38 -56.44 2.94 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.464 -0.789 . . . . 54.22 110.378 178.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 180' ' ' LEU . . . . . 0.43 ' HB3' HD12 ' B' ' 184' ' ' LEU . 3.5 mm? -76.54 -10.98 59.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.665 -0.698 . . . . 64.31 111.666 -176.206 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 181' ' ' LYS . . . . . 0.925 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 17.5 ptmt -61.37 -9.43 5.36 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.851 0.686 . . . . 72.31 112.851 -174.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -76.09 -31.91 58.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.998 0.428 . . . . 65.41 110.585 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 20.8 m -113.24 -10.77 12.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.016 -0.538 . . . . 61.31 110.806 178.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 184' ' ' LEU . . . . . 0.67 HD13 ' HG3' ' B' ' 167' ' ' ARG . 95.7 mt . . . . . 0 C--N 1.327 -0.388 0 N-CA-C 108.977 -0.749 . . . . 71.24 108.977 173.769 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 43.5 p90 . . . . . 0 C--O 1.234 0.252 0 CA-C-O 120.637 0.256 . . . . 63.31 111.062 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.591 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 6.5 t30 -65.69 -42.5 91.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.27 -0.423 . . . . 63.54 110.922 -173.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.63 HG21 ' HB3' ' B' ' 179' ' ' LEU . 30.2 mm -74.26 -32.8 32.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.643 0.735 . . . . 62.24 110.479 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.507 HD12 HD23 ' B' ' 149' ' ' LEU . 76.6 mt -70.75 -34.48 71.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.387 -0.824 . . . . 70.01 111.749 -175.581 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.569 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 7.9 ptm180 -69.62 -37.24 76.76 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.969 0.414 . . . . 61.11 110.536 178.548 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.591 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 38.2 mt-10 -63.33 -44.68 94.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.61 -0.723 . . . . 75.14 111.387 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 -95.41 5.99 50.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.255 -0.43 . . . . 75.2 110.973 -175.588 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 55.48 65.77 1.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.355 -0.839 . . . . 74.01 112.685 177.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.409 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 4.6 m-85 -90.53 -3.61 57.48 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.461 -0.791 . . . . 73.31 109.397 170.185 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.402 ' O ' ' HA ' ' B' ' 151' ' ' PHE . 45.3 mt-10 56.98 71.17 1.18 Allowed Pre-proline 0 CA--C 1.53 0.186 0 CA-C-N 114.958 -1.019 . . . . 64.42 111.565 -179.329 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.402 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 85.1 Cg_endo -85.18 170.11 9.69 Favored 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 122.456 2.104 . . . . 63.41 111.693 177.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.651 ' HD3' ' HB3' ' B' ' 150' ' ' ALA . 5.1 mptp? . . . . . 0 C--N 1.323 -0.586 0 C-N-CA 121.07 -0.252 . . . . 73.43 110.359 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.436 0 CA-C-O 121.475 0.655 . . . . 74.42 109.79 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.79 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.9 mp -75.55 94.8 3.22 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.353 -0.84 . . . . 70.41 110.949 -175.724 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -87.25 59.33 5.5 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.637 -0.505 . . . . 63.34 109.637 172.501 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.79 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 54.9 p90 -88.08 166.94 14.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.097 -0.501 . . . . 74.24 110.713 -176.058 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.4 tppp? -96.15 131.51 42.52 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.524 -0.762 . . . . 73.44 110.415 179.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.473 ' SG ' ' HE2' ' A' ' 69' ' ' PHE . 49.7 t -139.35 107.73 5.82 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.869 0.366 . . . . 73.22 110.478 175.73 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 t70 70.54 13.56 7.36 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.429 -0.805 . . . . 74.04 111.56 172.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 120.17 -29.6 5.92 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.291 -0.957 . . . . 64.51 112.702 177.092 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.449 ' CD ' ' HD3' ' A' ' 58' ' ' LYS . 12.7 pt-20 -102.17 155.2 18.36 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 110.064 -0.347 . . . . 75.3 110.064 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 47.8 mm -86.86 129.2 38.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.494 -0.558 . . . . 74.32 109.494 176.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.561 ' HB3' ' CE2' ' A' ' 60' ' ' PHE . 31.7 mmmt -117.56 97.01 5.65 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 121.266 -0.174 . . . . 44.45 110.767 -176.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.58 ' HA ' ' O ' ' A' ' 49' ' ' LEU . 0.6 OUTLIER -79.09 110.31 14.22 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.872 0.323 . . . . 70.13 111.872 -179.855 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.561 ' CE2' ' HB3' ' A' ' 58' ' ' LYS . 82.6 m-85 -129.47 140.1 51.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.803 0.335 . . . . 65.5 110.369 176.604 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.7 p -124.01 13.32 9.09 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.234 0.54 . . . . 62.43 110.557 176.258 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -140.01 -177.74 5.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.849 -0.614 . . . . 72.21 110.738 -176.439 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 26.6 tp -127.91 32.6 4.91 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.746 -0.661 . . . . 33.55 109.972 -179.271 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -120.82 -42.66 2.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.171 0.51 . . . . 64.33 109.871 177.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.6 m -81.14 -43.05 19.96 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.641 -0.503 . . . . 55.43 109.641 174.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.544 HD12 ' HB2' ' A' ' 60' ' ' PHE . 5.9 tt -63.4 -41.52 98.76 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.447 -0.575 . . . . 62.41 109.447 177.51 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.6 ttt180 -60.0 -38.66 83.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.808 -0.633 . . . . 73.04 110.996 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.1 mtmm -64.71 -43.24 94.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.935 0.397 . . . . 70.35 110.673 175.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.473 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 64.1 t80 -63.44 -44.91 93.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.002 -0.545 . . . . 74.42 110.541 179.331 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.46 -25.58 66.79 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.855 -0.612 . . . . 64.53 111.95 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.1 t -80.71 -28.48 36.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.506 0.193 . . . . 73.41 111.21 -177.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -88.38 -19.32 26.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.209 0.528 . . . . 75.44 110.16 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -86.68 118.8 26.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.586 -0.733 . . . . 70.13 110.67 176.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.4 m -62.21 -40.33 95.75 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.004 0.43 . . . . 74.04 110.303 178.158 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.402 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 36.4 t -63.67 -49.11 74.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.679 -0.691 . . . . 73.42 110.787 -179.182 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 68.9 mtp -78.62 -14.99 59.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.295 -0.411 . . . . 70.11 111.183 -175.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.434 ' HE3' ' HB2' ' A' ' 77' ' ' LYS . 38.8 ttmt -64.3 -32.65 74.34 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.082 -0.508 . . . . 61.22 110.549 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.469 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 20.6 mm-40 -88.99 -4.26 58.48 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 121.639 0.733 . . . . 65.12 110.127 -178.319 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.612 ' HB3' HG21 ' B' ' 133' ' ' ILE . 49.0 mt -95.19 -52.96 3.97 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.835 -1.075 . . . . 73.03 109.583 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.682 ' HB3' HD13 ' A' ' 84' ' ' LEU . 4.1 mm? -84.8 -0.75 54.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.298 -0.864 . . . . 71.33 111.412 -176.744 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.469 ' HD3' ' HA ' ' A' ' 78' ' ' GLU . 64.7 pttt -56.74 -14.44 3.34 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 111.895 0.331 . . . . 62.15 111.895 176.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -63.4 -42.11 98.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.995 0.426 . . . . 75.23 110.862 176.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.411 HG13 HD12 ' A' ' 84' ' ' LEU . 7.5 p -111.52 -15.64 9.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.308 0.575 . . . . 64.12 111.009 -176.857 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.682 HD13 ' HB3' ' A' ' 80' ' ' LEU . 11.2 mp . . . . . 0 C--N 1.327 -0.412 0 N-CA-C 109.882 -0.414 . . . . 54.52 109.882 173.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 49.8 p90 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.769 0.319 . . . . 75.04 111.291 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 132' ' ' ASN . . . . . 0.487 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 50.4 t30 -59.2 -51.1 71.44 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 116.117 -0.492 . . . . 74.32 110.965 -178.435 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 133' ' ' ILE . . . . . 0.612 HG21 ' HB3' ' A' ' 79' ' ' LEU . 4.0 mp -67.88 -34.09 65.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.367 0.603 . . . . 72.53 110.563 -177.645 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.615 HD12 HD23 ' A' ' 49' ' ' LEU . 92.4 mt -73.47 -25.24 60.39 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.834 -0.621 . . . . 74.43 111.985 -175.508 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.601 ' HG3' ' N ' ' B' ' 136' ' ' GLU . 3.5 ptp180 -75.96 -40.43 53.96 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.54 -0.464 . . . . 74.35 109.82 175.097 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 136' ' ' GLU . . . . . 0.601 ' N ' ' HG3' ' B' ' 135' ' ' ARG . 10.4 mm-40 -58.7 -45.51 89.35 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.355 -0.839 . . . . 62.03 111.142 -179.183 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -95.81 5.83 50.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.783 -0.644 . . . . 63.14 111.323 -175.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 52.54 70.11 0.61 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.512 -0.767 . . . . 73.21 112.742 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -96.09 4.88 52.21 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.55 -0.75 . . . . 71.32 109.989 172.707 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 55.57 67.69 2.87 Favored Pre-proline 0 C--O 1.232 0.155 0 CA-C-N 115.023 -0.989 . . . . 73.24 111.238 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 141' ' ' PRO . . . . . 0.474 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 90.1 Cg_endo -88.2 165.31 6.93 Favored 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 122.528 2.152 . . . . 74.2 112.415 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? . . . . . 0 C--N 1.325 -0.459 0 CA-C-N 115.816 -0.629 . . . . 61.43 109.512 175.493 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.513 -0.476 0 N-CA-C 109.123 -0.695 . . . . 72.0 109.123 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.717 ' HB3' ' HD1' ' B' ' 151' ' ' PHE . 9.7 mp -71.65 90.61 1.05 Allowed 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.51 -0.768 . . . . 73.44 110.511 -178.233 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.651 ' HB3' ' HD3' ' A' ' 42' ' ' LYS . . . -87.7 68.29 9.43 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.621 -0.511 . . . . 63.31 109.621 174.654 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 151' ' ' PHE . . . . . 0.717 ' HD1' ' HB3' ' B' ' 149' ' ' LEU . 53.5 p90 -100.17 164.91 11.76 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.763 -0.653 . . . . 72.44 110.622 -176.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 5.3 tppp? -93.98 120.16 33.86 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.744 -0.662 . . . . 74.24 110.431 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 153' ' ' CYS . . . . . 0.477 ' SG ' ' HE2' ' B' ' 169' ' ' PHE . 43.5 t -125.77 108.77 11.82 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 116.448 -0.342 . . . . 61.54 110.528 177.316 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 2.0 t70 68.8 10.25 7.8 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.527 -0.76 . . . . 71.24 111.852 170.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 119.99 -19.94 9.35 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.314 -0.946 . . . . 75.24 112.824 179.079 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 156' ' ' GLU . . . . . 0.578 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 9.9 pt-20 -112.95 139.04 48.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.798 0.333 . . . . 75.34 110.284 178.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 44.0 mm -75.48 118.4 21.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.216 -0.447 . . . . 74.44 109.919 177.437 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 158' ' ' LYS . . . . . 0.578 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 31.7 mmmt -107.78 94.52 5.12 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.557 -0.292 . . . . 53.14 110.896 -175.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 159' ' ' THR . . . . . 0.499 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.7 OUTLIER -74.44 117.21 15.99 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.954 0.406 . . . . 63.3 110.852 177.852 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 160' ' ' PHE . . . . . 0.526 ' CD2' HD13 ' B' ' 166' ' ' LEU . 41.4 m-85 -126.29 120.09 29.07 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.139 -0.482 . . . . 74.43 110.003 176.765 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 25.5 p -101.1 6.7 43.37 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.378 0.609 . . . . 73.33 109.844 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -150.29 162.22 40.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.322 -0.854 . . . . 65.03 110.137 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 163' ' ' LEU . . . . . 0.463 ' CD1' HD23 ' B' ' 166' ' ' LEU . 35.3 tp -96.28 -1.61 47.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.171 0.51 . . . . 74.11 111.151 -176.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 164' ' ' GLN . . . . . 0.471 ' O ' ' HG2' ' B' ' 168' ' ' LYS . 61.5 tt0 -81.42 -52.03 7.69 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.727 -0.472 . . . . 72.43 109.727 -178.344 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 3.2 m -67.25 -28.56 68.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.576 -0.738 . . . . 71.13 110.104 177.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 166' ' ' LEU . . . . . 0.526 HD13 ' CD2' ' B' ' 160' ' ' PHE . 43.5 tp -64.54 -39.47 93.82 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.16 -0.473 . . . . 73.01 110.258 178.486 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 75.2 ttt180 -65.04 -38.0 89.44 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.818 -0.438 . . . . 52.5 109.818 175.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 168' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' B' ' 164' ' ' GLN . 13.1 mmmm -56.51 -36.95 69.76 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.583 -0.735 . . . . 71.44 110.576 179.31 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 169' ' ' PHE . . . . . 0.528 ' O ' ' HG2' ' B' ' 173' ' ' LYS . 58.0 t80 -89.54 -47.73 7.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.463 -0.79 . . . . 73.44 110.945 -177.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.18 -33.18 74.05 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.664 0.616 . . . . 75.23 112.664 -176.188 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 6.5 t -67.54 -20.13 65.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.658 0.266 . . . . 34.52 111.441 -175.583 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 172' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 11.4 pt20 -105.49 -3.2 22.75 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.913 0.387 . . . . 75.42 110.534 179.034 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 173' ' ' LYS . . . . . 0.602 ' HB2' ' HB2' ' B' ' 176' ' ' MET . 29.8 mmmt -87.23 129.89 34.79 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.176 -0.466 . . . . 63.34 111.017 -178.492 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 3.5 m -56.66 -45.6 81.56 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.701 -0.681 . . . . 51.25 110.593 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 175' ' ' SER . . . . . 0.472 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 40.1 t -82.92 -49.17 9.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.018 -0.537 . . . . 73.12 111.703 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.602 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 66.1 mtp -70.75 -20.53 62.62 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.405 0.52 . . . . 72.03 112.405 -169.324 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 177' ' ' LYS . . . . . 0.498 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 88.8 tttt -62.11 -35.01 77.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.982 0.42 . . . . 74.52 110.641 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 178' ' ' GLU . . . . . 0.458 ' HA ' ' HD3' ' B' ' 181' ' ' LYS . 25.9 mm-40 -91.22 -8.76 47.56 Favored 'General case' 0 CA--C 1.511 -0.519 0 CA-C-O 121.619 0.723 . . . . 73.53 110.213 -176.797 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 179' ' ' LEU . . . . . 0.63 ' HB3' HG21 ' A' ' 33' ' ' ILE . 81.2 mt -89.9 -48.41 7.24 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.883 -1.053 . . . . 75.32 109.798 178.535 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 180' ' ' LEU . . . . . 0.651 ' HB3' HD13 ' B' ' 184' ' ' LEU . 4.2 mm? -86.17 -11.05 53.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.574 -0.739 . . . . 45.15 111.778 -176.228 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 181' ' ' LYS . . . . . 0.498 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 64.1 pttt -55.71 -18.3 7.83 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 111.625 0.232 . . . . 73.24 111.625 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -60.16 -46.85 88.27 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.821 0.343 . . . . 75.11 110.879 177.087 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 17.4 m -105.98 -14.46 9.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.128 -0.487 . . . . 45.23 111.375 -176.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 184' ' ' LEU . . . . . 0.651 HD13 ' HB3' ' B' ' 180' ' ' LEU . 8.2 mp . . . . . 0 C--N 1.324 -0.502 0 N-CA-C 109.739 -0.467 . . . . 64.02 109.739 176.418 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 81.0 t80 . . . . . 0 C--O 1.233 0.199 0 CA-C-O 120.905 0.383 . . . . 72.23 110.44 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.535 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 8.5 t30 -60.0 -51.7 68.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.629 -0.714 . . . . 75.22 110.698 178.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.482 HG22 ' OD1' ' A' ' 37' ' ' ASN . 50.1 mm -58.67 -53.59 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 116.39 -0.368 . . . . 74.24 110.718 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.465 ' HB2' ' HG3' ' A' ' 41' ' ' PRO . 88.7 mt -54.92 -32.55 61.25 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.148 -0.478 . . . . 73.34 111.759 -178.766 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 34.6 ttt180 -69.29 -41.28 77.0 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.854 -0.339 . . . . 74.42 110.361 176.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.535 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 30.2 mt-10 -68.69 -35.53 77.31 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.299 -0.41 . . . . 71.04 110.353 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.482 ' OD1' HG22 ' A' ' 33' ' ' ILE . 4.3 m120 -73.48 -13.62 61.09 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.122 -0.49 . . . . 64.34 109.806 177.152 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.4 t70 68.4 36.4 3.02 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.202 -0.908 . . . . 62.14 110.982 -178.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -75.67 -22.92 56.26 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.848 -0.615 . . . . 73.41 109.522 172.659 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 60.31 82.66 0.22 Allowed Pre-proline 0 N--CA 1.463 0.191 0 CA-C-N 114.806 -1.088 . . . . 70.4 111.046 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.709 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 60.1 Cg_endo -87.83 178.24 3.28 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.878 2.385 . . . . 73.34 111.929 177.242 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.448 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.459 0 CA-C-O 120.744 0.307 . . . . 73.12 110.989 -177.772 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 mptt . . . . . 0 N--CA 1.446 -0.646 0 N-CA-C 107.737 -1.209 . . . . 74.15 107.737 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 35.5 tp -79.96 68.42 6.07 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.497 -0.927 . . . . 61.43 108.497 173.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.584 ' HB2' HG22 ' A' ' 59' ' ' THR . . . -84.3 97.86 9.68 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 114.892 -1.049 . . . . 51.42 110.616 -176.755 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -111.39 165.99 11.49 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.974 -0.557 . . . . 52.1 110.376 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -90.28 124.9 35.27 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.139 -0.482 . . . . 71.54 110.275 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 14.7 t -138.54 116.88 11.94 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.777 -0.453 . . . . 62.21 109.777 178.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 64.63 16.22 10.2 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.714 0.635 . . . . 63.34 112.714 176.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 107.69 -17.5 36.0 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.068 -1.063 . . . . 65.33 112.412 177.353 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -111.78 146.66 37.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.777 0.323 . . . . 72.51 110.433 177.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 45.2 mm -79.84 126.9 39.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.165 -0.47 . . . . 74.11 110.14 178.269 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.483 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 27.6 mmmt -107.33 117.3 33.71 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.113 -0.329 . . . . 74.11 110.113 -179.134 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.584 HG22 ' HB2' ' A' ' 50' ' ' ALA . 2.6 p -93.91 123.88 37.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.166 -0.47 . . . . 74.33 111.044 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.461 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 71.9 m-85 -131.2 135.2 47.19 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.303 -0.408 . . . . 72.33 111.21 178.436 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.7 p -126.55 -5.02 6.51 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.826 -0.624 . . . . 64.24 109.983 175.496 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -125.32 130.57 52.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.724 -0.671 . . . . 75.33 110.181 178.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.1 mp -73.72 -33.23 64.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.443 . . . . 74.55 111.665 -175.298 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -60.43 -46.04 91.47 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.32 0.581 . . . . 74.25 110.474 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.0 t -61.54 -46.89 88.01 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.717 -0.674 . . . . 53.41 110.533 177.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 48.3 tp -65.95 -36.61 83.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.015 -0.538 . . . . 74.51 111.436 -177.048 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -56.78 -41.5 77.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.079 0.466 . . . . 63.23 110.541 176.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.465 ' HZ2' ' HB2' ' A' ' 68' ' ' LYS . 10.4 mtmp? -69.94 -30.86 68.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.891 -0.595 . . . . 74.11 111.08 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.542 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 46.9 t80 -74.49 -45.75 43.93 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.94 -0.573 . . . . 74.4 110.647 -178.198 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.41 -27.53 67.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.295 -0.412 . . . . 74.23 111.364 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 43.8 t -67.29 -42.18 84.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.302 -0.408 . . . . 63.31 111.371 -178.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.542 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 13.9 pt20 -73.96 -25.04 59.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.123 0.487 . . . . 74.54 110.618 -176.736 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.611 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 71.1 mmtt -70.57 139.31 51.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.928 -0.578 . . . . 74.3 110.374 178.347 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 29.2 m -75.39 -39.87 58.59 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.993 0.425 . . . . 54.3 110.576 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.429 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 15.7 m -78.06 -50.49 11.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.212 -0.449 . . . . 64.24 111.136 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.611 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 83.4 mtp -67.78 -19.86 65.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 75.4 111.792 -174.668 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.433 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 4.6 ttmp? -58.79 -35.3 72.59 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.023 0.439 . . . . 72.51 110.769 177.068 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.402 ' O ' ' HE3' ' A' ' 81' ' ' LYS . 35.6 mt-10 -100.74 2.02 40.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.135 0.493 . . . . 74.12 110.333 -176.024 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.446 ' HB3' ' CG2' ' B' ' 133' ' ' ILE . 68.0 mt -89.0 -48.61 7.31 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.859 -0.609 . . . . 61.41 110.094 177.163 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.678 ' HB3' HD13 ' A' ' 84' ' ' LEU . 3.5 mm? -90.94 7.54 39.67 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.708 -0.678 . . . . 53.14 111.218 -176.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.402 ' HE3' ' O ' ' A' ' 78' ' ' GLU . 21.3 pttp -56.19 -24.48 42.0 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.532 -0.758 . . . . 63.24 112.112 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -81.06 -9.11 59.87 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 111.997 0.369 . . . . 62.14 111.997 -175.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 12.6 m -127.0 -33.42 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 C-N-CA 120.983 -0.287 . . . . 72.34 111.422 178.139 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.678 HD13 ' HB3' ' A' ' 80' ' ' LEU . 10.3 mp . . . . . 0 C--N 1.325 -0.47 0 CA-C-N 116.629 -0.26 . . . . 74.14 110.402 178.735 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 131' ' ' PHE . . . . . 0.459 ' HE1' HH11 ' B' ' 135' ' ' ARG . 53.0 t80 . . . . . 0 N--CA 1.456 -0.125 0 N-CA-C 110.126 -0.324 . . . . 65.03 110.126 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 132' ' ' ASN . . . . . 0.613 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 15.2 t-20 -57.92 -48.92 78.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.934 -0.576 . . . . 75.31 111.439 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 133' ' ' ILE . . . . . 0.446 ' CG2' ' HB3' ' A' ' 79' ' ' LEU . 2.4 mp -61.49 -47.52 93.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 CA-C-O 121.056 0.455 . . . . 72.33 110.691 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 87.1 mt -62.65 -31.32 72.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.945 -0.57 . . . . 64.22 110.543 178.52 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.459 HH11 ' HE1' ' B' ' 131' ' ' PHE . 24.9 ttt180 -73.02 -42.07 63.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.159 -0.473 . . . . 70.1 110.762 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 136' ' ' GLU . . . . . 0.613 ' HG3' ' O ' ' B' ' 132' ' ' ASN . 41.2 mt-10 -60.07 -47.08 87.34 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.204 0.526 . . . . 75.32 110.8 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -86.83 -0.71 56.93 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.693 -0.685 . . . . 74.41 111.083 -177.031 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 25.6 t0 57.92 67.91 0.9 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.382 -0.826 . . . . 71.53 111.894 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -96.53 -3.91 42.3 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.193 -0.912 . . . . 72.14 109.032 169.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 140' ' ' GLU . . . . . 0.407 ' HG2' ' HE3' ' B' ' 142' ' ' LYS . 37.6 tt0 55.69 78.07 0.4 Allowed Pre-proline 0 C--O 1.232 0.161 0 CA-C-N 114.566 -1.197 . . . . 72.55 111.275 -176.186 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 141' ' ' PRO . . . . . 0.432 ' C ' ' HD2' ' B' ' 142' ' ' LYS . 92.8 Cg_endo -82.99 163.41 15.65 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 123.076 2.517 . . . . 73.55 111.432 176.767 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 142' ' ' LYS . . . . . 0.432 ' HD2' ' C ' ' B' ' 141' ' ' PRO . 0.8 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-O 121.096 0.474 . . . . 71.44 111.321 -175.437 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.511 -0.546 0 N-CA-C 108.544 -0.91 . . . . 64.32 108.544 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 5.4 mp -73.92 86.83 1.78 Allowed 'General case' 0 C--N 1.317 -0.816 0 O-C-N 123.244 0.34 . . . . 75.11 110.104 177.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.578 ' HA ' ' O ' ' B' ' 158' ' ' LYS . . . -91.58 97.61 11.15 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.414 -0.812 . . . . 75.52 109.561 174.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 151' ' ' PHE . . . . . 0.709 ' HB3' ' HA ' ' A' ' 41' ' ' PRO . 47.4 p90 -132.55 166.55 21.83 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.087 -0.506 . . . . 62.51 110.817 -176.692 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -94.23 114.03 26.06 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.133 -0.485 . . . . 73.45 110.053 178.422 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 153' ' ' CYS . . . . . 0.461 ' HB2' ' HE1' ' B' ' 151' ' ' PHE . 49.0 t -126.32 120.8 30.83 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.095 -0.502 . . . . 73.12 110.166 178.384 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 19.6 t70 70.48 6.0 5.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.875 -0.602 . . . . 55.44 111.789 170.388 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 111.19 -6.4 28.75 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.502 -0.856 . . . . 63.14 112.316 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 156' ' ' GLU . . . . . 0.523 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 12.6 pt-20 -120.91 145.74 47.36 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 110.023 -0.362 . . . . 74.31 110.023 177.542 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 42.5 mm -77.92 126.94 38.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 109.723 -0.473 . . . . 71.2 109.723 176.61 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 158' ' ' LYS . . . . . 0.578 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 29.1 mmmt -109.78 137.52 47.46 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.872 -0.418 . . . . 74.25 109.872 179.431 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.01 104.6 8.99 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 123.194 0.309 . . . . 73.34 110.791 178.443 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 160' ' ' PHE . . . . . 0.606 ' CD2' HD13 ' B' ' 166' ' ' LEU . 94.9 m-85 -117.11 122.62 44.62 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.782 -0.367 . . . . 72.44 111.017 178.666 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 10.5 p -92.81 -5.78 50.34 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.161 -0.472 . . . . 52.41 110.557 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -132.81 157.1 45.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.872 -0.604 . . . . 72.22 109.884 177.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -89.18 -16.84 30.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.274 -0.421 . . . . 63.43 111.055 -177.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 164' ' ' GLN . . . . . 0.413 ' O ' ' HG3' ' B' ' 168' ' ' LYS . 6.2 tp60 -67.94 -51.45 47.57 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.418 -0.355 . . . . 74.41 111.12 -176.573 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 165' ' ' SER . . . . . 0.951 ' HA ' ' HE3' ' B' ' 168' ' ' LYS . 11.5 t -69.6 -34.15 73.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.852 0.358 . . . . 71.0 110.38 -178.71 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 166' ' ' LEU . . . . . 0.606 HD13 ' CD2' ' B' ' 160' ' ' PHE . 33.5 tp -68.02 -35.13 77.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.975 0.416 . . . . 75.12 110.515 177.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -62.41 -37.07 84.37 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.11 -0.495 . . . . 71.43 110.464 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 168' ' ' LYS . . . . . 0.951 ' HE3' ' HA ' ' B' ' 165' ' ' SER . 9.2 mtmp? -67.19 -42.87 83.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.866 -0.606 . . . . 73.51 110.295 175.406 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 169' ' ' PHE . . . . . 0.441 ' HA ' ' HG2' ' B' ' 172' ' ' GLN . 63.9 t80 -64.89 -44.28 90.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.5 -0.773 . . . . 75.34 110.755 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -59.1 -31.36 68.85 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.156 -0.475 . . . . 62.43 110.93 177.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 26.3 t -72.34 -41.84 66.04 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.822 -0.626 . . . . 75.51 111.003 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 172' ' ' GLN . . . . . 0.441 ' HG2' ' HA ' ' B' ' 169' ' ' PHE . 19.2 pt20 -77.34 -22.64 51.54 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.952 0.406 . . . . 70.34 110.781 -176.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 173' ' ' LYS . . . . . 0.875 ' HE2' ' HA ' ' B' ' 173' ' ' LYS . 9.1 mmpt? -75.75 142.68 42.32 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.813 -0.44 . . . . 72.52 109.813 173.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 19.9 m -80.25 -42.46 23.14 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.749 -0.463 . . . . 62.4 109.749 177.437 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 175' ' ' SER . . . . . 0.53 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 47.4 m -69.49 -50.44 45.25 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.413 -0.358 . . . . 73.42 110.863 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.713 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 68.0 mtp -63.11 -27.66 69.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.201 -0.454 . . . . 74.35 112.064 -174.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? -62.36 -28.66 69.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.008 0.432 . . . . 74.0 110.691 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -100.63 1.04 40.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.281 0.562 . . . . 75.21 110.616 -176.06 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 179' ' ' LEU . . . . . 0.69 HD12 ' HA ' ' B' ' 176' ' ' MET . 77.2 mt -95.32 -55.67 2.97 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.419 -0.81 . . . . 63.13 109.832 178.291 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 180' ' ' LEU . . . . . 0.411 HD22 ' HB2' ' B' ' 179' ' ' LEU . 3.2 mm? -78.98 -6.65 56.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.378 -0.828 . . . . 65.5 111.881 -176.734 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -55.36 -19.22 8.29 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.436 0.532 . . . . 64.22 112.436 -176.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -60.23 -36.82 78.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.967 0.413 . . . . 63.13 111.125 179.059 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 13.2 m -123.06 -17.32 4.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.314 -0.403 . . . . 64.41 111.743 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 184' ' ' LEU . . . . . . . . . . . . . 10.2 mp . . . . . 0 C--N 1.327 -0.397 0 N-CA-C 109.723 -0.473 . . . . 60.4 109.723 177.993 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 12.8 p90 . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 114.461 1.282 . . . . 74.2 114.461 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.513 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 11.8 t30 -58.12 -45.09 87.89 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 122.317 0.247 . . . . 70.12 111.578 -175.359 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.472 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 44.4 mm -60.16 -41.16 85.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.033 0.444 . . . . 65.23 111.399 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.568 HD12 HD23 ' B' ' 149' ' ' LEU . 88.3 mt -68.37 -27.57 66.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.189 -0.46 . . . . 75.32 110.691 -178.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -74.07 -34.67 64.11 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.123 -0.49 . . . . 71.14 109.95 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.513 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 5.8 mm-40 -71.52 -27.65 63.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.127 0.489 . . . . 73.05 110.736 178.411 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -101.55 4.37 40.97 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.15 -0.477 . . . . 73.43 111.04 -178.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 60.18 43.99 13.35 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.603 -0.726 . . . . 75.13 112.361 174.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.546 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 11.8 m-85 -77.74 -12.81 60.01 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.122 0.487 . . . . 74.21 109.995 171.182 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 58.9 73.85 0.66 Allowed Pre-proline 0 C--O 1.236 0.345 0 CA-C-N 114.99 -1.005 . . . . 71.41 110.859 -174.632 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -81.44 148.62 16.43 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.513 2.142 . . . . 53.44 111.304 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.3 mptt . . . . . 0 C--N 1.323 -0.555 0 CA-C-O 121.133 0.492 . . . . 72.34 110.856 -177.954 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.575 0 N-CA-C 109.762 -0.458 . . . . 71.33 109.762 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.714 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.5 mp -67.92 88.42 0.26 Allowed 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.507 -0.769 . . . . 74.35 110.384 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.698 ' H ' ' HB2' ' B' ' 142' ' ' LYS . . . -85.17 58.05 4.81 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.851 -0.426 . . . . 44.21 109.851 176.113 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.714 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 51.5 p90 -86.02 162.55 18.43 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.982 -0.554 . . . . 61.44 110.731 -177.214 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.402 ' HD3' HD13 ' A' ' 57' ' ' ILE . 14.1 tptm -98.12 118.91 35.79 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.324 -0.853 . . . . 64.3 110.109 -176.587 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 46.5 t -120.18 99.89 6.86 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.917 0.389 . . . . 74.33 110.691 178.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 66.84 6.37 4.56 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.413 -0.812 . . . . 73.43 112.968 171.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 133.26 -27.58 3.4 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.403 -0.903 . . . . 71.24 112.636 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -107.86 139.33 42.62 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.253 0.549 . . . . 61.43 110.868 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.402 HD13 ' HD3' ' A' ' 52' ' ' LYS . 45.9 mm -77.37 123.41 33.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.473 -0.785 . . . . 73.12 109.939 178.199 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.42 ' HE2' ' CE1' ' A' ' 69' ' ' PHE . 30.9 mmmt -107.81 90.65 3.36 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 121.084 -0.246 . . . . 74.54 110.722 -177.736 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.58 110.09 7.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.33 -0.395 . . . . 61.21 111.572 -178.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -120.92 123.41 42.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.345 -0.388 . . . . 75.1 110.447 174.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 7.0 t -100.71 -4.31 28.48 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.396 0.617 . . . . 71.2 109.357 179.173 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -142.84 159.4 42.3 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.533 -0.758 . . . . 73.11 110.007 177.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 46.6 tp -87.14 -20.58 26.83 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.272 -0.422 . . . . 72.34 110.452 -175.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -61.6 -51.33 68.97 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.901 -0.591 . . . . 74.32 110.484 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.7 t -66.27 -36.82 83.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.818 -0.628 . . . . 63.21 110.429 178.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.469 ' O ' HD23 ' A' ' 66' ' ' LEU . 6.2 tt -66.1 -37.77 86.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.724 -0.671 . . . . 73.34 110.428 -178.213 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.851 ' HG3' HD21 ' A' ' 84' ' ' LEU . 55.3 ttp180 -57.65 -38.71 75.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 73.03 110.967 -179.614 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -63.39 -38.36 90.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 75.44 110.979 177.69 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.42 ' CE1' ' HE2' ' A' ' 58' ' ' LYS . 54.0 t80 -68.41 -47.86 66.17 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.082 -0.508 . . . . 73.24 110.554 -178.734 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.442 ' HA ' ' HB2' ' A' ' 73' ' ' LYS . . . -62.56 -28.74 70.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.828 0.347 . . . . 54.1 111.349 177.483 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 34.6 t -67.43 -31.15 71.14 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.143 -0.48 . . . . 62.33 111.084 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -100.76 6.71 43.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.353 0.597 . . . . 73.0 109.98 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.442 ' HB2' ' HA ' ' A' ' 70' ' ' ALA . 21.3 mmmt -112.54 102.9 10.96 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.369 -0.832 . . . . 63.43 110.584 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.484 ' O ' ' HB3' ' A' ' 77' ' ' LYS . 14.8 p -54.51 -38.74 66.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.331 -0.395 . . . . 62.41 111.591 -178.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.536 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 47.3 t -66.37 -49.61 66.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.796 0.331 . . . . 74.0 110.919 178.595 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 80.9 mtp -71.76 -22.22 61.63 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.931 0.396 . . . . 73.43 110.728 -175.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.484 ' HB3' ' O ' ' A' ' 74' ' ' SER . 29.3 tttp -53.82 -34.64 59.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.661 -0.699 . . . . 75.02 110.707 172.376 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.521 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 32.8 mm-40 -101.7 3.82 40.05 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.75 -0.659 . . . . 74.32 110.419 -175.385 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.582 HD22 ' ND2' ' B' ' 137' ' ' ASN . 53.2 mt -101.06 -47.26 4.81 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.17 -0.923 . . . . 71.54 109.168 175.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.0 mt -91.86 2.25 56.64 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.716 -0.675 . . . . 45.43 111.024 -175.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.521 ' HD2' ' HA ' ' A' ' 78' ' ' GLU . 20.8 ptmt -54.41 -20.72 8.0 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.146 -0.479 . . . . 61.22 112.278 178.125 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -82.27 -37.62 25.6 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.05 0.453 . . . . 65.31 110.945 178.723 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 24.3 t -79.75 -40.2 20.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.066 -0.515 . . . . 71.54 110.308 -178.46 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.851 HD21 ' HG3' ' A' ' 67' ' ' ARG . 10.6 mp . . . . . 0 C--N 1.324 -0.509 0 CA-C-N 115.843 -0.617 . . . . 62.4 110.5 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 131' ' ' PHE . . . . . 0.612 ' HB3' HD21 ' A' ' 49' ' ' LEU . 26.0 p90 . . . . . 0 N--CA 1.481 1.116 0 N-CA-C 113.92 1.081 . . . . 74.01 113.92 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 132' ' ' ASN . . . . . 0.4 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 44.7 t30 -56.58 -55.12 37.88 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.85 0.357 . . . . 73.51 111.324 -177.553 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 133' ' ' ILE . . . . . 0.527 HG21 ' HB3' ' A' ' 79' ' ' LEU . 49.1 mm -58.11 -41.42 80.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.002 -0.544 . . . . 71.25 111.247 -178.252 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.409 HD12 HD23 ' A' ' 49' ' ' LEU . 84.5 mt -63.65 -36.97 85.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.02 -0.536 . . . . 74.25 110.906 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -72.42 -38.89 68.27 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.653 -0.249 . . . . 60.14 110.488 179.099 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 136' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 28.7 mm-40 -64.31 -43.14 95.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.241 -0.436 . . . . 42.41 111.282 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 137' ' ' ASN . . . . . 0.582 ' ND2' HD22 ' A' ' 79' ' ' LEU . 92.1 m-20 -92.21 7.61 41.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.161 -0.472 . . . . 73.44 111.227 -178.366 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 55.63 57.91 4.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.408 -0.815 . . . . 72.5 112.96 174.607 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -82.97 -10.1 58.96 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.595 -0.891 . . . . 70.43 108.595 165.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 59.6 71.8 0.87 Allowed Pre-proline 0 C--O 1.234 0.274 0 CA-C-N 114.204 -1.362 . . . . 75.42 110.828 -176.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 141' ' ' PRO . . . . . 0.5 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 89.1 Cg_endo -79.95 144.94 17.34 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.508 2.139 . . . . 75.11 111.591 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 142' ' ' LYS . . . . . 0.698 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 13.9 mptt . . . . . 0 C--N 1.32 -0.684 0 CA-C-O 121.036 0.446 . . . . 70.54 110.448 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 148' ' ' LYS . . . . . 0.453 ' HB3' ' HB2' ' B' ' 161' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.49 0 N-CA-C 109.758 -0.46 . . . . 74.21 109.758 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.767 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.5 mp -74.14 86.67 1.89 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.597 -0.729 . . . . 74.01 110.359 -178.29 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.501 ' HB2' HG23 ' B' ' 159' ' ' THR . . . -85.19 62.34 7.44 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.014 -0.539 . . . . 75.12 109.649 174.701 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 151' ' ' PHE . . . . . 0.767 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 49.6 p90 -92.09 164.01 13.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.015 -0.539 . . . . 74.21 110.737 -175.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -92.08 117.38 29.79 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.704 -0.68 . . . . 75.02 110.794 -178.082 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 153' ' ' CYS . . . . . 0.617 ' HB3' ' CG ' ' B' ' 158' ' ' LYS . 50.8 t -131.56 116.96 18.1 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.541 -0.3 . . . . 54.42 110.889 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 67.71 11.53 8.41 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.674 -0.694 . . . . 71.53 112.408 175.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 110.06 -16.24 30.37 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.407 -0.901 . . . . 65.15 112.572 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 156' ' ' GLU . . . . . 0.479 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 9.6 pt-20 -116.42 143.98 44.88 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.841 0.353 . . . . 73.24 110.41 177.922 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 43.5 mm -70.59 118.69 15.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.209 -0.451 . . . . 75.31 110.045 177.208 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 158' ' ' LYS . . . . . 0.617 ' CG ' ' HB3' ' B' ' 153' ' ' CYS . 31.5 mmmt -104.08 88.31 2.98 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.945 -0.391 . . . . 70.33 109.945 -179.369 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 159' ' ' THR . . . . . 0.501 HG23 ' HB2' ' B' ' 150' ' ' ALA . 0.2 OUTLIER -75.63 110.19 9.83 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.892 -0.595 . . . . 70.43 111.461 -175.965 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -121.8 124.41 44.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.521 -0.308 . . . . 75.13 111.009 178.066 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 161' ' ' SER . . . . . 0.453 ' HB2' ' HB3' ' B' ' 148' ' ' LYS . 9.5 t -106.38 0.61 25.05 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.038 -0.727 . . . . 61.33 109.038 176.072 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -121.28 124.18 44.0 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.499 -0.773 . . . . 50.24 110.339 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 55.2 tp -68.56 -32.77 72.93 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.149 -0.686 . . . . 63.13 109.149 175.386 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -59.62 -50.32 74.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.333 -0.849 . . . . 71.43 110.922 176.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 32.3 t -67.54 -39.6 85.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.203 -0.453 . . . . 72.2 110.432 -178.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 166' ' ' LEU . . . . . 0.425 ' O ' HD23 ' B' ' 166' ' ' LEU . 4.1 tt -65.71 -36.46 83.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.07 -0.514 . . . . 35.54 110.294 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 167' ' ' ARG . . . . . 0.559 ' HG3' HD11 ' B' ' 184' ' ' LEU . 43.3 ttp180 -62.78 -34.88 78.17 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.249 0.547 . . . . 72.01 110.062 179.123 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -66.66 -38.56 87.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.818 -0.628 . . . . 45.3 110.458 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 169' ' ' PHE . . . . . 0.518 ' CZ ' ' HE3' ' B' ' 173' ' ' LYS . 69.8 t80 -67.05 -46.38 74.54 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.424 -0.807 . . . . 72.44 110.661 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.61 -26.67 68.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.504 -0.316 . . . . 53.32 111.428 179.304 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 8.6 t -64.98 -27.84 69.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.241 -0.436 . . . . 63.4 110.59 -178.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -106.08 15.98 25.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.248 0.547 . . . . 74.44 110.33 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 173' ' ' LYS . . . . . 0.518 ' HE3' ' CZ ' ' B' ' 169' ' ' PHE . 64.1 mmtt -117.3 115.63 25.64 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.612 -0.722 . . . . 74.44 110.427 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.2 p -57.7 -41.44 81.68 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.909 0.385 . . . . 72.33 111.869 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 175' ' ' SER . . . . . 0.526 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 45.7 t -82.04 -47.08 13.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.827 0.346 . . . . 72.11 110.325 -178.3 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.462 ' HB2' ' CB ' ' B' ' 173' ' ' LYS . 70.9 mtp -67.47 -25.85 66.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.454 -0.339 . . . . 64.41 111.866 -174.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 177' ' ' LYS . . . . . 0.49 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 26.0 ttpp -62.11 -35.09 77.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.842 0.353 . . . . 54.24 110.558 176.152 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 178' ' ' GLU . . . . . 0.602 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 18.8 mm-40 -89.71 -12.11 40.39 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-O 121.661 0.743 . . . . 74.22 109.88 -175.134 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 179' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' B' ' 175' ' ' SER . 74.7 mt -82.08 -47.82 12.13 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.767 -1.106 . . . . 63.33 109.173 175.714 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 7.5 mt -94.27 0.92 55.95 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.764 -0.653 . . . . 72.42 111.451 -173.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 181' ' ' LYS . . . . . 0.602 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 17.8 ptmt -58.6 -8.44 1.26 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 112.083 0.401 . . . . 74.3 112.083 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -68.29 -37.01 80.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.021 0.438 . . . . 74.1 110.411 175.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 183' ' ' VAL . . . . . 0.462 HG23 HD12 ' B' ' 184' ' ' LEU . 31.2 m -104.47 -15.29 8.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.15 -0.477 . . . . 62.41 111.198 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 184' ' ' LEU . . . . . 0.559 HD11 ' HG3' ' B' ' 167' ' ' ARG . 11.1 mp . . . . . 0 C--N 1.325 -0.488 0 N-CA-C 109.676 -0.49 . . . . 54.35 109.676 175.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.583 ' HB2' ' HB3' ' A' ' 41' ' ' PRO . 11.6 p90 . . . . . 0 CA--C 1.523 -0.081 0 CA-C-O 121.319 0.581 . . . . 52.33 109.536 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.526 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 9.4 t30 -64.87 -54.61 28.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.22 -0.9 . . . . 74.32 111.548 -170.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.486 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 47.7 mm -57.32 -41.67 78.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 CA-C-O 121.03 0.443 . . . . 72.13 111.377 -176.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.849 HD12 HD21 ' B' ' 149' ' ' LEU . 80.0 mt -66.59 -37.38 84.79 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.0 -0.545 . . . . 75.32 110.646 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 35' ' ' ARG . 20.5 ttt85 -64.47 -40.56 95.93 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.202 -0.454 . . . . 74.12 110.687 178.233 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 4.6 mm-40 -72.0 -27.59 62.84 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.991 -0.549 . . . . 74.42 111.671 -177.019 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -100.9 4.29 42.54 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.877 0.37 . . . . 70.11 111.034 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 22.2 t70 61.66 69.68 0.63 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.406 -0.815 . . . . 61.34 111.487 177.214 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.566 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 7.6 m-85 -107.22 -7.39 16.8 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.231 -0.895 . . . . 65.05 109.882 172.676 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 68.51 93.73 0.05 OUTLIER Pre-proline 0 C--O 1.232 0.173 0 CA-C-N 114.81 -1.086 . . . . 64.05 111.128 -177.487 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.583 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 67.5 Cg_endo -75.29 166.27 29.19 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.774 2.316 . . . . 75.42 111.444 175.412 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.743 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 13.9 tptt . . . . . 0 C--N 1.327 -0.399 0 C-N-CA 119.596 -0.842 . . . . 75.4 112.63 -177.614 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.428 ' O ' ' HB3' ' B' ' 142' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.509 -0.622 0 N-CA-C 109.02 -0.733 . . . . 75.52 109.02 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.832 HD21 HD12 ' B' ' 134' ' ' LEU . 41.2 tp -75.25 87.96 2.51 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.282 0.563 . . . . 52.41 110.384 -175.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 1.003 ' HB2' HG23 ' A' ' 59' ' ' THR . . . -97.14 96.36 8.39 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.03 -0.986 . . . . 65.22 110.216 177.324 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.421 ' HB2' ' HB3' ' B' ' 139' ' ' PHE . 53.7 p90 -111.81 167.61 10.23 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.071 -0.513 . . . . 70.03 110.289 -179.644 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -97.03 122.91 40.54 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.304 -0.407 . . . . 61.22 111.031 -178.051 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 46.0 t -132.95 107.5 8.32 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.164 -0.471 . . . . 72.22 110.0 176.108 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 68.07 23.61 8.03 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.284 0.476 . . . . 74.45 112.284 174.294 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 104.25 -19.03 44.08 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.277 -0.963 . . . . 62.44 112.428 177.167 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.468 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 9.7 pt-20 -108.4 138.96 43.83 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.183 0.515 . . . . 74.25 110.723 179.13 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.0 mm -77.31 124.22 35.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.738 -0.665 . . . . 74.13 109.6 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.468 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 26.2 mmmt -103.78 90.57 3.68 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.816 -0.438 . . . . 63.23 109.816 -179.731 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' THR . . . . . 1.003 HG23 ' HB2' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -81.39 105.64 12.73 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.927 -0.579 . . . . 71.1 111.309 -177.784 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -110.48 133.11 53.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.304 -0.407 . . . . 72.1 110.805 178.098 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.3 p -79.63 -18.69 50.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.946 -0.57 . . . . 64.21 111.443 -178.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -152.95 172.71 16.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.167 -0.47 . . . . 53.34 110.588 -178.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -84.88 -12.59 53.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.111 -0.495 . . . . 75.53 111.612 -176.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -74.97 -42.66 57.16 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.975 -0.75 . . . . 71.44 108.975 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.584 ' HA ' ' HE2' ' A' ' 68' ' ' LYS . 15.0 m -65.99 -37.07 85.02 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.407 -0.815 . . . . 75.14 110.137 177.159 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.525 HD11 HD11 ' B' ' 134' ' ' LEU . 6.0 tt -68.19 -38.3 81.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.82 -0.627 . . . . 74.21 109.784 178.206 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.667 ' HG3' HD22 ' A' ' 84' ' ' LEU . 54.8 ttp180 -51.41 -38.76 55.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.076 -0.965 . . . . 75.24 111.02 -179.275 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.584 ' HE2' ' HA ' ' A' ' 65' ' ' SER . 49.8 mtmt -64.94 -51.36 62.27 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.72 -0.673 . . . . 72.1 110.785 178.346 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -64.52 -42.11 95.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.353 -0.839 . . . . 62.25 111.36 -175.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.19 -33.1 75.2 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.207 -0.451 . . . . 73.21 111.234 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.1 m -74.38 -22.73 59.05 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.673 0.273 . . . . 74.13 111.374 -178.355 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -98.83 5.98 47.12 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.283 0.563 . . . . 53.31 110.459 177.257 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.7 mmmt -108.0 109.41 20.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.421 -0.809 . . . . 71.32 109.334 172.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.0 p -51.18 -35.98 38.89 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.469 0.544 . . . . 75.35 112.469 -174.283 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 41.2 t -78.13 -56.35 4.54 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.674 0.274 . . . . 65.03 110.807 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 78.0 mtp -64.24 -21.38 66.56 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.871 0.367 . . . . 64.41 111.513 -174.377 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.406 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 88.5 tttt -59.6 -25.64 64.79 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.845 -0.616 . . . . 74.31 111.106 179.253 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.518 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 32.4 mt-10 -104.93 5.49 32.85 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.233 0.54 . . . . 74.02 110.629 -178.79 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.538 ' HB3' HG21 ' B' ' 133' ' ' ILE . 10.6 mp -91.55 -52.09 4.94 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.42 -0.809 . . . . 63.2 109.447 173.769 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -81.2 -10.48 59.61 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.511 -0.768 . . . . 61.34 111.256 -176.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.518 ' HD3' ' HA ' ' A' ' 78' ' ' GLU . 64.8 pttt -59.83 -18.46 44.09 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 111.975 0.361 . . . . 63.31 111.975 -176.088 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -66.2 -36.51 83.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.968 0.413 . . . . 70.33 110.636 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 29.2 m -110.12 4.34 8.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.239 0.543 . . . . 74.33 110.45 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.667 HD22 ' HG3' ' A' ' 67' ' ' ARG . 45.0 tp . . . . . 0 C--N 1.324 -0.518 0 CA-C-N 115.599 -0.728 . . . . 74.1 110.661 -175.155 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 10.7 p90 . . . . . 0 CA--C 1.534 0.339 0 N-CA-C 111.93 0.345 . . . . 63.22 111.93 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 132' ' ' ASN . . . . . 0.465 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 64.4 t30 -57.97 -53.73 54.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.028 0.442 . . . . 71.33 110.617 -176.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 133' ' ' ILE . . . . . 0.538 HG21 ' HB3' ' A' ' 79' ' ' LEU . 49.1 mm -60.55 -43.71 95.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.787 -0.642 . . . . 73.04 111.549 -177.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.832 HD12 HD21 ' A' ' 49' ' ' LEU . 80.8 mt -67.46 -24.3 65.6 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.263 -0.426 . . . . 75.05 111.266 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -73.63 -46.05 49.19 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.122 0.486 . . . . 61.3 110.062 177.537 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 136' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 26.7 mm-40 -65.45 -33.24 75.49 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.472 -0.785 . . . . 75.34 110.97 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -99.04 5.56 47.02 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.546 -0.297 . . . . 61.43 111.432 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 52.37 70.59 0.55 Allowed 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.55 0.944 . . . . 64.34 113.55 175.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 139' ' ' PHE . . . . . 0.447 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 28.1 m-85 -99.77 0.99 42.78 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.832 -0.622 . . . . 74.43 109.645 169.133 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 61.75 89.94 0.1 OUTLIER Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 114.842 -1.072 . . . . 74.13 111.472 -173.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 141' ' ' PRO . . . . . 0.417 ' HA ' ' CD1' ' A' ' 49' ' ' LEU . 22.4 Cg_exo -65.94 143.54 73.2 Favored 'Trans proline' 0 N--CA 1.463 -0.318 0 C-N-CA 122.632 2.221 . . . . 74.02 110.695 172.002 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 142' ' ' LYS . . . . . 0.708 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 17.2 tptt . . . . . 0 C--N 1.327 -0.406 0 C-N-CA 119.658 -0.817 . . . . 73.11 111.652 -176.098 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 148' ' ' LYS . . . . . 0.59 ' HB3' ' HA ' ' B' ' 161' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.499 0 N-CA-C 109.553 -0.536 . . . . 74.22 109.553 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.849 HD21 HD12 ' A' ' 34' ' ' LEU . 39.1 tp -76.03 98.18 4.24 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.243 -0.89 . . . . 73.43 110.743 -173.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.976 ' HB2' HG23 ' B' ' 159' ' ' THR . . . -102.25 102.45 12.85 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.112 -0.949 . . . . 62.21 110.213 177.021 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 151' ' ' PHE . . . . . 0.58 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 37.6 p90 -125.89 166.65 16.5 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.84 -0.618 . . . . 60.24 110.13 -178.847 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -87.04 115.52 24.48 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.183 0.516 . . . . 74.25 110.802 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 153' ' ' CYS . . . . . 0.493 ' HB3' ' CG ' ' B' ' 158' ' ' LYS . 45.7 t -134.13 122.86 23.48 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.845 -0.616 . . . . 75.33 110.183 177.239 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.1 t70 70.23 8.63 6.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.233 -0.894 . . . . 72.3 111.956 174.081 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 111.53 -9.11 28.32 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.267 -0.968 . . . . 22.24 112.959 176.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -124.24 160.99 26.73 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.673 -0.491 . . . . 75.23 109.673 175.214 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 47.2 mm -80.12 119.53 29.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.737 -0.468 . . . . 71.1 109.737 175.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 158' ' ' LYS . . . . . 0.493 ' CG ' ' HB3' ' B' ' 153' ' ' CYS . 30.7 mmmt -98.39 98.32 9.56 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.876 -0.416 . . . . 63.41 109.876 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 159' ' ' THR . . . . . 0.976 HG23 ' HB2' ' B' ' 150' ' ' ALA . 0.2 OUTLIER -84.06 102.78 12.76 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.268 -0.424 . . . . 71.53 110.997 179.83 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -99.6 114.59 27.72 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.348 -0.387 . . . . 71.41 110.85 178.071 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 161' ' ' SER . . . . . 0.59 ' HA ' ' HB3' ' B' ' 148' ' ' LYS . 5.3 p -76.69 -33.46 58.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.976 -0.557 . . . . 64.31 110.167 176.098 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -116.37 149.5 39.25 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.604 -0.726 . . . . 72.41 109.684 176.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -90.19 -9.21 48.96 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.13 0.49 . . . . 74.4 110.327 -178.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -63.93 -49.6 71.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.629 -0.714 . . . . 75.31 110.183 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 10.7 m -66.43 -36.1 81.96 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.88 -0.6 . . . . 72.01 110.753 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 3.9 tt -60.29 -43.36 96.34 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.069 0.461 . . . . 61.34 110.131 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 15.9 ttp180 -60.83 -23.38 65.05 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.373 -0.83 . . . . 64.42 110.899 -175.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -88.32 -43.24 11.68 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.184 0.516 . . . . 62.52 110.207 176.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 169' ' ' PHE . . . . . 0.43 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 59.1 t80 -62.81 -39.3 93.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.39 -0.823 . . . . 75.42 111.051 -178.032 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -67.1 -29.09 68.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.059 -0.519 . . . . 53.41 111.532 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 22.9 t -75.6 -32.61 60.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.758 0.314 . . . . 73.3 111.112 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -82.79 -16.09 49.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.907 0.385 . . . . 71.51 110.651 179.288 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 173' ' ' LYS . . . . . 0.409 ' HA ' ' HD2' ' B' ' 173' ' ' LYS . 25.7 mmmt -81.31 117.92 22.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.225 -0.443 . . . . 74.44 110.281 174.863 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.1 p -54.16 -44.84 71.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.129 -0.487 . . . . 73.32 111.89 -178.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 4.5 p -71.45 -50.73 28.82 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.957 -0.565 . . . . 74.44 111.658 -178.146 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 82.3 mtp -73.61 -16.77 61.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.321 -0.4 . . . . 51.4 112.077 -172.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 177' ' ' LYS . . . . . 0.441 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 47.4 tttp -62.8 -26.11 68.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.307 -0.406 . . . . 73.41 110.91 -178.197 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 178' ' ' GLU . . . . . 0.402 ' HA ' ' HD3' ' B' ' 181' ' ' LYS . 5.1 mm-40 -94.33 -8.19 39.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.434 0.635 . . . . 72.24 109.917 -176.295 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 179' ' ' LEU . . . . . 0.486 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 11.2 mp -87.64 -54.88 4.04 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.029 -0.987 . . . . 74.04 109.844 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -81.03 -14.25 58.06 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.207 -0.906 . . . . 73.04 112.19 -173.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 181' ' ' LYS . . . . . 0.446 ' HA ' ' O ' ' B' ' 184' ' ' LEU . 64.9 pttt -57.46 -19.2 22.63 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.347 0.499 . . . . 71.11 112.347 -176.646 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -58.51 -36.39 73.73 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.061 0.458 . . . . 65.11 110.783 177.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 26.9 m -119.32 11.77 6.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.223 0.535 . . . . 74.05 110.367 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 184' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' B' ' 181' ' ' LYS . 55.6 tp . . . . . 0 C--N 1.323 -0.548 0 CA-C-N 115.736 -0.666 . . . . 73.1 110.534 -175.171 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.406 ' HB3' HD11 ' B' ' 149' ' ' LEU . 22.1 p90 . . . . . 0 CA--C 1.534 0.347 0 CA-C-O 120.991 0.424 . . . . 74.05 111.185 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.525 ' O ' ' HB3' ' A' ' 35' ' ' ARG . 48.6 t30 -60.17 -51.13 70.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.703 -0.68 . . . . 70.55 111.368 -174.517 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.502 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 48.5 mm -58.78 -47.54 88.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.167 -0.469 . . . . 72.11 111.469 -177.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.1 mt -60.3 -35.45 75.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.007 0.432 . . . . 63.33 110.746 177.329 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.525 ' HB3' ' O ' ' A' ' 32' ' ' ASN . 23.4 ttt-85 -62.38 -49.94 73.53 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.637 -0.711 . . . . 73.34 110.374 176.477 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 15.9 mm-40 -66.67 -31.95 72.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.672 -0.695 . . . . 65.34 111.898 -176.262 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -98.04 3.62 49.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.771 0.319 . . . . 73.22 111.159 -177.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 38.2 t70 57.73 62.06 2.22 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.592 0.711 . . . . 73.11 111.929 175.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.417 ' HB3' ' HB2' ' B' ' 151' ' ' PHE . 23.4 m-85 -89.3 -3.33 58.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.816 -0.629 . . . . 75.51 110.534 170.258 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 61.06 67.28 1.47 Allowed Pre-proline 0 CA--C 1.534 0.333 0 CA-C-N 115.624 -0.716 . . . . 75.02 110.029 -173.167 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -80.65 168.88 17.4 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.535 2.157 . . . . 65.42 111.583 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.508 ' HE2' ' HB3' ' B' ' 150' ' ' ALA . 10.7 mptt . . . . . 0 C--N 1.321 -0.673 0 C-N-CA 120.431 -0.508 . . . . 74.24 110.866 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.575 0 CA-C-O 121.042 0.448 . . . . 73.13 110.073 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.668 ' HB3' ' HD1' ' A' ' 51' ' ' PHE . 10.6 mp -76.09 88.51 3.01 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.719 -0.673 . . . . 71.42 109.868 178.29 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.08 59.71 4.59 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.156 0.503 . . . . 65.1 109.683 175.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.668 ' HD1' ' HB3' ' A' ' 49' ' ' LEU . 52.5 p90 -90.5 166.96 12.94 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.993 -0.548 . . . . 64.33 110.203 -175.364 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -100.41 123.31 44.47 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 120.981 0.419 . . . . 73.44 110.697 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.645 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 52.9 t -125.77 112.32 15.92 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.726 -0.67 . . . . 71.14 109.577 176.88 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 68.04 21.27 8.84 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.862 -0.608 . . . . 72.22 111.39 177.352 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 107.8 -32.75 6.82 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.75 -0.738 . . . . 63.42 112.433 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.4 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 10.6 pt-20 -98.37 143.87 28.37 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.073 0.463 . . . . 64.12 110.8 -176.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.2 mm -74.5 118.32 20.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.027 -0.533 . . . . 74.31 110.289 178.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.412 ' HG2' ' HB3' ' A' ' 53' ' ' CYS . 29.9 mmmt -106.17 107.72 18.87 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.198 -0.667 . . . . 71.4 109.198 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.535 ' HA ' ' O ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -98.51 112.92 24.8 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.061 -0.518 . . . . 74.33 111.919 -171.178 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -128.56 139.18 52.43 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.246 -0.433 . . . . 73.34 110.2 177.267 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 65.4 p -104.21 -16.69 15.13 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.121 0.486 . . . . 62.21 110.1 176.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -127.16 150.14 49.64 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.813 -0.63 . . . . 71.22 111.237 -176.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.0 mt -67.92 -23.39 65.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.712 -0.677 . . . . 75.43 110.477 177.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -60.63 -48.8 80.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.093 0.473 . . . . 74.54 110.55 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 9.9 m -68.11 -41.92 81.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.892 -0.594 . . . . 61.13 110.705 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.4 tp -65.28 -36.11 83.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.941 -0.572 . . . . 74.15 110.648 -178.564 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.745 ' HG2' HD11 ' A' ' 84' ' ' LEU . 62.8 mtt180 -53.77 -49.51 68.08 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.222 -0.445 . . . . 73.15 111.806 178.795 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 40.7 mtmt -73.06 -28.9 62.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.994 -0.548 . . . . 54.42 111.353 -173.498 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.504 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 81.5 t80 -79.21 -43.48 23.77 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.869 0.366 . . . . 72.53 110.658 178.747 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.18 -32.28 73.89 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.416 -0.356 . . . . 72.34 111.61 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.0 p -75.88 -15.5 60.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.555 -0.293 . . . . 70.13 111.624 -178.025 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 19.4 pt20 -102.1 -2.12 30.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.183 0.516 . . . . 75.32 110.106 176.342 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.645 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 30.2 mmmt -98.49 120.01 38.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.842 -0.617 . . . . 74.45 110.36 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.2 p -58.85 -40.52 84.53 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.349 -0.387 . . . . 50.01 111.299 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.0 m -77.43 -31.89 54.23 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.033 -0.53 . . . . 52.35 111.74 -177.425 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.452 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 80.0 mtp -94.42 -10.93 30.92 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.862 0.319 . . . . 72.45 111.862 -174.344 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -59.28 -37.31 77.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.048 0.451 . . . . 72.55 111.421 -176.425 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.461 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 61.9 mm-40 -96.69 5.07 51.4 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.3 0.571 . . . . 61.44 110.548 -175.396 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.554 ' HB3' HG21 ' B' ' 133' ' ' ILE . 53.6 mt -95.63 -52.29 4.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.172 -0.922 . . . . 74.43 109.687 177.133 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.416 ' HB3' HD13 ' A' ' 84' ' ' LEU . 4.2 mm? -85.7 -4.81 59.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.529 -0.76 . . . . 71.03 111.808 -176.482 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.461 ' HD2' ' HA ' ' A' ' 78' ' ' GLU . 18.4 ptmt -54.68 -18.09 4.17 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.854 0.359 . . . . 74.4 111.63 177.491 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -69.12 -44.28 72.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.393 -0.367 . . . . 64.45 111.386 179.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.603 HG23 HD12 ' A' ' 84' ' ' LEU . 16.1 m -100.46 5.28 10.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-O 120.878 0.37 . . . . 65.11 111.865 -176.02 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.745 HD11 ' HG2' ' A' ' 67' ' ' ARG . 8.2 mp . . . . . 0 C--N 1.321 -0.669 0 N-CA-C 108.895 -0.78 . . . . 64.0 108.895 172.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 20.0 p90 . . . . . 0 N--CA 1.478 0.957 0 N-CA-C 113.881 1.067 . . . . 72.14 113.881 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 132' ' ' ASN . . . . . 0.499 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 52.0 t30 -55.12 -58.04 9.3 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.746 0.308 . . . . 65.3 111.632 -173.506 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 133' ' ' ILE . . . . . 0.554 HG21 ' HB3' ' A' ' 79' ' ' LEU . 49.5 mm -57.36 -42.54 80.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.183 0.516 . . . . 74.52 111.108 -178.128 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.556 HD12 HD23 ' A' ' 49' ' ' LEU . 86.2 mt -67.63 -26.52 66.28 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.052 -0.522 . . . . 52.1 111.35 -177.511 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 46.1 ttt180 -71.73 -46.44 58.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.998 0.428 . . . . 75.43 109.942 175.375 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 136' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 16.8 mm-40 -63.05 -27.08 69.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.51 -0.768 . . . . 75.45 111.358 -177.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -106.17 3.36 27.84 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.411 -0.359 . . . . 70.0 111.305 -177.4 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 32.9 t70 55.37 65.61 1.44 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.562 0.696 . . . . 55.04 111.887 177.646 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -94.03 6.3 48.97 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.827 -0.624 . . . . 71.21 111.025 172.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 58.44 66.26 2.67 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 116.004 -0.544 . . . . 65.41 110.485 -175.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 141' ' ' PRO . . . . . 0.407 ' C ' ' HD2' ' B' ' 142' ' ' LYS . 85.7 Cg_endo -86.76 156.82 8.89 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.772 2.314 . . . . 74.21 112.691 -176.581 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 142' ' ' LYS . . . . . 0.407 ' HD2' ' C ' ' B' ' 141' ' ' PRO . 12.7 mptt . . . . . 0 C--N 1.328 -0.347 0 CA-C-O 120.942 0.401 . . . . 62.32 110.95 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 148' ' ' LYS . . . . . 0.515 ' HD3' HG22 ' B' ' 159' ' ' THR . 0.1 OUTLIER . . . . . 0 CA--C 1.51 -0.573 0 N-CA-C 107.304 -1.369 . . . . 64.43 107.304 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.581 ' O ' ' HA ' ' B' ' 159' ' ' THR . 2.6 mm? -65.23 93.95 0.14 Allowed 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.49 -0.484 . . . . 75.12 110.719 -175.418 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.546 ' HA ' ' O ' ' B' ' 158' ' ' LYS . . . -103.27 75.92 1.39 Allowed 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.014 -0.994 . . . . 73.34 108.75 176.112 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 151' ' ' PHE . . . . . 0.55 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 46.2 p90 -110.64 164.5 12.67 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.274 -0.876 . . . . 74.44 110.575 -173.686 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -101.73 116.26 32.34 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.049 0.452 . . . . 73.34 111.011 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 153' ' ' CYS . . . . . 0.668 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 49.2 t -112.32 107.7 16.63 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.84 -0.618 . . . . 64.54 109.66 178.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 66.92 6.72 4.83 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 116.093 -0.503 . . . . 73.33 111.883 176.777 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 126.56 -29.98 4.35 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.724 -0.75 . . . . 51.25 112.442 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 156' ' ' GLU . . . . . 0.592 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 14.1 pt-20 -91.89 140.37 29.74 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 122.682 -0.304 . . . . 63.03 110.262 -178.194 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 44.9 mm -83.38 123.83 39.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.879 0.371 . . . . 63.44 110.103 177.739 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 158' ' ' LYS . . . . . 0.592 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 27.0 mmmt -106.35 148.06 28.5 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.149 -0.686 . . . . 61.31 109.149 179.511 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 159' ' ' THR . . . . . 0.581 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.0 OUTLIER -130.46 124.87 33.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.049 0.452 . . . . 71.53 111.584 178.449 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 160' ' ' PHE . . . . . 0.412 ' CD2' HD13 ' B' ' 166' ' ' LEU . 90.1 m-85 -132.68 126.84 33.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.587 -0.733 . . . . 74.34 110.405 176.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.7 -23.1 62.41 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.976 -0.557 . . . . 71.41 111.495 -179.09 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -150.97 177.25 10.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.851 0.358 . . . . 53.45 110.471 175.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 76.3 mt -86.65 -7.56 58.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.881 -0.6 . . . . 65.31 111.736 -175.047 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 164' ' ' GLN . . . . . 0.501 ' OE1' ' HD3' ' B' ' 167' ' ' ARG . 5.7 tp-100 -78.59 -40.11 35.53 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.991 -0.744 . . . . 75.32 108.991 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 22.5 t -67.79 -39.24 84.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.435 -0.802 . . . . 73.12 110.014 175.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 166' ' ' LEU . . . . . 0.412 HD13 ' CD2' ' B' ' 160' ' ' PHE . 53.0 tp -68.06 -29.87 68.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.875 -0.602 . . . . 75.14 110.476 177.756 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 167' ' ' ARG . . . . . 0.501 ' HD3' ' OE1' ' B' ' 164' ' ' GLN . 58.5 ttt180 -60.46 -28.05 68.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.992 -0.549 . . . . 74.13 110.908 178.565 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -79.89 -26.37 40.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.142 -0.481 . . . . 60.12 111.175 177.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -88.3 -42.37 12.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.159 -0.473 . . . . 61.44 110.834 -176.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.64 -23.06 67.14 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.092 -0.504 . . . . 74.21 111.535 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 3.1 p -81.14 -26.28 36.24 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.409 -0.36 . . . . 44.34 111.826 -178.348 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -92.73 -14.63 27.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.041 0.448 . . . . 61.21 110.526 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 173' ' ' LYS . . . . . 0.668 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 29.4 mmmt -85.56 117.34 24.4 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.01 -0.541 . . . . 55.21 109.822 175.774 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 11.2 m -59.67 -35.97 75.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.883 0.373 . . . . 63.21 111.449 -175.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 7.0 p -76.51 -47.83 21.48 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.269 -0.423 . . . . 31.11 111.102 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.486 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 82.3 mtp -72.31 -18.79 61.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.828 0.347 . . . . 65.44 111.293 -176.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 177' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' B' ' 173' ' ' LYS . 84.0 tttt -58.75 -41.59 86.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.904 -0.589 . . . . 71.21 111.28 -177.769 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 178' ' ' GLU . . . . . 0.615 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 9.2 mm-40 -89.23 -6.76 56.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.601 0.715 . . . . 70.12 109.647 -174.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 179' ' ' LEU . . . . . 0.502 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 64.3 mt -82.77 -43.1 17.15 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.051 -0.977 . . . . 72.11 109.971 177.129 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 180' ' ' LEU . . . . . 0.649 ' HB3' HD13 ' B' ' 184' ' ' LEU . 4.3 mm? -95.89 -9.78 30.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.872 -0.604 . . . . 55.14 112.102 -174.612 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 181' ' ' LYS . . . . . 0.615 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 17.5 ptmt -56.5 -20.93 22.61 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.841 0.682 . . . . 30.04 112.841 -175.61 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -68.66 -40.16 80.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.989 0.423 . . . . 75.53 111.252 179.295 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 26.3 m -103.07 -15.58 7.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.081 -0.508 . . . . 75.02 111.537 -176.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 184' ' ' LEU . . . . . 0.649 HD13 ' HB3' ' B' ' 180' ' ' LEU . 9.9 mp . . . . . 0 C--N 1.325 -0.457 0 N-CA-C 109.654 -0.498 . . . . 61.13 109.654 175.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.604 ' HB3' HD11 ' B' ' 149' ' ' LEU . 26.1 p90 . . . . . 0 C--O 1.233 0.188 0 CA-C-O 120.76 0.314 . . . . 70.15 110.806 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.552 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 8.8 t30 -60.54 -46.1 91.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.063 -0.517 . . . . 70.31 110.156 178.45 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.518 HG21 ' HB3' ' B' ' 179' ' ' LEU . 45.2 mm -62.66 -35.98 73.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-O 121.22 0.534 . . . . 64.53 110.439 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 72.0 mt -64.36 -39.18 93.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.758 -0.655 . . . . 63.12 110.225 178.014 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 57.3 ttt85 -69.51 -40.95 76.66 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.099 -0.501 . . . . 73.25 110.858 178.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.552 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 5.5 mm-40 -64.48 -31.08 72.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.831 0.348 . . . . 72.11 111.406 -178.681 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -100.52 1.35 40.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.02 0.438 . . . . 43.44 110.824 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 58.79 58.15 3.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.128 -0.942 . . . . 63.13 112.259 177.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -84.18 -2.86 57.62 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.478 -0.783 . . . . 65.33 109.388 169.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 60.68 75.09 0.48 Allowed Pre-proline 0 C--O 1.234 0.252 0 CA-C-N 114.912 -1.04 . . . . 74.23 111.114 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -82.54 159.21 16.86 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.632 2.222 . . . . 74.44 111.214 176.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.748 ' HD3' ' HB3' ' B' ' 150' ' ' ALA . 3.6 mptp? . . . . . 0 C--N 1.325 -0.477 0 N-CA-C 112.418 0.525 . . . . 74.24 112.418 -177.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.488 ' O ' ' HB3' ' B' ' 142' ' ' LYS . 1.7 mptp? . . . . . 0 N--CA 1.446 -0.659 0 N-CA-C 108.471 -0.937 . . . . 75.43 108.471 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.568 HD21 ' HB3' ' B' ' 131' ' ' PHE . 21.0 tp -92.92 23.27 4.3 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 109.52 -0.548 . . . . 73.12 109.52 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.673 ' HB3' ' HD3' ' B' ' 142' ' ' LYS . . . -34.3 103.7 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 O-C-N 124.553 1.158 . . . . 64.15 112.895 -173.035 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.743 ' HB3' ' HA ' ' B' ' 141' ' ' PRO . 46.8 p90 -132.09 172.04 12.87 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.086 -0.961 . . . . 61.23 109.969 -178.168 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -101.46 115.11 29.77 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.277 0.56 . . . . 72.24 110.871 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.523 ' O ' ' HG2' ' A' ' 56' ' ' GLU . 41.9 t -112.31 99.84 8.33 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.432 -0.804 . . . . 61.05 110.454 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.6 t70 64.61 15.34 9.63 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.449 0.642 . . . . 73.42 110.817 176.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.17 -35.41 3.11 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.788 -0.72 . . . . 65.32 112.801 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.771 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 13.4 pt-20 -88.72 133.31 34.26 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.712 0.292 . . . . 75.12 110.902 -176.719 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.401 ' HA ' ' O ' ' A' ' 51' ' ' PHE . 47.9 mm -80.91 120.37 32.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 109.24 -0.652 . . . . 74.53 109.24 176.495 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.771 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 28.9 mmmt -111.2 112.27 23.93 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.932 0.396 . . . . 75.2 111.509 -173.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.468 HG22 ' HB2' ' A' ' 50' ' ' ALA . 1.0 OUTLIER -88.88 104.09 16.61 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.964 -0.562 . . . . 63.3 110.488 172.818 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.503 ' CD2' HD13 ' A' ' 66' ' ' LEU . 21.4 m-85 -120.32 142.74 48.84 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.054 -0.521 . . . . 75.23 110.953 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 32.9 p -137.05 -14.26 1.57 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.149 -0.932 . . . . 60.25 109.667 173.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.46 ' HB2' ' OG ' ' A' ' 65' ' ' SER . 9.3 m-20 -98.97 157.71 16.14 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.651 -0.704 . . . . 71.42 109.265 177.323 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.5 mp -92.72 -39.5 11.22 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.919 -0.4 . . . . 73.03 109.919 177.15 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -55.03 -43.83 74.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.895 -0.593 . . . . 74.3 111.408 178.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.46 ' OG ' ' HB2' ' A' ' 62' ' ' ASP . 16.9 p -65.42 -52.01 56.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.849 0.357 . . . . 63.11 110.891 -179.218 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.503 HD13 ' CD2' ' A' ' 60' ' ' PHE . 63.1 tp -63.47 -34.14 77.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.04 -0.527 . . . . 60.34 110.705 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.456 ' HG3' HD21 ' A' ' 84' ' ' LEU . 20.3 ttt180 -60.81 -40.16 91.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.786 -0.643 . . . . 74.44 110.297 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.405 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 46.1 mtmt -71.97 -45.11 62.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.99 -0.55 . . . . 74.22 110.737 174.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -58.89 -49.76 76.57 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.795 -0.639 . . . . 75.45 110.949 -175.057 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.404 ' CB ' HD12 ' A' ' 80' ' ' LEU . . . -57.57 -38.18 74.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.876 0.37 . . . . 63.52 111.501 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 42.9 m -70.77 -30.52 67.03 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.27 -0.423 . . . . 72.45 111.462 -177.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 13.1 pt20 -97.12 12.14 33.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.209 0.528 . . . . 74.22 110.662 178.214 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.445 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 26.2 mmmt -119.07 114.84 23.12 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.83 -0.623 . . . . 72.33 110.086 175.876 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.5 m -58.59 -33.42 69.96 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.247 0.546 . . . . 73.43 110.545 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 12.1 m -78.54 -23.64 46.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.884 -0.598 . . . . 73.33 111.974 -176.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.447 ' HG3' ' SG ' ' A' ' 53' ' ' CYS . 46.6 mtp -104.94 -18.28 14.24 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.792 0.664 . . . . 61.1 112.792 -176.249 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.559 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 81.8 tttt -72.92 -17.37 61.5 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.264 0.554 . . . . 73.33 110.208 -176.385 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.572 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 56.5 mm-40 -102.66 4.11 37.86 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.512 -0.767 . . . . 65.33 109.665 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.597 ' HB3' HG21 ' B' ' 133' ' ' ILE . 71.8 mt -100.61 -44.48 5.83 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.15 -0.932 . . . . 72.02 109.657 175.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.404 HD12 ' CB ' ' A' ' 70' ' ' ALA . 7.9 mt -97.09 0.02 47.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.862 -0.608 . . . . 74.01 110.691 -175.375 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.572 ' HD3' ' HA ' ' A' ' 78' ' ' GLU . 64.4 pttt -56.61 -22.69 35.69 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.195 -0.457 . . . . 74.12 111.781 178.615 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -75.73 -56.58 4.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.914 0.387 . . . . 73.45 110.879 178.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 29.8 m -80.64 -20.47 11.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.076 -0.511 . . . . 73.03 112.184 -172.515 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.456 HD21 ' HG3' ' A' ' 67' ' ' ARG . 10.7 mp . . . . . 0 C--N 1.326 -0.449 0 N-CA-C 109.222 -0.658 . . . . 62.24 109.222 172.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 131' ' ' PHE . . . . . 0.568 ' HB3' HD21 ' A' ' 49' ' ' LEU . 33.5 p90 . . . . . 0 C--O 1.23 0.076 0 N-CA-C 111.841 0.311 . . . . 74.14 111.841 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -63.77 -37.42 87.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.277 0.56 . . . . 71.21 109.979 175.367 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 133' ' ' ILE . . . . . 0.597 HG21 ' HB3' ' A' ' 79' ' ' LEU . 22.7 mm -64.33 -34.06 66.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.266 -0.879 . . . . 74.41 110.751 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 77.1 mt -66.92 -34.9 78.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.789 -0.641 . . . . 73.42 111.228 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -71.85 -41.27 68.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.909 0.385 . . . . 62.43 110.343 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -59.92 -46.77 88.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.954 -0.566 . . . . 73.32 111.172 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -92.53 3.18 56.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.139 -0.482 . . . . 74.41 111.349 -176.142 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 53.42 71.14 0.52 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.906 0.706 . . . . 63.13 112.906 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -89.65 -6.21 56.38 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.798 -0.637 . . . . 74.42 110.331 171.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 58.68 74.96 0.56 Allowed Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 115.486 -0.779 . . . . 24.52 110.81 178.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 141' ' ' PRO . . . . . 0.743 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 5.0 Cg_exo -74.77 -179.57 5.04 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.36 2.707 . . . . 73.43 111.801 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 142' ' ' LYS . . . . . 0.673 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 11.5 tptp . . . . . 0 C--N 1.33 -0.282 0 C-N-CA 119.899 -0.72 . . . . 64.11 110.812 -178.716 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.5 0 N-CA-C 107.921 -1.14 . . . . 71.14 107.921 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.738 ' HB3' ' HD1' ' B' ' 151' ' ' PHE . 3.7 mm? -51.32 -51.45 54.29 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.212 0.32 . . . . 74.03 111.742 -175.783 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.748 ' HB3' ' HD3' ' A' ' 42' ' ' LYS . . . 47.32 36.67 4.99 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 123.976 0.797 . . . . 72.53 111.673 176.89 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 151' ' ' PHE . . . . . 0.738 ' HD1' ' HB3' ' B' ' 149' ' ' LEU . 28.5 p90 -87.66 167.68 13.67 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.867 -0.606 . . . . 73.1 109.992 -177.174 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -96.87 121.34 38.63 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.174 -0.466 . . . . 73.21 110.294 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 153' ' ' CYS . . . . . 0.45 ' HB2' ' CE2' ' B' ' 151' ' ' PHE . 48.7 t -122.06 113.2 19.2 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.795 -0.639 . . . . 74.52 109.635 176.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.1 t70 68.63 16.46 9.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.613 -0.721 . . . . 63.32 111.127 174.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 116.71 -32.25 5.59 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.568 -0.825 . . . . 42.31 112.827 178.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 156' ' ' GLU . . . . . 0.487 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 13.4 pt-20 -97.87 157.68 15.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.831 0.348 . . . . 75.35 110.67 -177.763 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.9 mm -92.23 123.55 44.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.388 -0.369 . . . . 73.13 110.389 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 158' ' ' LYS . . . . . 0.487 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 26.5 mmmt -106.59 103.82 13.36 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.987 0.422 . . . . 74.13 110.89 -177.663 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.17 96.25 10.48 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.084 0.468 . . . . 63.32 111.687 -179.592 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -110.34 123.82 50.54 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.962 -0.563 . . . . 73.41 110.046 174.488 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 16.2 m -93.8 -26.4 16.97 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.216 -0.661 . . . . 72.04 109.216 174.299 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -102.77 153.64 19.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.282 -0.872 . . . . 74.31 109.48 177.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -87.73 -20.09 26.7 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.744 0.307 . . . . 64.45 110.809 -176.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -64.11 -47.6 79.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.322 -0.399 . . . . 73.32 110.805 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 15.7 m -65.9 -35.46 80.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.549 -0.296 . . . . 53.43 110.97 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 65.3 tp -66.44 -43.4 85.72 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.02 0.438 . . . . 74.31 110.136 177.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 167' ' ' ARG . . . . . 0.49 ' HG3' ' CD2' ' B' ' 184' ' ' LEU . 68.4 ttt180 -62.12 -41.5 98.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.868 -0.606 . . . . 64.24 110.471 178.38 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -66.48 -41.65 88.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.996 -0.547 . . . . 61.42 110.887 177.167 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 169' ' ' PHE . . . . . 0.412 ' O ' ' HG2' ' B' ' 172' ' ' GLN . 69.6 t80 -62.69 -46.3 88.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 74.05 110.666 -179.192 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 170' ' ' ALA . . . . . 0.42 ' CB ' HD12 ' B' ' 180' ' ' LEU . . . -61.48 -30.42 70.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.29 -0.413 . . . . 74.4 111.518 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 20.4 m -82.75 -12.3 57.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.775 0.322 . . . . 72.01 111.652 -175.732 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 172' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 14.0 pt20 -106.77 -1.99 22.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.436 0.636 . . . . 75.44 109.454 175.217 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -110.25 103.4 12.07 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.073 -0.967 . . . . 55.3 109.525 177.374 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 19.9 m -56.87 -32.11 65.5 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.9 0.381 . . . . 72.34 110.984 -177.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 6.2 m -66.11 -40.98 91.13 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.047 -0.524 . . . . 42.24 111.045 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 76.5 mtp -88.28 -21.15 24.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.392 -0.367 . . . . 44.3 111.077 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 177' ' ' LYS . . . . . 0.502 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 85.6 tttt -65.68 -23.09 66.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.308 0.575 . . . . 72.1 110.269 -179.261 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -95.59 -8.62 34.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.509 -0.769 . . . . 71.2 109.881 -178.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 179' ' ' LEU . . . . . 0.518 ' HB3' HG21 ' A' ' 33' ' ' ILE . 89.8 mt -94.04 -52.0 4.6 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 114.853 -1.067 . . . . 71.25 109.482 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 180' ' ' LEU . . . . . 0.42 HD12 ' CB ' ' B' ' 170' ' ' ALA . 6.0 mt -87.75 -12.45 45.16 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.791 -0.641 . . . . 63.11 112.368 -171.508 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 181' ' ' LYS . . . . . 0.502 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 64.2 pttt -62.15 -12.01 17.48 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.44 -0.504 . . . . 63.31 111.786 -178.784 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -70.03 -40.44 75.17 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.101 0.477 . . . . 74.01 110.445 175.487 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 25.9 m -104.65 -13.23 9.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.939 -0.573 . . . . 64.32 111.094 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 184' ' ' LEU . . . . . 0.49 ' CD2' ' HG3' ' B' ' 167' ' ' ARG . 9.1 mp . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 115.92 -0.582 . . . . 71.23 109.774 175.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.46 ' HB3' HD22 ' B' ' 149' ' ' LEU . 18.4 p90 . . . . . 0 N--CA 1.484 1.24 0 N-CA-C 114.653 1.353 . . . . 74.23 114.653 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -57.33 -46.42 83.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.035 0.445 . . . . 54.04 111.023 -178.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.527 HG22 HD21 ' A' ' 37' ' ' ASN . 48.8 mm -64.56 -43.53 96.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.937 -0.574 . . . . 75.44 110.887 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.762 HD12 HD21 ' B' ' 149' ' ' LEU . 85.5 mt -65.25 -17.94 64.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 74.43 111.617 -178.078 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -79.93 -34.38 38.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.113 0.482 . . . . 74.31 110.115 175.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -71.88 -46.17 58.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.753 -0.658 . . . . 64.12 111.293 -176.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.527 HD21 HG22 ' A' ' 33' ' ' ILE . 11.9 p30 -91.15 -8.0 49.93 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.866 -0.606 . . . . 74.05 110.753 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.1 t0 55.39 73.33 0.43 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.174 -0.921 . . . . 70.25 112.077 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -86.02 12.91 8.46 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.129 -0.942 . . . . 75.41 110.241 170.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.566 ' O ' ' HA ' ' B' ' 151' ' ' PHE . 1.1 tm-20 66.54 73.28 0.39 Allowed Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 115.62 -0.718 . . . . 72.42 110.215 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -76.88 161.31 33.34 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 123.352 2.702 . . . . 71.51 111.959 -178.404 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.553 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 10.8 tptt . . . . . 0 N--CA 1.463 0.194 0 C-N-CA 120.195 -0.602 . . . . 72.31 112.438 -176.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.411 ' O ' ' HB3' ' B' ' 142' ' ' LYS . 0.2 OUTLIER . . . . . 0 CA--C 1.506 -0.738 0 N-CA-C 109.505 -0.554 . . . . 74.43 109.505 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.999 HD21 HD12 ' B' ' 134' ' ' LEU . 47.2 tp -79.54 80.4 5.92 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 109.383 -0.599 . . . . 74.44 109.383 175.381 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.761 ' H ' ' HB2' ' B' ' 142' ' ' LYS . . . -88.4 77.06 8.2 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.514 -0.766 . . . . 63.14 110.146 178.498 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.575 ' HD1' ' HG ' ' A' ' 49' ' ' LEU . 43.7 p90 -93.77 168.76 10.79 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.638 -0.71 . . . . 73.34 110.919 -174.23 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.47 ' HE3' ' CD1' ' A' ' 57' ' ' ILE . 4.5 tppp? -96.78 114.08 25.68 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.999 -0.546 . . . . 63.42 110.368 -178.609 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.482 ' SG ' ' HE1' ' A' ' 69' ' ' PHE . 48.7 t -121.57 112.57 18.64 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.141 -0.481 . . . . 52.13 110.66 179.375 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.5 t70 68.88 0.98 2.94 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.298 -0.865 . . . . 74.54 112.456 171.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 127.98 -13.62 6.37 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.182 -1.009 . . . . 43.31 112.91 178.447 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.605 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 11.9 pt-20 -118.09 144.78 45.35 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.072 0.463 . . . . 75.22 110.272 177.417 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.47 ' CD1' ' HE3' ' A' ' 52' ' ' LYS . 41.0 mm -75.16 126.07 35.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.866 -0.607 . . . . 72.52 109.767 177.368 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.605 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 30.9 mmmt -114.17 117.51 31.4 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.187 -0.301 . . . . 75.24 110.187 -178.86 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.56 105.54 16.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.111 0.481 . . . . 70.14 111.458 178.565 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.444 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 25.5 m-85 -123.29 151.42 42.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.034 -0.53 . . . . 74.3 111.424 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.4 t -158.89 19.06 0.2 Allowed 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.075 -1.083 . . . . 54.43 108.075 173.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -129.88 117.05 19.55 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 114.809 -1.087 . . . . 75.31 109.373 -173.162 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.482 HD11 HD13 ' A' ' 84' ' ' LEU . 51.6 tp -65.38 -37.57 87.39 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.633 0.254 . . . . 74.23 110.535 179.192 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 44.5 tt0 -59.47 -50.39 74.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.09 0.471 . . . . 72.34 111.019 177.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.4 m -66.51 -42.09 87.85 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.101 -0.5 . . . . 71.13 110.881 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 36.4 tp -65.48 -33.17 75.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.271 -0.422 . . . . 63.01 110.714 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.576 ' HA ' HD21 ' A' ' 84' ' ' LEU . 54.3 ttp180 -57.95 -40.38 80.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.328 -0.396 . . . . 74.12 110.659 177.023 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -69.88 -40.61 75.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.081 -0.509 . . . . 74.3 111.228 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.575 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 33.9 t80 -74.66 -45.19 46.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 71.43 111.068 -176.68 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.48 -28.36 67.79 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.753 0.311 . . . . 74.34 111.028 -177.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 31.6 t -63.92 -29.32 70.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.137 -0.483 . . . . 32.31 111.18 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.575 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 13.5 pt20 -95.9 0.95 52.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.167 0.508 . . . . 60.34 110.199 -179.581 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.48 ' HD3' ' HA ' ' A' ' 73' ' ' LYS . 43.3 mmtt -102.74 111.38 23.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.944 -0.571 . . . . 71.34 111.067 -178.738 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.8 m -53.99 -35.53 61.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.019 -0.537 . . . . 61.23 111.228 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.2 p -81.8 -56.88 3.7 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.236 0.541 . . . . 74.1 111.28 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.517 ' HA ' HD12 ' A' ' 79' ' ' LEU . 74.9 mtp -66.23 -24.0 66.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.674 -0.694 . . . . 73.12 112.312 -173.238 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.415 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 45.4 tttm -61.9 -33.99 75.22 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.858 0.361 . . . . 65.13 110.989 179.635 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -87.76 -14.06 40.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.572 0.701 . . . . 63.34 109.517 -174.671 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.517 HD12 ' HA ' ' A' ' 76' ' ' MET . 84.8 mt -82.26 -48.19 11.52 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.746 -1.116 . . . . 71.44 109.302 175.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.445 ' O ' ' HB3' ' A' ' 84' ' ' LEU . 4.3 mm? -79.31 -24.3 42.92 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.145 -0.934 . . . . 60.43 112.077 -177.016 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.415 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 64.2 pttt -57.85 -16.84 13.06 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.486 0.55 . . . . 51.43 112.486 -174.602 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -81.1 -45.43 16.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.856 0.36 . . . . 70.23 111.178 -177.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 11.5 m -106.99 -2.19 9.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.225 0.536 . . . . 64.42 111.169 -174.054 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.576 HD21 ' HA ' ' A' ' 67' ' ' ARG . 40.6 tp . . . . . 0 C--N 1.32 -0.71 0 CA-C-N 115.716 -0.675 . . . . 70.41 109.82 -176.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 131' ' ' PHE . . . . . 0.656 ' HD1' HD22 ' A' ' 49' ' ' LEU . 57.2 m-85 . . . . . 0 N--CA 1.471 0.609 0 N-CA-C 112.13 0.419 . . . . 71.25 112.13 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -55.11 -36.75 66.03 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.352 0.501 . . . . 72.13 112.352 -176.795 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 133' ' ' ILE . . . . . 0.467 HG21 ' HB3' ' A' ' 79' ' ' LEU . 40.6 mm -58.0 -50.7 77.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.922 0.391 . . . . 55.44 110.797 177.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.999 HD12 HD21 ' A' ' 49' ' ' LEU . 40.3 mt -69.35 -9.07 51.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.037 -0.528 . . . . 72.52 111.558 -178.682 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -82.34 -30.1 30.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.848 0.356 . . . . 71.12 110.109 176.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -73.62 -53.87 9.47 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.269 0.556 . . . . 60.24 110.324 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 137' ' ' ASN . . . . . 0.543 ' OD1' ' HA ' ' B' ' 134' ' ' LEU . 16.1 p30 -80.48 -14.04 58.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.233 -0.894 . . . . 74.33 111.606 -177.025 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 11.5 t70 55.85 70.91 0.59 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.754 0.787 . . . . 62.25 110.403 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 139' ' ' PHE . . . . . 0.494 ' O ' ' HB2' ' B' ' 140' ' ' GLU . 1.8 m-85 -86.15 26.63 1.0 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.181 -0.918 . . . . 73.32 110.462 178.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 140' ' ' GLU . . . . . 0.528 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 12.4 mm-40 70.36 61.34 0.5 Allowed Pre-proline 0 N--CA 1.464 0.258 0 O-C-N 123.951 0.782 . . . . 72.04 110.529 -177.235 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 141' ' ' PRO . . . . . 0.434 ' HD3' ' N ' ' B' ' 140' ' ' GLU . 6.5 Cg_exo -72.8 139.77 31.07 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.722 2.281 . . . . 52.15 112.073 -175.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 142' ' ' LYS . . . . . 0.761 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 13.6 mptt . . . . . 0 C--N 1.327 -0.409 0 CA-C-O 120.952 0.406 . . . . 75.21 111.328 -178.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 148' ' ' LYS . . . . . 0.441 ' O ' ' HB3' ' A' ' 42' ' ' LYS . 1.3 mptt . . . . . 0 CA--C 1.508 -0.67 0 N-CA-C 108.662 -0.866 . . . . 62.12 108.662 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.762 HD21 HD12 ' A' ' 34' ' ' LEU . 65.9 tp -80.26 84.86 5.85 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.636 0.731 . . . . 72.52 109.147 174.224 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.553 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -94.76 115.72 27.86 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 114.811 -1.086 . . . . 43.34 109.082 176.666 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 151' ' ' PHE . . . . . 0.566 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 44.8 p90 -130.78 164.78 24.39 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.084 -0.507 . . . . 73.42 110.716 -179.087 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -87.52 123.2 32.17 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.131 -0.486 . . . . 73.42 110.012 179.031 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 153' ' ' CYS . . . . . 0.591 ' SG ' ' HE3' ' B' ' 173' ' ' LYS . 38.1 t -133.69 104.58 6.4 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.342 -0.39 . . . . 73.41 110.546 178.552 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 15.0 t70 70.21 14.02 7.65 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.259 -0.882 . . . . 73.25 111.948 172.544 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 124.54 -29.72 4.9 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.424 -0.893 . . . . 71.54 112.953 176.758 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 156' ' ' GLU . . . . . 0.446 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 15.4 pt-20 -106.68 150.85 25.83 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 122.553 -0.38 . . . . 74.53 110.644 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 44.6 mm -84.77 127.34 39.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.555 -0.535 . . . . 74.12 109.555 177.19 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 158' ' ' LYS . . . . . 0.533 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 29.2 mmmt -107.52 112.05 24.63 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.498 -0.319 . . . . 75.02 110.557 -177.468 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 159' ' ' THR . . . . . 0.526 HG22 ' HB2' ' B' ' 150' ' ' ALA . 0.8 OUTLIER -86.35 103.54 15.02 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.921 0.391 . . . . 74.32 110.988 176.777 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 160' ' ' PHE . . . . . 0.446 ' HD2' HD13 ' B' ' 166' ' ' LEU . 20.4 m-30 -120.66 116.56 25.54 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.173 -0.467 . . . . 73.33 111.197 178.254 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 8.0 t -109.64 10.53 24.91 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.354 -0.98 . . . . 74.1 108.354 171.394 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -122.09 121.62 37.35 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 114.863 -1.062 . . . . 71.24 110.104 -177.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 63.0 tp -65.96 -35.48 80.71 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.925 -0.398 . . . . 63.54 109.925 177.108 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -62.29 -42.29 99.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.941 -0.572 . . . . 74.22 110.813 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 43.6 m -67.15 -43.5 82.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.215 -0.448 . . . . 75.11 110.645 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 166' ' ' LEU . . . . . 0.446 HD13 ' HD2' ' B' ' 160' ' ' PHE . 64.5 tp -65.35 -38.0 88.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.253 -0.431 . . . . 73.33 110.532 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 167' ' ' ARG . . . . . 0.423 ' HG3' ' HG ' ' B' ' 184' ' ' LEU . 36.6 ttp180 -58.37 -41.08 83.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.341 -0.391 . . . . 51.43 110.55 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 168' ' ' LYS . . . . . 0.402 ' HB2' ' HE3' ' B' ' 168' ' ' LYS . 40.0 mtmt -65.19 -51.97 57.76 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.01 -0.541 . . . . 74.13 110.886 177.078 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 169' ' ' PHE . . . . . 0.408 ' CE1' ' HE2' ' B' ' 173' ' ' LYS . 22.4 t80 -65.97 -44.8 83.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.296 -0.865 . . . . 71.22 111.266 -171.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.57 -30.52 71.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.374 -0.375 . . . . 62.33 111.511 -179.273 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 25.6 t -77.67 -20.47 53.67 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.495 -0.321 . . . . 52.23 111.111 -177.4 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -100.07 1.68 42.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.247 0.546 . . . . 62.44 110.618 178.675 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 173' ' ' LYS . . . . . 0.591 ' HE3' ' SG ' ' B' ' 153' ' ' CYS . 60.8 mmtt -102.18 118.11 36.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.57 -0.741 . . . . 71.4 109.58 173.131 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 4.2 p -59.01 -43.12 91.5 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.14 0.495 . . . . 40.22 111.007 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 4.5 m -69.6 -32.87 71.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.815 -0.63 . . . . 60.44 111.687 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.511 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 77.1 mtp -96.82 -10.85 25.76 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.698 0.258 . . . . 63.42 111.698 -172.597 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -56.58 -40.85 75.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.25 -0.432 . . . . 74.33 111.723 -177.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 178' ' ' GLU . . . . . 0.603 ' HA ' ' HD3' ' B' ' 181' ' ' LYS . 31.9 mt-10 -94.51 -0.31 54.74 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.262 0.553 . . . . 71.52 110.622 -173.456 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 179' ' ' LEU . . . . . 0.497 HD22 HD22 ' A' ' 37' ' ' ASN . 83.8 mt -83.21 -51.01 7.85 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.465 -0.789 . . . . 74.24 109.496 176.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 180' ' ' LEU . . . . . 0.625 ' HB3' HD13 ' B' ' 184' ' ' LEU . 3.7 mm? -92.01 1.54 57.13 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.775 -0.648 . . . . 72.12 111.481 -175.451 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 181' ' ' LYS . . . . . 0.603 ' HD3' ' HA ' ' B' ' 178' ' ' GLU . 63.8 pttt -65.19 -2.35 2.88 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.714 0.635 . . . . 73.21 112.714 -176.152 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -79.48 -31.0 42.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.357 0.599 . . . . 63.21 109.939 174.626 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 5.3 p -107.23 -21.25 5.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.46 -0.791 . . . . 61.43 110.006 177.31 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 184' ' ' LEU . . . . . 0.625 HD13 ' HB3' ' B' ' 180' ' ' LEU . 10.1 mp . . . . . 0 C--N 1.327 -0.41 0 CA-C-N 115.998 -0.547 . . . . 63.42 109.927 174.65 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.573 ' HB3' HD11 ' B' ' 149' ' ' LEU . 13.0 p90 . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.543 0.211 . . . . 75.12 111.475 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.616 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 22.4 t-20 -59.3 -61.13 2.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.323 -0.399 . . . . 70.25 111.217 -174.739 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.551 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 1.7 mp -53.45 -41.59 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.44 -0.345 . . . . 65.11 111.508 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.1 mt -60.06 -40.49 89.66 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.13 -0.487 . . . . 73.32 111.27 178.196 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -67.83 -43.39 79.68 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 116.605 -0.27 . . . . 74.21 110.799 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.616 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 4.8 mm-40 -63.5 -38.93 93.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 62.42 111.005 -177.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -92.23 1.17 57.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 64.21 111.032 -178.665 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 56.77 53.45 8.28 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.608 -0.724 . . . . 72.1 112.371 177.321 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -81.37 -11.34 59.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.856 -0.611 . . . . 63.44 109.629 171.419 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 60.25 81.85 0.24 Allowed Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 114.506 -1.225 . . . . 72.35 111.734 176.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.576 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 20.9 Cg_exo -66.27 164.28 28.72 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.719 2.279 . . . . 74.3 110.969 175.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 1.129 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.478 0 C-N-CA 119.595 -0.842 . . . . 64.0 110.476 -176.347 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.387 0 N-CA-C 109.396 -0.594 . . . . 75.54 109.396 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.689 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 11.0 mp -72.61 92.35 1.51 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.339 -0.391 . . . . 74.24 110.293 178.291 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.631 ' HA ' ' O ' ' A' ' 58' ' ' LYS . . . -87.56 70.25 9.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.966 -0.561 . . . . 53.52 109.834 175.501 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.689 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 45.3 p90 -100.92 169.29 9.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.622 -0.717 . . . . 72.24 110.527 -177.413 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -105.65 121.72 44.57 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.477 -0.328 . . . . 73.15 111.391 -176.566 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.559 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 48.5 t -110.18 103.62 12.34 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.109 -0.496 . . . . 63.34 109.891 175.136 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 65.01 12.81 8.21 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.676 0.621 . . . . 73.24 112.676 174.71 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.45 -28.94 4.9 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.402 -0.904 . . . . 63.13 112.482 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.424 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 12.0 pt-20 -95.54 131.92 41.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.015 0.436 . . . . 74.21 110.721 -179.719 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 50.0 mm -75.26 129.64 36.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.103 -0.499 . . . . 71.24 110.375 177.219 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.631 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 28.0 mmmt -113.05 155.36 25.0 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.078 -0.712 . . . . 61.22 109.078 178.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.4 p -128.45 108.82 10.86 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.001 0.429 . . . . 74.54 110.889 175.533 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.468 ' CD2' HD13 ' A' ' 66' ' ' LEU . 87.2 m-85 -121.17 123.69 42.9 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.94 -0.573 . . . . 64.1 111.27 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.7 p -116.82 -17.27 10.51 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.396 -0.82 . . . . 74.31 109.527 174.651 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -106.97 127.3 53.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.472 -0.786 . . . . 70.34 110.526 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.5 tt -65.35 -44.06 88.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.996 -0.547 . . . . 72.42 110.328 -176.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.548 ' O ' ' HG3' ' A' ' 68' ' ' LYS . 47.9 tp60 -58.55 -41.48 85.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.095 -0.502 . . . . 75.1 110.84 -177.748 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.7 m -62.91 -45.76 90.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.12 -0.491 . . . . 74.31 111.011 178.503 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.468 HD13 ' CD2' ' A' ' 60' ' ' PHE . 55.2 tp -70.35 -31.8 69.24 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 75.43 110.888 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.432 ' HG2' ' HG ' ' A' ' 84' ' ' LEU . 3.4 tmm_? -62.79 -29.22 70.54 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.173 -0.467 . . . . 72.31 110.378 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.548 ' HG3' ' O ' ' A' ' 64' ' ' GLN . 91.5 mttt -70.02 -46.16 65.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.352 0.596 . . . . 61.14 110.599 176.6 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -67.28 -48.8 66.6 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.186 -0.915 . . . . 73.53 110.956 -176.163 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.1 -26.69 67.58 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.17 -0.468 . . . . 72.22 111.636 -177.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 35.9 t -75.97 -23.53 55.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.559 -0.291 . . . . 63.15 111.472 -178.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -102.82 2.01 34.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.328 0.585 . . . . 74.34 110.299 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.559 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 28.2 mmmt -103.5 101.12 11.0 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.216 -0.902 . . . . 73.34 109.751 175.604 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.4 p -55.83 -33.32 64.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.04 0.448 . . . . 71.13 111.07 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.455 ' O ' HD13 ' A' ' 79' ' ' LEU . 3.0 m -62.34 -45.64 92.3 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.727 -0.669 . . . . 72.53 110.937 177.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 82.0 mtp -90.95 -13.51 33.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.159 -0.473 . . . . 74.12 111.482 -174.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.638 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 33.6 ttpt -75.24 -9.05 58.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.778 0.323 . . . . 62.05 110.709 -176.72 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -99.06 -5.06 31.0 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.904 0.859 . . . . 73.54 109.492 174.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.714 ' HB3' HG21 ' B' ' 133' ' ' ILE . 10.7 mp -97.62 -55.92 2.67 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.442 -1.254 . . . . 74.34 109.42 176.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.811 ' HB3' HD13 ' A' ' 84' ' ' LEU . 3.8 mm? -81.19 -7.79 59.63 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 114.806 -1.088 . . . . 74.42 112.111 -176.254 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.638 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 64.8 pttt -55.05 -20.22 9.03 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.812 0.339 . . . . 75.4 111.729 178.012 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -69.24 -33.69 73.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.348 -0.387 . . . . 74.22 111.219 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 27.0 m -115.9 -8.3 12.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.018 0.377 . . . . 54.14 112.018 -175.717 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.811 HD13 ' HB3' ' A' ' 80' ' ' LEU . 8.3 mp . . . . . 0 C--N 1.326 -0.413 0 CA-C-N 116.464 -0.334 . . . . 61.24 110.823 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 29.7 p90 . . . . . 0 N--CA 1.463 0.178 0 CA-C-O 120.716 0.293 . . . . 73.44 111.569 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 132' ' ' ASN . . . . . 0.439 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 30.0 t30 -58.13 -54.55 45.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.855 -0.612 . . . . 70.4 111.079 -179.288 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 133' ' ' ILE . . . . . 0.714 HG21 ' HB3' ' A' ' 79' ' ' LEU . 4.1 mp -62.0 -40.57 87.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.138 0.494 . . . . 73.41 110.651 -177.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 89.9 mt -64.27 -31.38 72.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.928 -0.578 . . . . 64.34 111.142 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 54.2 ttt-85 -70.52 -45.02 66.36 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.113 0.482 . . . . 72.01 110.359 177.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 136' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 14.6 mm-40 -66.25 -33.08 74.94 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.587 -0.733 . . . . 73.12 111.58 -176.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -100.22 7.99 44.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.707 0.289 . . . . 74.43 111.22 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 56.16 68.16 0.9 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.718 -0.673 . . . . 73.14 112.639 175.169 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 139' ' ' PHE . . . . . 0.432 ' O ' ' HB2' ' A' ' 51' ' ' PHE . 11.4 m-85 -97.96 1.86 48.4 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.996 -0.547 . . . . 75.15 110.377 173.262 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 66.81 71.57 0.44 Allowed Pre-proline 0 CA--C 1.534 0.362 0 O-C-N 123.886 0.741 . . . . 74.5 110.696 -178.507 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -74.18 160.3 42.7 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.648 2.232 . . . . 61.12 111.689 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 11.4 mptt . . . . . 0 C--N 1.325 -0.494 0 N-CA-C 112.151 0.426 . . . . 71.31 112.151 -176.109 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? . . . . . 0 CA--C 1.519 -0.241 0 CA-C-O 121.206 0.527 . . . . 54.44 110.648 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.573 HD11 ' HB3' ' A' ' 31' ' ' PHE . 23.5 tp -98.2 15.11 25.43 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.402 -0.817 . . . . 74.44 109.02 172.663 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.706 ' HB2' HG22 ' B' ' 159' ' ' THR . . . -34.61 104.11 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 O-C-N 124.317 1.011 . . . . 65.14 113.242 -173.29 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 151' ' ' PHE . . . . . 0.576 ' HB3' ' HA ' ' A' ' 41' ' ' PRO . 50.5 p90 -119.04 174.23 6.43 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 114.921 -1.036 . . . . 73.55 109.543 -177.576 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -100.56 123.45 44.79 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.146 0.498 . . . . 70.41 111.578 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 153' ' ' CYS . . . . . 0.553 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 49.8 t -124.8 116.59 22.53 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.399 -0.819 . . . . 74.5 109.229 174.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 63.29 17.58 10.36 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.462 -0.335 . . . . 72.04 111.469 178.542 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 110.44 -29.59 8.96 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.641 -0.79 . . . . 73.2 112.714 178.217 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 156' ' ' GLU . . . . . 0.637 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 12.7 pt-20 -93.79 146.66 23.71 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.051 0.453 . . . . 64.15 110.677 -177.522 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.7 mm -85.06 120.17 35.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.227 -0.442 . . . . 61.41 110.162 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 158' ' ' LYS . . . . . 0.637 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 28.4 mmmt -102.54 120.03 39.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.458 -0.337 . . . . 74.31 110.267 -178.262 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 159' ' ' THR . . . . . 0.706 HG22 ' HB2' ' B' ' 150' ' ' ALA . 2.5 p -95.69 110.52 22.64 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.118 -0.492 . . . . 61.42 112.164 -176.631 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 160' ' ' PHE . . . . . 0.588 ' CD2' HD13 ' B' ' 166' ' ' LEU . 61.5 m-85 -132.65 151.94 51.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.709 -0.678 . . . . 73.04 110.192 176.577 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 13.2 p -134.03 14.11 3.92 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.049 -0.523 . . . . 71.4 110.006 176.154 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -146.96 144.59 29.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.757 -0.656 . . . . 74.02 110.598 -176.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 163' ' ' LEU . . . . . 0.447 ' O ' HD13 ' B' ' 163' ' ' LEU . 2.6 tm? -78.19 -34.28 49.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.456 . . . . 75.52 110.679 -175.304 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -67.17 -46.77 73.0 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.688 0.28 . . . . 74.03 110.496 -178.411 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 41.8 m -61.42 -39.12 89.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.359 -0.382 . . . . 62.52 110.86 177.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 166' ' ' LEU . . . . . 0.588 HD13 ' CD2' ' B' ' 160' ' ' PHE . 62.5 tp -71.47 -31.83 67.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.423 -0.353 . . . . 71.34 110.858 179.678 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 21.5 ttm180 -57.5 -39.35 76.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.356 -0.384 . . . . 74.31 110.543 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -60.11 -51.95 67.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.942 -0.572 . . . . 75.22 110.591 177.176 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 169' ' ' PHE . . . . . 0.434 ' CZ ' ' HE2' ' B' ' 158' ' ' LYS . 73.9 t80 -66.16 -43.6 86.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.261 -0.881 . . . . 74.32 111.074 -176.039 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -59.9 -40.89 90.3 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.121 -0.491 . . . . 63.15 111.977 -177.395 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 12.8 t -78.54 -21.32 48.95 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.759 0.281 . . . . 73.03 111.759 -174.526 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -93.96 -13.53 26.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.193 0.521 . . . . 72.11 110.617 179.137 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 173' ' ' LYS . . . . . 0.553 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 27.7 mmmt -88.59 117.16 27.35 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.042 -0.526 . . . . 75.11 110.28 176.54 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 1.5 m -51.42 -46.26 62.89 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 123.449 0.468 . . . . 62.02 110.96 -179.095 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 5.4 m -67.26 -43.87 80.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.897 -0.592 . . . . 63.52 111.556 -179.178 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.429 ' HA ' HD12 ' B' ' 179' ' ' LEU . 73.5 mtp -80.09 -22.39 42.27 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.779 0.323 . . . . 73.52 111.712 -174.52 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 177' ' ' LYS . . . . . 0.455 ' HE2' ' HB3' ' B' ' 177' ' ' LYS . 33.8 ttpt -58.37 -38.94 78.28 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.02 -0.536 . . . . 75.45 110.851 -177.573 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -86.1 -3.23 58.91 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.644 0.735 . . . . 63.45 110.063 -174.089 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 179' ' ' LEU . . . . . 0.551 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 78.1 mt -94.48 -42.13 9.01 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 114.89 -1.05 . . . . 74.24 109.667 179.372 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 180' ' ' LEU . . . . . 0.631 ' HB3' HD13 ' B' ' 184' ' ' LEU . 4.0 mm? -96.38 -9.84 29.04 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.608 -0.724 . . . . 54.22 111.929 -176.29 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 181' ' ' LYS . . . . . 0.44 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 65.5 pttt -55.52 -17.61 5.7 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.838 0.681 . . . . 51.1 112.838 -177.606 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -70.9 -38.53 73.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.859 0.361 . . . . 43.23 110.687 179.494 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 31.5 m -107.67 -10.35 10.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.259 -0.428 . . . . 54.43 111.365 -176.689 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 184' ' ' LEU . . . . . 0.631 HD13 ' HB3' ' B' ' 180' ' ' LEU . 9.3 mp . . . . . 0 C--N 1.327 -0.406 0 CA-C-N 116.272 -0.422 . . . . 64.24 110.316 177.498 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.47 ' HB2' ' HB3' ' A' ' 41' ' ' PRO . 22.6 p90 . . . . . 0 N--CA 1.475 0.785 0 N-CA-C 113.918 1.081 . . . . 62.22 113.918 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.486 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 9.4 t30 -66.35 -53.09 40.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.878 0.37 . . . . 71.11 110.307 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.564 HG21 ' HB3' ' B' ' 179' ' ' LEU . 45.8 mm -58.07 -43.7 85.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.87 -0.604 . . . . 63.15 110.616 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.657 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 64.7 mt -60.3 -42.06 94.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.695 -0.684 . . . . 73.35 111.252 179.358 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -64.61 -42.43 95.54 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.408 -0.36 . . . . 75.4 110.185 -179.604 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 38.8 mm-40 -65.75 -32.81 74.56 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.257 -0.429 . . . . 72.54 111.32 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -99.67 7.16 45.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.947 0.403 . . . . 54.35 111.064 -178.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 56.65 54.63 7.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.433 -0.803 . . . . 75.4 112.278 177.003 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.657 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 7.9 m-85 -84.45 -7.94 59.12 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.13 -0.693 . . . . 73.2 109.13 168.271 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 64.15 88.14 0.12 Allowed Pre-proline 0 N--CA 1.455 -0.18 0 CA-C-N 114.633 -1.167 . . . . 72.12 111.685 179.558 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.47 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 51.1 Cg_endo -70.28 148.36 61.51 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.56 2.174 . . . . 75.42 111.362 175.885 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.633 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 3.6 tptp . . . . . 0 C--N 1.325 -0.46 0 C-N-CA 119.848 -0.741 . . . . 74.41 110.846 -179.306 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.586 ' O ' ' HB3' ' B' ' 142' ' ' LYS . 3.8 mptt . . . . . 0 CA--C 1.508 -0.645 0 N-CA-C 109.099 -0.704 . . . . 73.34 109.099 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.786 HD21 HD12 ' B' ' 134' ' ' LEU . 46.2 tp -111.26 78.87 1.15 Allowed 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 109.225 -0.657 . . . . 74.2 109.225 169.501 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.867 ' H ' ' HB2' ' B' ' 142' ' ' LYS . . . -90.95 83.33 5.64 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.196 -0.911 . . . . 74.21 109.506 176.051 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.538 ' HD1' ' HG ' ' A' ' 49' ' ' LEU . 31.2 p90 -103.53 170.94 7.64 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.427 -0.806 . . . . 65.53 109.732 -178.033 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -98.24 127.51 44.22 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 120.324 -0.55 . . . . 71.33 110.177 177.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.5 ' SG ' ' HE2' ' A' ' 69' ' ' PHE . 29.8 t -133.5 108.81 8.86 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.895 -0.593 . . . . 72.04 109.567 175.762 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 70.82 27.06 3.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.321 -0.854 . . . . 52.32 110.627 176.82 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 103.68 -36.48 4.32 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.482 -0.866 . . . . 71.34 112.771 177.234 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.469 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 10.7 pt-20 -91.77 148.95 21.86 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.211 0.529 . . . . 75.23 110.673 -178.616 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 50.7 mm -86.16 127.27 40.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.481 -0.781 . . . . 65.03 109.652 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.68 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 29.2 mmmt -112.58 128.26 56.31 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.421 -0.354 . . . . 55.32 110.331 -176.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.33 109.37 21.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.007 0.432 . . . . 70.24 111.189 179.15 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.68 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 35.5 m-85 -118.82 148.4 42.9 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.129 -0.487 . . . . 73.53 110.472 178.567 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 11.7 p -138.17 6.58 2.6 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.184 -0.462 . . . . 43.23 110.939 176.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -142.43 144.01 32.88 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.879 -0.415 . . . . 73.41 109.879 179.041 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.472 ' O ' HD13 ' A' ' 63' ' ' LEU . 1.4 tm? -72.11 -32.33 66.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.25 -0.432 . . . . 72.22 110.244 -179.355 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.43 ' NE2' HH21 ' A' ' 67' ' ' ARG . 7.0 tp60 -64.8 -44.98 88.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.97 0.414 . . . . 50.31 110.355 -178.066 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.4 m -64.69 -38.32 90.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.789 -0.641 . . . . 62.02 110.181 178.103 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.484 ' HA ' ' CE2' ' A' ' 60' ' ' PHE . 47.3 tp -70.83 -36.17 72.78 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.764 -0.653 . . . . 73.43 111.178 -177.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.43 HH21 ' NE2' ' A' ' 64' ' ' GLN . 56.8 ttp85 -54.48 -45.62 73.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.09 0.471 . . . . 72.42 111.2 178.843 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 39.0 mtmt -66.23 -38.6 88.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.983 -0.553 . . . . 72.24 111.076 -176.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.5 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 55.8 t80 -74.44 -39.32 62.64 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.239 0.542 . . . . 73.23 110.443 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.69 -23.89 66.18 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.013 -0.539 . . . . 73.4 111.449 179.139 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.1 t -74.94 -38.84 61.66 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.522 -0.308 . . . . 73.13 111.128 -179.156 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 20.6 pt20 -74.8 -28.2 60.62 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.006 0.431 . . . . 55.13 110.237 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.435 ' HE3' ' HB3' ' A' ' 73' ' ' LYS . 25.8 mmmt -79.23 109.9 13.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.942 -0.572 . . . . 73.11 110.68 176.192 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.5 p -61.53 -29.75 70.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.376 -0.374 . . . . 71.21 111.737 -176.488 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.7 p -76.4 -45.57 31.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.951 0.405 . . . . 63.22 110.973 178.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 81.2 mtp -71.42 -26.32 62.7 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.34 -0.391 . . . . 51.44 110.634 -178.455 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.536 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 26.1 ttpp -56.44 -29.3 61.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.906 -0.588 . . . . 74.54 111.081 177.704 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -96.36 -4.69 41.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.292 0.568 . . . . 73.14 110.641 -176.077 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.596 ' HB3' ' CG2' ' B' ' 133' ' ' ILE . 84.3 mt -91.97 -46.95 7.55 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.314 -0.857 . . . . 64.22 109.421 177.546 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.78 -11.6 53.12 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.318 -0.856 . . . . 53.24 111.693 -177.072 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.536 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 62.6 pttt -60.17 -18.59 49.04 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.372 0.508 . . . . 72.41 112.372 -177.509 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.53 -44.53 86.58 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.128 0.489 . . . . 61.45 110.399 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 23.1 m -98.46 -11.1 8.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.83 -0.623 . . . . 71.54 111.107 -177.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.9 mt . . . . . 0 C--N 1.325 -0.497 0 N-CA-C 109.334 -0.617 . . . . 72.43 109.334 174.134 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 131' ' ' PHE . . . . . 0.51 ' HB3' HD22 ' A' ' 49' ' ' LEU . 22.1 p90 . . . . . 0 N--CA 1.477 0.922 0 N-CA-C 113.426 0.898 . . . . 54.52 113.426 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 132' ' ' ASN . . . . . 0.472 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 8.9 t30 -69.98 -44.31 69.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.522 0.201 . . . . 72.24 110.844 -177.296 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 133' ' ' ILE . . . . . 0.596 ' CG2' ' HB3' ' A' ' 79' ' ' LEU . 50.3 mm -58.24 -43.54 86.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.395 0.617 . . . . 64.31 110.414 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.786 HD12 HD21 ' A' ' 49' ' ' LEU . 61.1 mt -67.4 -29.98 69.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.616 -0.72 . . . . 53.24 110.711 178.194 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -71.82 -41.56 68.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.988 -0.551 . . . . 74.51 110.1 178.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 136' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 11.1 mm-40 -66.7 -37.17 84.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.922 -0.581 . . . . 74.24 111.461 179.454 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -96.42 -0.64 48.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.468 -0.333 . . . . 74.13 111.36 -176.332 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 38.4 t70 58.34 69.24 0.75 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.648 0.737 . . . . 65.42 112.043 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 139' ' ' PHE . . . . . 0.564 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 3.2 m-85 -97.54 7.34 46.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.529 -0.759 . . . . 70.25 109.501 170.745 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 140' ' ' GLU . . . . . 0.413 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 33.7 tt0 62.14 79.15 0.28 Allowed Pre-proline 0 C--N 1.332 -0.177 0 CA-C-N 114.61 -1.177 . . . . 74.55 111.046 -176.563 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.51 156.34 66.53 Favored 'Trans proline' 0 N--CA 1.464 -0.242 0 C-N-CA 122.388 2.059 . . . . 74.05 110.33 173.74 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 142' ' ' LYS . . . . . 0.867 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 23.3 tptt . . . . . 0 C--N 1.327 -0.385 0 C-N-CA 119.296 -0.962 . . . . 73.32 110.548 -178.075 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.509 -0.618 0 N-CA-C 109.341 -0.614 . . . . 63.41 109.341 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.65 ' HG ' ' HD1' ' B' ' 151' ' ' PHE . 56.5 tp -75.11 83.52 2.32 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.263 0.554 . . . . 70.23 109.678 177.314 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.633 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -91.5 76.9 5.8 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.289 -0.869 . . . . 60.11 109.863 177.475 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 151' ' ' PHE . . . . . 0.65 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 42.3 p90 -94.01 167.87 11.32 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.52 -0.764 . . . . 73.31 110.323 -176.122 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -99.58 113.89 26.59 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 121.248 0.547 . . . . 61.24 110.66 179.346 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 153' ' ' CYS . . . . . 0.59 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 44.1 t -110.22 102.47 11.14 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.507 -0.769 . . . . 74.31 110.098 179.377 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 15.0 t70 68.91 17.93 8.59 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 115.545 -0.752 . . . . 73.01 111.234 175.133 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 122.26 -34.73 3.72 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.204 -0.998 . . . . 63.41 112.882 177.258 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -94.61 150.16 20.51 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.624 0.249 . . . . 64.11 110.611 -178.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.9 mm -84.23 131.39 34.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 109.899 -0.408 . . . . 74.05 109.899 175.823 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 158' ' ' LYS . . . . . 0.606 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 31.8 mmmt -120.98 129.81 53.57 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.032 -0.358 . . . . 74.35 110.032 178.888 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.83 107.14 17.88 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.102 0.477 . . . . 63.3 111.85 -176.444 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 160' ' ' PHE . . . . . 0.606 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 42.6 m-85 -120.47 135.54 55.03 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.18 -0.463 . . . . 75.32 110.78 178.477 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 31.4 p -120.7 10.12 10.92 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.103 0.478 . . . . 53.14 110.461 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -144.2 138.76 28.29 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.829 -0.623 . . . . 73.42 110.543 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 163' ' ' LEU . . . . . 0.409 HD22 ' HA ' ' B' ' 163' ' ' LEU . 1.8 tm? -74.77 -39.31 61.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.864 -0.607 . . . . 63.51 110.275 -176.82 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -60.8 -45.67 93.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.086 0.469 . . . . 61.32 110.64 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 165' ' ' SER . . . . . 0.578 ' HA ' ' HE2' ' B' ' 168' ' ' LYS . 23.8 m -60.71 -38.21 84.29 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.815 -0.629 . . . . 73.23 110.63 176.282 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 53.3 tp -70.55 -32.08 69.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.093 -0.503 . . . . 70.11 111.091 -178.151 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -59.45 -38.27 80.29 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.666 0.27 . . . . 71.33 110.504 177.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 168' ' ' LYS . . . . . 0.578 ' HE2' ' HA ' ' B' ' 165' ' ' SER . 56.9 mtmt -61.6 -46.58 89.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.274 0.559 . . . . 63.14 110.588 177.498 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 169' ' ' PHE . . . . . 0.518 ' O ' ' HG2' ' B' ' 172' ' ' GLN . 66.9 t80 -66.67 -43.41 84.57 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.406 -0.816 . . . . 72.53 110.327 -179.465 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -60.8 -36.13 78.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.002 -0.545 . . . . 74.43 111.2 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 45.3 m -74.62 -22.25 59.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.487 -0.324 . . . . 65.44 111.849 -176.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 172' ' ' GLN . . . . . 0.518 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 13.7 pt20 -95.54 -7.73 37.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.091 0.472 . . . . 70.55 110.454 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 173' ' ' LYS . . . . . 0.59 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 30.1 mmmt -96.86 119.56 35.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.858 -0.61 . . . . 72.54 110.138 179.18 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 24.1 m -56.51 -37.59 70.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.99 0.424 . . . . 64.24 110.805 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 11.2 p -76.02 -49.83 16.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.678 -0.692 . . . . 73.52 111.521 -178.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.519 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 81.1 mtp -74.57 -22.3 59.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.092 -0.504 . . . . 74.34 111.996 -173.363 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -62.63 -25.91 68.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.136 0.493 . . . . 63.41 111.014 -178.603 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -103.27 8.31 38.33 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.612 0.72 . . . . 74.45 110.544 -177.775 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 179' ' ' LEU . . . . . 0.564 ' HB3' HG21 ' A' ' 33' ' ' ILE . 97.3 mt -103.31 -49.36 3.74 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.049 -0.978 . . . . 74.44 110.28 176.868 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 180' ' ' LEU . . . . . 0.528 ' HB3' HD12 ' B' ' 184' ' ' LEU . 4.0 mm? -85.05 -17.91 35.97 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.671 -0.695 . . . . 72.14 112.312 -174.1 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 59.2 pttt -64.26 -20.55 66.13 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.69 0.281 . . . . 73.34 111.665 -174.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -67.92 -47.99 67.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.977 0.418 . . . . 74.12 110.548 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 183' ' ' VAL . . . . . 0.439 HG23 ' HG ' ' B' ' 184' ' ' LEU . 31.4 m -91.82 -21.58 6.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.955 -0.566 . . . . 71.34 111.279 -177.377 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 184' ' ' LEU . . . . . 0.528 HD12 ' HB3' ' B' ' 180' ' ' LEU . 87.7 mt . . . . . 0 C--N 1.322 -0.6 0 N-CA-C 109.147 -0.686 . . . . 62.42 109.147 176.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.604 ' HB3' HD13 ' B' ' 149' ' ' LEU . 36.0 p90 . . . . . 0 N--CA 1.482 1.175 0 N-CA-C 114.549 1.314 . . . . 75.33 114.549 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -67.28 -57.17 7.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.839 0.352 . . . . 75.01 111.618 -175.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.498 HG21 ' HB3' ' B' ' 179' ' ' LEU . 48.7 mm -62.38 -37.81 79.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.367 0.603 . . . . 73.03 111.136 -177.245 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.4 mt -59.2 -33.15 70.62 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.332 -0.849 . . . . 64.51 111.551 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 51.4 ttt180 -68.56 -46.87 68.33 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.07 0.462 . . . . 71.22 110.406 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -69.04 -27.68 65.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.396 -0.82 . . . . 75.44 111.645 -173.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -106.61 6.83 30.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.548 -0.296 . . . . 71.34 111.19 -177.541 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.2 t70 58.55 69.89 0.69 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 115.494 -0.776 . . . . 75.53 111.919 175.062 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -98.76 3.13 47.48 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.697 -0.683 . . . . 74.42 111.037 172.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 58.02 71.37 1.06 Allowed Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 115.943 -0.571 . . . . 73.41 110.783 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -87.31 166.7 7.92 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.616 2.211 . . . . 61.52 112.505 -178.571 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.779 ' HB2' ' HA ' ' B' ' 149' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.333 -0.394 . . . . 73.21 110.413 177.319 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.448 ' HD2' ' O ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.445 -0.702 0 N-CA-C 109.59 -0.522 . . . . 53.14 109.59 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.79 ' HA ' ' HB2' ' B' ' 142' ' ' LYS . 0.2 OUTLIER -75.71 90.96 2.87 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 120.492 -0.483 . . . . 75.41 109.815 178.21 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.16 90.58 1.58 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.506 -0.77 . . . . 62.21 109.348 173.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.437 ' HA ' ' O ' ' B' ' 140' ' ' GLU . 53.9 p90 -107.16 166.84 10.33 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.525 -0.761 . . . . 63.23 110.514 -177.438 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.82 ' HE2' ' HA2' ' A' ' 55' ' ' GLY . 82.3 tttt -105.93 113.0 26.28 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.628 -0.715 . . . . 72.03 109.928 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.619 ' SG ' ' HE3' ' A' ' 73' ' ' LYS . 53.6 t -100.13 93.54 5.77 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.9 -0.591 . . . . 62.32 110.032 -179.248 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.9 t70 70.91 -9.09 0.87 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.664 0.745 . . . . 74.52 111.609 176.1 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.82 ' HA2' ' HE2' ' A' ' 52' ' ' LYS . . . 150.39 -27.25 1.09 Allowed Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.677 -0.692 . . . . 64.01 112.276 -178.497 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 53' ' ' CYS . 11.7 pt-20 -91.88 130.06 37.72 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.743 0.306 . . . . 75.53 110.695 -179.055 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.6 mm -80.9 122.38 36.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.682 -0.488 . . . . 74.21 109.682 177.458 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.598 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 30.6 mmmt -120.62 131.08 54.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.449 -0.342 . . . . 73.02 110.444 -177.744 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.1 p -101.09 113.73 27.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.068 0.461 . . . . 73.5 111.311 177.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.598 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 22.6 m-85 -120.85 139.48 53.11 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.892 -0.595 . . . . 71.34 110.825 178.504 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.4 t -120.85 -24.24 5.71 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.833 -0.803 . . . . 60.44 108.833 176.013 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -101.38 137.3 39.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.261 -0.881 . . . . 51.21 109.658 179.249 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.7 mt -83.25 -31.55 26.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.958 0.408 . . . . 64.14 110.701 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -69.39 -36.84 77.18 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.467 -0.333 . . . . 74.33 110.312 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.1 m -70.61 -32.71 70.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.032 0.444 . . . . 65.4 110.331 176.248 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.482 ' HA ' ' CE2' ' A' ' 60' ' ' PHE . 3.5 tm? -67.82 -42.16 81.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.719 -0.673 . . . . 62.41 109.721 177.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -33.6 70.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.466 -0.788 . . . . 74.53 110.128 -179.658 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -65.43 -47.84 74.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.651 -0.704 . . . . 70.44 111.057 176.255 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -63.35 -40.28 96.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.666 -0.697 . . . . 65.12 110.886 -175.427 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.8 -22.88 66.0 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.486 -0.325 . . . . 63.53 111.155 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.1 m -76.05 -20.73 57.5 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.302 -0.408 . . . . 73.54 111.673 -178.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -100.01 3.19 44.07 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.197 0.522 . . . . 75.41 110.724 178.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.619 ' HE3' ' SG ' ' A' ' 53' ' ' CYS . 70.6 mmtt -108.5 109.68 21.0 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.665 -0.698 . . . . 64.54 110.184 178.358 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.9 m -58.35 -32.41 68.51 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.823 0.344 . . . . 75.11 111.131 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.446 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 8.1 m -76.36 -37.96 56.52 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.304 -0.407 . . . . 71.41 111.251 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.578 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 77.4 mtp -86.35 -22.33 26.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.881 0.372 . . . . 71.04 111.566 -175.557 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -62.25 -30.0 70.8 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.994 -0.548 . . . . 62.44 111.981 -175.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -103.92 3.47 33.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.552 0.691 . . . . 72.33 110.319 -178.696 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 75' ' ' SER . 63.9 mt -86.52 -51.35 6.23 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.352 -0.84 . . . . 73.23 108.761 170.567 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.85 -7.66 56.98 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.88 -1.055 . . . . 73.0 111.393 -177.131 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.464 ' HE3' ' HB2' ' A' ' 81' ' ' LYS . 19.0 ptmt -57.85 -19.12 26.7 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.115 0.413 . . . . 71.33 112.115 -177.668 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -74.12 -43.77 56.31 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.998 -0.281 . . . . 62.01 110.773 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 32.7 m -91.41 -20.16 6.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.084 0.469 . . . . 63.45 110.909 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 40.9 mt . . . . . 0 C--N 1.326 -0.453 0 N-CA-C 108.991 -0.744 . . . . 75.23 108.991 175.438 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 131' ' ' PHE . . . . . 0.672 ' HB3' HD13 ' A' ' 49' ' ' LEU . 24.6 p90 . . . . . 0 N--CA 1.479 0.998 0 N-CA-C 114.086 1.143 . . . . 63.45 114.086 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -68.31 -61.55 1.79 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.95 0.405 . . . . 71.21 110.854 -178.014 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 133' ' ' ILE . . . . . . . . . . . . . 49.0 mm -60.06 -38.44 76.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.902 -0.59 . . . . 74.32 111.044 -177.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 70.0 mt -56.46 -37.41 70.26 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.545 -0.752 . . . . 73.52 111.158 177.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -69.45 -42.72 74.56 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.3 -0.409 . . . . 62.44 110.906 -178.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -69.93 -29.45 66.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.916 -0.584 . . . . 61.24 111.533 -175.497 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -98.47 -0.14 44.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.035 0.445 . . . . 60.43 110.677 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 26.4 t70 61.84 64.01 1.06 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.05 -0.977 . . . . 74.53 111.515 177.28 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -91.36 2.97 56.01 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.283 -0.871 . . . . 75.54 110.372 171.487 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 140' ' ' GLU . . . . . 0.437 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 14.7 tp10 61.71 63.41 2.23 Favored Pre-proline 0 CA--C 1.538 0.49 0 CA-C-N 115.948 -0.569 . . . . 75.15 111.397 178.617 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.4 163.47 34.41 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.262 1.975 . . . . 71.23 111.204 177.837 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 142' ' ' LYS . . . . . 0.823 ' HA ' ' HE3' ' B' ' 142' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.528 0 C-N-CA 120.81 -0.356 . . . . 75.24 111.372 -176.896 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 148' ' ' LYS . . . . . 0.495 ' CG ' HG22 ' B' ' 159' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.399 0 N-CA-C 110.22 -0.289 . . . . 74.42 110.22 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.779 ' HA ' ' HB2' ' A' ' 42' ' ' LYS . 0.5 OUTLIER -78.29 86.2 4.4 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 109.285 -0.635 . . . . 72.52 109.285 174.525 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -78.56 91.28 4.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.242 -0.89 . . . . 55.24 109.295 175.002 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 151' ' ' PHE . . . . . 0.445 ' CE2' ' HB2' ' B' ' 153' ' ' CYS . 52.6 p90 -108.57 164.7 12.12 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.08 -0.509 . . . . 72.11 110.736 -175.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 152' ' ' LYS . . . . . 0.738 ' HE2' ' HA2' ' B' ' 155' ' ' GLY . 78.0 tttt -92.9 104.92 17.12 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.762 -0.654 . . . . 71.13 110.015 179.232 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 153' ' ' CYS . . . . . 0.796 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 36.8 t -93.45 92.26 7.54 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.352 -0.84 . . . . 71.22 110.607 -174.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 16.8 t70 66.44 6.89 4.62 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.762 -0.654 . . . . 74.53 111.294 174.391 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 155' ' ' GLY . . . . . 0.738 ' HA2' ' HE2' ' B' ' 152' ' ' LYS . . . 138.53 -32.65 2.29 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.966 -0.635 . . . . 73.53 112.348 -179.623 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 156' ' ' GLU . . . . . 0.492 ' OE1' ' HD3' ' B' ' 158' ' ' LYS . 16.0 pt-20 -98.06 135.18 40.11 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.502 0.191 . . . . 71.03 110.665 -177.637 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 46.7 mm -77.48 120.14 27.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.54 -0.541 . . . . 64.14 109.54 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 158' ' ' LYS . . . . . 0.524 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 32.3 mmmt -117.17 123.58 47.04 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.81 0.338 . . . . 63.0 110.621 -177.898 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 159' ' ' THR . . . . . 0.495 HG22 ' CG ' ' B' ' 148' ' ' LYS . 0.3 OUTLIER -93.94 107.67 19.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.095 -0.502 . . . . 73.5 111.005 178.567 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 160' ' ' PHE . . . . . 0.524 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 57.3 m-85 -115.13 123.79 49.85 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.329 0.585 . . . . 74.42 111.482 179.126 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 23.3 t -120.79 10.75 11.01 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 107.665 -1.235 . . . . 71.23 107.665 171.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -129.7 110.39 11.74 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.36 -1.291 . . . . 63.24 109.476 -177.322 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -69.52 -32.96 72.11 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.486 -0.324 . . . . 71.12 111.087 -176.608 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -68.44 -45.8 71.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.847 0.356 . . . . 73.42 110.458 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 49.8 m -64.27 -30.78 71.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.215 -0.448 . . . . 55.42 110.485 176.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 166' ' ' LEU . . . . . 0.441 ' HA ' ' CE2' ' B' ' 160' ' ' PHE . 61.5 tp -68.1 -39.98 82.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.489 . . . . 64.12 110.69 177.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -59.55 -38.68 81.72 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.251 -0.431 . . . . 75.25 110.648 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -58.66 -54.84 42.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.294 0.569 . . . . 75.44 110.575 176.137 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 169' ' ' PHE . . . . . 0.605 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 57.0 t80 -66.56 -44.86 81.17 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.944 -1.025 . . . . 74.44 111.584 -172.273 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.4 -29.49 70.53 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 111.948 0.351 . . . . 73.2 111.948 -178.274 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 3.7 t -80.65 -23.55 39.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.754 0.312 . . . . 63.22 110.96 -175.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -95.27 -15.81 22.91 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.82 0.343 . . . . 71.03 111.102 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 173' ' ' LYS . . . . . 0.796 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 25.6 mmmt -78.41 116.25 18.68 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.522 -0.547 . . . . 73.24 109.522 173.617 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 22.0 t -59.51 -33.87 71.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.356 -0.384 . . . . 54.31 111.412 -174.382 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 175' ' ' SER . . . . . 0.43 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 5.1 p -78.97 -40.98 30.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.768 0.318 . . . . 71.42 111.291 179.643 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.556 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 70.3 mtp -75.21 -27.29 59.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.566 -0.288 . . . . 71.54 111.667 -177.608 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 45.8 tttm -52.79 -40.26 63.05 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.284 -0.416 . . . . 74.12 111.625 -178.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -92.33 -2.99 56.04 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.561 0.695 . . . . 64.23 110.051 -173.632 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 179' ' ' LEU . . . . . 0.498 ' HB3' HG21 ' A' ' 33' ' ' ILE . 60.1 mt -88.7 -47.72 8.04 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.014 -0.994 . . . . 41.44 108.92 173.637 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 180' ' ' LEU . . . . . 0.465 HD13 HG13 ' A' ' 33' ' ' ILE . 4.1 mm? -86.62 -7.94 57.9 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.881 -1.054 . . . . 72.34 111.689 -176.096 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 181' ' ' LYS . . . . . 0.42 ' HE3' ' HB2' ' B' ' 181' ' ' LYS . 18.1 ptmt -53.21 -23.16 7.95 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.499 0.555 . . . . 72.32 112.499 -178.866 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -72.41 -40.85 66.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.239 0.543 . . . . 64.31 110.174 177.491 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 47.5 t -82.14 -35.71 13.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.77 0.795 . . . . 72.14 109.934 178.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 184' ' ' LEU . . . . . . . . . . . . . 30.8 mt . . . . . 0 C--N 1.316 -0.85 0 CA-C-N 115.104 -0.953 . . . . 72.43 109.47 -178.667 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 11.2 p90 . . . . . 0 C--O 1.232 0.181 0 N-CA-C 112.338 0.495 . . . . 73.12 112.338 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -73.3 -52.27 14.54 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.999 -0.28 . . . . 74.25 111.073 -175.359 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.537 HG21 ' HB3' ' B' ' 179' ' ' LEU . 43.3 mm -55.56 -45.33 78.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.22 0.533 . . . . 43.31 111.338 -178.457 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.032 HD12 HD21 ' B' ' 149' ' ' LEU . 66.2 mt -66.78 -26.87 67.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.809 -0.632 . . . . 42.33 111.414 -176.332 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.472 ' HB2' ' HG3' ' A' ' 41' ' ' PRO . 1.0 OUTLIER -68.77 -40.34 79.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.785 0.326 . . . . 64.42 110.39 176.994 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -76.56 -23.82 53.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.106 0.479 . . . . 71.23 110.8 -177.035 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -100.54 4.3 43.43 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.017 -0.538 . . . . 71.52 110.906 -179.308 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.7 t70 56.11 58.59 4.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.507 -0.77 . . . . 74.21 111.85 177.433 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.615 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 5.8 m-85 -96.69 7.15 47.23 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.797 -0.638 . . . . 71.2 109.578 172.663 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.458 ' O ' ' HA ' ' B' ' 151' ' ' PHE . 30.7 tt0 61.55 80.03 0.26 Allowed Pre-proline 0 C--N 1.333 -0.117 0 CA-C-N 114.829 -1.078 . . . . 73.22 110.942 -178.389 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.472 ' HG3' ' HB2' ' A' ' 35' ' ' ARG . 69.3 Cg_endo -75.31 152.36 39.24 Favored 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.583 2.189 . . . . 73.31 111.966 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.651 ' H ' HD12 ' B' ' 149' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.428 0 C-N-CA 120.785 -0.366 . . . . 74.02 110.675 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.512 0 N-CA-C 108.421 -0.955 . . . . 75.22 108.421 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.683 HD11 ' HB3' ' B' ' 141' ' ' PRO . 12.5 tp -74.93 86.49 2.28 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.012 0.434 . . . . 75.24 109.961 -176.585 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.541 ' HB2' HG22 ' A' ' 59' ' ' THR . . . -88.17 103.85 16.15 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.488 -0.778 . . . . 63.32 110.255 177.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -125.7 169.89 12.09 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.101 -0.5 . . . . 64.53 110.088 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.435 ' HE3' HD11 ' A' ' 57' ' ' ILE . 32.2 ttmt -101.71 116.62 33.13 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.333 -0.394 . . . . 75.35 110.758 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.619 ' O ' ' HG2' ' A' ' 56' ' ' GLU . 52.7 t -116.18 104.12 11.21 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.937 -0.574 . . . . 33.32 110.365 179.288 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.8 t70 70.24 4.33 4.82 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.854 0.835 . . . . 61.15 110.805 175.519 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.12 -31.43 4.27 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.542 -0.753 . . . . 75.3 112.017 -179.488 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.619 ' HG2' ' O ' ' A' ' 53' ' ' CYS . 11.7 pt-20 -84.24 131.16 34.77 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.014 0.435 . . . . 74.21 110.082 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.435 HD11 ' HE3' ' A' ' 52' ' ' LYS . 41.1 mm -82.21 114.81 23.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.486 -0.561 . . . . 74.32 109.486 178.206 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.427 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 32.1 mmmt -109.63 129.72 55.57 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.23 -0.441 . . . . 73.14 111.187 -174.421 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.541 HG22 ' HB2' ' A' ' 50' ' ' ALA . 2.5 p -103.07 118.16 36.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.095 -0.502 . . . . 73.23 110.593 176.341 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.463 ' CD2' HD13 ' A' ' 66' ' ' LEU . 49.7 m-85 -129.72 121.36 26.75 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.206 0.527 . . . . 75.44 110.669 177.188 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.0 p -95.34 1.81 54.48 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.841 -0.618 . . . . 73.24 110.599 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -155.2 166.88 32.21 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.543 -0.753 . . . . 74.4 110.158 -178.305 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.525 ' O ' HD13 ' A' ' 63' ' ' LEU . 2.8 tm? -87.6 -21.22 25.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.167 -0.469 . . . . 74.3 109.898 -177.752 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -62.88 -47.66 82.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.088 -0.506 . . . . 71.52 110.946 -177.525 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' A' ' 68' ' ' LYS . 12.2 t -71.31 -34.26 70.43 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.372 -0.376 . . . . 71.24 110.196 178.835 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.463 HD13 ' CD2' ' A' ' 60' ' ' PHE . 57.1 tp -68.45 -34.53 76.12 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 120.996 -0.281 . . . . 72.24 110.457 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.567 ' HG3' HD13 ' A' ' 84' ' ' LEU . 50.8 ttt180 -56.17 -46.33 79.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.231 0.539 . . . . 74.31 109.914 173.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 65' ' ' SER . 15.8 mmmt -57.57 -36.16 71.32 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.058 -0.974 . . . . 64.53 111.299 177.76 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.484 ' CE2' ' HE3' ' A' ' 73' ' ' LYS . 58.5 t80 -84.87 -44.19 13.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.742 -0.663 . . . . 74.11 111.511 -175.519 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.12 -22.21 63.98 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.46 -0.336 . . . . 64.5 111.364 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 14.2 t -74.71 -17.9 60.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.316 -0.402 . . . . 74.4 111.286 -178.303 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 13.0 pt20 -101.79 -8.94 21.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.229 0.538 . . . . 74.13 110.185 176.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.534 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 70.0 mmtt -94.0 104.34 16.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.704 -0.68 . . . . 73.4 109.631 176.427 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.5 m -53.42 -32.58 50.36 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.879 0.371 . . . . 75.12 111.713 -178.393 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 26.9 m -76.94 -45.13 28.82 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.813 0.339 . . . . 71.11 111.297 179.384 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.534 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 61.4 mtp -78.38 -17.09 56.93 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.901 0.382 . . . . 54.33 111.422 -175.764 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.475 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 12.9 tmtt? -63.97 -24.15 67.61 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.944 -0.571 . . . . 63.22 110.593 177.205 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.564 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 28.3 mm-40 -98.24 6.62 47.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.295 0.569 . . . . 52.35 110.287 -178.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.761 ' HB3' HG21 ' B' ' 133' ' ' ILE . 43.2 mt -100.59 -46.99 5.02 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.226 -0.897 . . . . 65.24 110.233 178.542 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -94.92 -0.39 53.99 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.939 -0.573 . . . . 54.03 111.052 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.564 ' HD2' ' HA ' ' A' ' 78' ' ' GLU . 20.5 ptmt -51.2 -21.31 1.96 Allowed 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.364 0.876 . . . . 75.5 113.364 -178.09 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -76.25 -46.67 27.03 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.801 0.334 . . . . 72.44 111.476 -178.119 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 29.2 m -89.19 -12.58 9.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.263 -0.426 . . . . 74.24 111.221 -175.505 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.567 HD13 ' HG3' ' A' ' 67' ' ' ARG . 80.3 mt . . . . . 0 C--N 1.319 -0.734 0 CA-C-N 116.076 -0.511 . . . . 64.45 109.622 178.415 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 34.9 p90 . . . . . 0 CA--C 1.524 -0.054 0 N-CA-C 111.791 0.293 . . . . 72.3 111.791 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 132' ' ' ASN . . . . . 0.408 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 31.7 t30 -64.25 -58.64 5.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.524 -0.307 . . . . 43.43 111.178 -177.053 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 133' ' ' ILE . . . . . 0.761 HG21 ' HB3' ' A' ' 79' ' ' LEU . 27.3 mm -61.05 -38.95 80.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-O 121.194 0.521 . . . . 42.24 110.828 -176.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.613 ' HA ' ' HD2' ' B' ' 139' ' ' PHE . 51.6 mt -65.4 -33.28 75.59 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.67 -0.695 . . . . 73.24 111.235 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 42.2 ttt-85 -65.36 -48.23 73.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.146 0.498 . . . . 61.14 110.154 175.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 136' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 6.6 mm-40 -61.2 -42.03 97.87 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.149 -0.932 . . . . 72.14 111.616 -177.009 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -86.46 0.12 54.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.304 -0.407 . . . . 65.51 110.997 -179.612 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 15.6 t70 56.66 62.79 2.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.298 -0.864 . . . . 74.54 112.016 177.202 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 139' ' ' PHE . . . . . 0.613 ' HD2' ' HA ' ' B' ' 134' ' ' LEU . 75.3 m-85 -91.3 -4.5 55.82 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.06 -0.518 . . . . 73.42 110.394 169.604 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 60.1 84.67 0.2 Allowed Pre-proline 0 CA--C 1.529 0.157 0 CA-C-N 115.316 -0.857 . . . . 65.22 110.859 -176.62 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 141' ' ' PRO . . . . . 0.683 ' HB3' HD11 ' A' ' 49' ' ' LEU . 17.6 Cg_exo -67.03 161.96 40.33 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 123.179 2.586 . . . . 72.12 112.092 177.655 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 142' ' ' LYS . . . . . 0.474 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 23.4 tptt . . . . . 0 C--N 1.329 -0.311 0 C-N-CA 120.819 -0.352 . . . . 73.23 110.133 179.294 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.512 -0.511 0 N-CA-C 109.374 -0.602 . . . . 74.51 109.374 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 1.032 HD21 HD12 ' A' ' 34' ' ' LEU . 66.4 tp -77.32 92.57 3.92 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.519 -0.764 . . . . 71.31 110.811 -174.631 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.633 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -95.01 85.75 4.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.677 -0.692 . . . . 71.52 109.788 175.062 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 151' ' ' PHE . . . . . 0.592 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 45.4 p90 -102.54 171.95 7.14 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.876 -0.602 . . . . 75.31 110.349 -177.036 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -103.2 119.56 39.09 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.103 0.478 . . . . 75.14 110.625 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 153' ' ' CYS . . . . . 0.432 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 23.0 t -113.15 101.22 9.23 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.802 -0.636 . . . . 72.15 109.618 177.764 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 65.69 14.69 9.67 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.605 -0.725 . . . . 62.35 112.115 176.285 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 128.89 -32.82 3.21 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.103 -1.046 . . . . 70.01 112.84 177.26 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -100.2 142.13 32.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.145 0.498 . . . . 71.45 110.918 -177.717 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 157' ' ' ILE . . . . . 0.43 ' HA ' ' O ' ' B' ' 151' ' ' PHE . 49.1 mm -80.3 124.96 38.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.809 -0.632 . . . . 53.43 110.278 178.781 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 158' ' ' LYS . . . . . 0.448 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 26.7 mmmt -114.34 132.47 56.18 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.888 -0.412 . . . . 61.23 109.888 179.155 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.4 109.93 21.85 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.902 0.382 . . . . 72.14 111.667 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 160' ' ' PHE . . . . . 0.448 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 33.9 m-85 -119.8 128.99 54.22 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.047 -0.524 . . . . 73.34 110.438 177.853 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 2.9 p -100.85 -16.56 17.21 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.125 -0.489 . . . . 54.14 111.764 -178.835 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -139.37 164.44 29.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.924 0.392 . . . . 63.34 110.786 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 163' ' ' LEU . . . . . 0.458 ' O ' HD13 ' B' ' 163' ' ' LEU . 3.0 tm? -86.45 -25.29 25.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.763 -0.653 . . . . 73.42 110.251 -176.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 51.3 tt0 -60.85 -46.76 89.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.011 0.434 . . . . 64.55 110.86 -177.575 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 14.2 m -68.63 -34.43 75.73 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.845 -0.616 . . . . 74.22 110.373 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 42.8 tp -71.45 -26.95 62.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.915 -0.584 . . . . 72.21 110.615 -178.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -56.2 -43.35 78.41 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.664 -0.244 . . . . 70.33 110.681 177.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 28.0 mtmt -67.36 -43.15 82.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.033 0.444 . . . . 74.54 110.234 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 169' ' ' PHE . . . . . 0.582 ' O ' ' HG2' ' B' ' 173' ' ' LYS . 70.8 t80 -64.16 -45.9 86.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.516 -0.765 . . . . 72.34 110.54 -177.775 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -71.63 -28.62 63.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.101 -0.5 . . . . 61.45 111.286 -178.461 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 22.9 t -67.89 -32.89 73.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.622 -0.263 . . . . 63.24 111.127 -177.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -84.45 -16.04 43.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.872 0.368 . . . . 70.1 110.403 178.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 173' ' ' LYS . . . . . 0.582 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 31.6 mmmt -83.22 145.72 28.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.151 -0.477 . . . . 75.3 110.129 178.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 12.7 m -83.67 -44.79 14.14 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.284 0.564 . . . . 53.13 109.557 176.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 3.2 m -72.54 -40.29 66.86 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.52 -0.764 . . . . 63.23 111.504 -177.228 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.446 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 81.6 mtp -85.2 -17.85 35.86 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.391 0.515 . . . . 75.25 112.391 -172.867 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 177' ' ' LYS . . . . . 0.537 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 88.0 tttt -63.93 -31.06 72.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.979 0.419 . . . . 44.32 110.795 -178.696 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 178' ' ' GLU . . . . . 0.871 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 51.7 mm-40 -90.08 -0.3 57.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.521 0.677 . . . . 65.42 110.419 -175.356 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 179' ' ' LEU . . . . . 0.537 ' HB3' HG21 ' A' ' 33' ' ' ILE . 52.8 mt -94.78 -49.71 5.47 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.024 -0.989 . . . . 64.04 109.806 -179.244 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 180' ' ' LEU . . . . . 0.61 ' O ' ' HG ' ' B' ' 184' ' ' LEU . 3.4 mm? -88.89 -14.93 35.64 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.531 -0.759 . . . . 72.01 111.858 -176.542 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 181' ' ' LYS . . . . . 0.871 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 20.4 ptmt -53.89 -23.96 14.46 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 111.959 0.355 . . . . 73.51 111.959 -178.113 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -65.66 -23.75 66.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.022 -0.535 . . . . 71.53 111.942 -174.63 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 19.3 m -124.88 3.34 4.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 112.201 0.445 . . . . 64.31 112.201 -178.248 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 184' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' B' ' 180' ' ' LEU . 81.9 mt . . . . . 0 C--N 1.326 -0.452 0 C-N-CA 121.21 -0.196 . . . . 74.13 110.874 -179.151 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 33.8 p90 . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.86 0.362 . . . . 70.01 110.601 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -61.03 -50.96 71.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.893 -0.594 . . . . 71.24 110.962 -175.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.488 HG21 ' HB3' ' B' ' 179' ' ' LEU . 28.4 mm -60.59 -39.98 83.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.905 -0.589 . . . . 74.54 111.411 -178.167 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.48 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 86.4 mt -68.29 -22.49 64.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.863 -0.608 . . . . 71.51 110.982 -176.574 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 46.4 ttt-85 -73.32 -42.6 62.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.09 -0.505 . . . . 73.44 109.914 175.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -72.05 -23.43 61.37 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.925 -0.579 . . . . 64.24 111.04 -177.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -103.89 6.17 36.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.382 -0.372 . . . . 62.22 110.731 179.161 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 52.06 62.27 2.79 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.387 -0.824 . . . . 71.24 112.816 176.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.484 ' HB3' ' HB2' ' B' ' 151' ' ' PHE . 12.4 m-85 -94.36 -4.8 47.86 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.74 -0.664 . . . . 72.31 109.794 173.251 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 58.82 74.69 0.58 Allowed Pre-proline 0 C--O 1.232 0.183 0 CA-C-N 115.25 -0.886 . . . . 63.02 110.195 -174.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -78.58 142.42 18.29 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 123.006 2.471 . . . . 44.11 112.334 -176.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.702 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 1.4 mptm? . . . . . 0 C--N 1.322 -0.609 0 CA-C-N 116.072 -0.513 . . . . 75.34 110.061 177.624 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.564 ' HD3' HG22 ' A' ' 59' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.45 -0.436 0 N-CA-C 109.225 -0.657 . . . . 63.35 109.225 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.689 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 11.2 mp -70.43 86.57 0.62 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.469 -0.332 . . . . 61.3 110.491 -178.751 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.587 ' HA ' ' O ' ' A' ' 58' ' ' LYS . . . -84.98 63.08 7.9 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.629 -0.714 . . . . 54.54 110.047 175.459 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.689 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 51.8 p90 -95.33 171.57 8.63 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.485 -0.78 . . . . 74.03 110.077 -177.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -102.51 133.56 47.27 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.324 -0.398 . . . . 74.52 111.25 -178.424 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 42.3 t -135.8 114.69 12.11 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.695 -0.684 . . . . 74.5 109.453 175.319 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 70.34 13.95 7.52 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.143 0.577 . . . . 73.43 111.308 177.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 110.21 -32.32 6.76 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.682 -0.77 . . . . 74.4 112.186 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -89.01 156.1 19.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.006 0.432 . . . . 54.34 110.271 -179.292 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.1 mm -91.94 124.54 44.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 116.007 -0.542 . . . . 75.55 110.425 -179.442 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.587 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 27.4 mmmt -100.82 155.2 18.06 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.872 -0.788 . . . . 73.33 108.872 177.413 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.564 HG22 ' HD3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -133.45 102.18 5.43 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.177 0.513 . . . . 61.12 111.426 177.088 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.544 ' CD2' HD13 ' A' ' 66' ' ' LEU . 84.6 m-85 -108.35 119.83 40.63 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.804 -0.634 . . . . 74.45 110.448 177.327 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 32.6 t -97.06 -13.57 22.15 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.761 -0.654 . . . . 63.32 110.005 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -130.21 154.54 47.45 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.715 -0.675 . . . . 71.1 110.296 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.403 HD23 ' O ' ' A' ' 63' ' ' LEU . 10.4 tt -83.23 -24.36 32.37 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.409 -0.589 . . . . 73.43 109.409 -178.23 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 49.6 tp60 -54.18 -52.72 60.29 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.443 -0.798 . . . . 60.02 111.013 -178.493 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.8 m -69.75 -44.13 70.84 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.96 -0.564 . . . . 72.43 111.346 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.544 HD13 ' CD2' ' A' ' 60' ' ' PHE . 54.6 tp -65.74 -35.87 81.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.429 -0.35 . . . . 63.1 111.379 -174.766 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.428 ' HE ' ' HB3' ' A' ' 67' ' ' ARG . 17.7 ttp180 -58.11 -41.85 84.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.957 0.408 . . . . 73.3 110.342 176.425 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -72.4 -32.0 66.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.967 -0.561 . . . . 70.45 110.688 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 31.6 t80 -65.31 -44.86 86.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.907 -0.588 . . . . 74.11 109.907 177.392 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.73 -24.57 61.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.192 -0.458 . . . . 53.11 111.399 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.761 ' HA ' ' HE2' ' A' ' 77' ' ' LYS . 70.4 m -73.42 -18.78 61.1 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.599 -0.273 . . . . 65.45 111.294 -179.841 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -106.52 4.1 27.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.367 0.604 . . . . 75.2 110.194 176.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 56.3 mmtt -105.11 107.58 18.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.599 -0.728 . . . . 71.35 110.183 177.477 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.3 t -56.89 -33.0 66.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.976 0.417 . . . . 65.22 110.598 -178.277 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.8 p -80.87 -52.12 7.83 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.123 -0.49 . . . . 74.41 111.293 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.618 ' HA ' HD13 ' A' ' 79' ' ' LEU . 72.9 mtp -67.76 -12.77 61.25 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.843 0.354 . . . . 64.15 111.578 -177.331 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.761 ' HE2' ' HA ' ' A' ' 71' ' ' SER . 16.7 mmtt -61.83 -25.96 67.83 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.072 -0.513 . . . . 62.23 110.513 174.181 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.448 ' O ' ' HE2' ' A' ' 81' ' ' LYS . 3.6 mm-40 -94.95 -5.31 45.02 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.411 0.625 . . . . 74.31 110.131 -178.581 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.618 HD13 ' HA ' ' A' ' 76' ' ' MET . 8.5 mp -92.43 -56.84 2.89 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.265 -0.88 . . . . 74.43 110.094 178.1 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.821 ' HB3' HD13 ' A' ' 84' ' ' LEU . 3.7 mm? -83.22 -4.47 58.44 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.023 -0.535 . . . . 62.0 111.752 -174.133 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.539 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 64.9 pttt -56.46 -18.5 11.57 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.611 0.597 . . . . 74.41 112.611 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -76.25 -26.03 55.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.76 0.314 . . . . 74.25 111.55 -177.489 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 7.5 p -116.14 -28.51 2.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.84 0.352 . . . . 71.14 111.375 -177.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.821 HD13 ' HB3' ' A' ' 80' ' ' LEU . 8.8 mp . . . . . 0 C--N 1.328 -0.342 0 N-CA-C 109.76 -0.459 . . . . 64.13 109.76 177.245 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 45.5 p90 . . . . . 0 N--CA 1.454 -0.248 0 CA-C-O 120.967 0.413 . . . . 65.11 110.016 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 132' ' ' ASN . . . . . 0.54 ' O ' ' HB3' ' B' ' 135' ' ' ARG . 8.1 t30 -67.47 -35.43 79.17 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.115 -0.493 . . . . 72.42 110.137 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 133' ' ' ILE . . . . . 0.442 HG21 ' HB3' ' A' ' 79' ' ' LEU . 46.4 mm -64.32 -41.03 91.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.204 0.526 . . . . 75.45 110.231 175.508 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.419 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 91.4 mt -70.42 -22.06 62.76 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.926 -0.579 . . . . 73.04 110.363 177.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.54 ' HB3' ' O ' ' B' ' 132' ' ' ASN . 22.6 ttt180 -68.71 -51.54 40.42 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.679 -0.489 . . . . 74.31 109.679 171.447 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 136' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 69.7 mm-40 -55.36 -48.74 73.8 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.248 -0.887 . . . . 75.54 111.508 -179.744 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -87.82 0.64 55.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.47 . . . . 72.45 111.174 -177.261 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 33.2 t70 52.14 63.46 2.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.643 0.735 . . . . 74.51 111.95 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 139' ' ' PHE . . . . . 0.419 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 4.0 m-85 -93.16 0.81 57.28 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.485 -0.779 . . . . 74.12 109.835 174.081 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 74.3 81.97 0.14 Allowed Pre-proline 0 N--CA 1.465 0.294 0 O-C-N 124.328 1.017 . . . . 73.54 110.679 -176.638 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -85.27 127.81 3.45 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 122.521 2.147 . . . . 65.1 112.904 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 115.885 -0.598 . . . . 75.31 110.017 174.914 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.513 -0.446 0 N-CA-C 108.543 -0.91 . . . . 73.31 108.543 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.646 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.8 mp -70.0 91.48 0.68 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.268 -0.424 . . . . 71.42 109.934 -178.376 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.702 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -93.02 61.05 3.39 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.656 -0.498 . . . . 71.53 109.656 175.781 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 151' ' ' PHE . . . . . 0.646 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 50.5 p90 -88.93 165.7 14.42 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.661 -0.699 . . . . 73.43 110.711 -176.481 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 152' ' ' LYS . . . . . 0.583 ' HE2' ' HA2' ' B' ' 155' ' ' GLY . 57.9 tttt -98.03 115.87 29.09 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.079 -0.51 . . . . 74.12 110.172 -178.082 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 153' ' ' CYS . . . . . . . . . . . . . 53.6 t -117.68 103.38 9.97 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.236 -0.438 . . . . 60.33 110.147 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 65.89 29.14 10.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.444 -0.798 . . . . 74.01 111.374 175.266 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 155' ' ' GLY . . . . . 0.583 ' HA2' ' HE2' ' B' ' 152' ' ' LYS . . . 108.5 -33.35 6.28 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.525 -0.845 . . . . 31.12 112.987 176.495 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 156' ' ' GLU . . . . . 0.571 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 10.1 pt-20 -99.6 140.3 34.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.911 0.386 . . . . 65.21 110.92 -178.363 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 50.9 mm -76.63 120.56 27.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.045 -0.525 . . . . 75.54 110.173 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 158' ' ' LYS . . . . . 0.571 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 29.9 mmmt -110.54 110.05 20.62 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.827 -0.435 . . . . 74.22 109.827 -177.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 159' ' ' THR . . . . . 0.466 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.5 OUTLIER -87.82 126.77 35.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.086 0.47 . . . . 55.12 111.954 -178.75 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -130.27 124.78 33.19 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.783 -0.644 . . . . 74.21 110.592 177.003 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 34.3 t -112.51 -5.94 14.0 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.789 -0.642 . . . . 62.24 109.899 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -137.8 163.37 31.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.031 -0.531 . . . . 65.14 109.997 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 91.5 mt -97.92 1.41 48.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.424 -0.353 . . . . 63.14 111.583 -176.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -82.47 -53.08 6.27 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.371 -0.604 . . . . 72.33 109.371 178.695 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 15.1 m -62.96 -38.89 92.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.74 -0.663 . . . . 54.43 110.039 176.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 53.2 tp -67.66 -35.85 79.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.621 -0.718 . . . . 63.52 110.951 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 54.4 ttp180 -61.09 -46.04 92.28 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.989 0.423 . . . . 73.54 109.944 178.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -63.38 -41.31 98.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.632 -0.713 . . . . 64.0 110.611 178.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 169' ' ' PHE . . . . . 0.479 ' O ' ' HG2' ' B' ' 172' ' ' GLN . 51.7 t80 -65.32 -46.64 79.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.7 -0.682 . . . . 72.12 110.985 -178.51 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -66.23 -28.38 68.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.361 -0.381 . . . . 61.12 111.373 -178.629 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 40.2 m -75.28 -34.06 61.3 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.52 -0.309 . . . . 72.13 111.305 -178.256 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 172' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 4.3 pt20 -81.97 -25.56 34.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.247 0.546 . . . . 74.12 110.229 178.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 58.0 mmtt -81.25 109.11 15.46 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.587 -0.733 . . . . 71.45 110.762 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 11.8 t -67.2 -24.36 65.84 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.074 -0.713 . . . . 72.11 109.074 176.346 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 4.8 m -82.68 -12.26 57.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.411 -0.813 . . . . 73.42 111.617 -179.058 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.426 ' O ' ' HB2' ' B' ' 179' ' ' LEU . 79.1 mtp -121.77 -10.05 8.77 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.924 0.392 . . . . 71.05 111.441 -179.203 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 177' ' ' LYS . . . . . 0.403 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 89.0 tttt -64.81 -34.99 79.65 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.083 -0.508 . . . . 72.41 111.056 -177.259 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -84.43 -6.67 59.4 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 122.001 0.905 . . . . 65.54 109.494 -176.465 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 179' ' ' LEU . . . . . 0.488 ' HB3' HG21 ' A' ' 33' ' ' ILE . 11.0 mp -90.33 -56.29 3.27 Favored 'General case' 0 N--CA 1.438 -1.06 0 CA-C-N 114.054 -1.43 . . . . 73.54 109.801 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.01 -10.64 56.78 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.782 -0.644 . . . . 63.23 112.242 -173.364 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 181' ' ' LYS . . . . . 0.439 ' HA ' ' HB2' ' B' ' 184' ' ' LEU . 64.0 pttt -64.8 -5.92 6.97 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.405 -0.518 . . . . 73.02 111.493 178.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -74.75 -30.99 61.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.201 -0.454 . . . . 62.13 110.434 175.525 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 10.7 p -104.58 -18.87 6.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 52.33 110.764 -178.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 184' ' ' LEU . . . . . 0.439 ' HB2' ' HA ' ' B' ' 181' ' ' LYS . 9.1 mp . . . . . 0 C--N 1.33 -0.258 0 N-CA-C 109.898 -0.408 . . . . 74.43 109.898 176.276 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.438 ' HB3' HD11 ' B' ' 149' ' ' LEU . 53.1 p90 . . . . . 0 CA--C 1.52 -0.189 0 CA-C-O 120.713 0.292 . . . . 74.42 110.99 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.554 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 8.7 t30 -62.96 -57.23 11.45 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.211 -0.449 . . . . 60.13 111.478 -172.348 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.586 HG21 ' HB3' ' B' ' 179' ' ' LEU . 4.2 mp -65.35 -37.2 79.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.142 0.496 . . . . 71.11 110.985 -176.562 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.0 mt -63.92 -32.37 73.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.978 -0.555 . . . . 64.12 110.527 178.188 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -77.08 -29.16 54.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.745 -0.661 . . . . 72.4 110.417 178.53 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 95.6 mt-10 -70.21 -47.98 59.08 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.073 -0.512 . . . . 74.55 110.952 177.567 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -92.13 6.09 47.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.067 -0.515 . . . . 70.43 111.536 -175.48 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 57.2 60.67 2.84 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 113.089 0.774 . . . . 71.12 113.089 177.296 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -86.32 -1.1 57.21 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.883 -0.784 . . . . 75.4 108.883 167.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 60.43 78.15 0.34 Allowed Pre-proline 0 C--O 1.235 0.291 0 CA-C-N 114.333 -1.303 . . . . 64.22 110.946 -179.312 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -79.14 161.77 26.14 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.639 2.226 . . . . 72.02 111.529 177.061 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.7 mptt . . . . . 0 C--N 1.322 -0.626 0 CA-C-O 121.146 0.498 . . . . 72.03 111.63 -179.174 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.505 -0.765 0 N-CA-C 108.947 -0.76 . . . . 62.1 108.947 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.779 HD11 ' HB3' ' B' ' 131' ' ' PHE . 9.6 tp -66.01 -33.25 75.37 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.973 -0.751 . . . . 75.32 108.973 175.876 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.548 ' HB3' ' HG2' ' B' ' 142' ' ' LYS . . . 43.09 43.43 3.76 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 124.484 1.115 . . . . 75.1 112.639 169.859 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 41.6 p90 -84.55 165.08 18.33 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.061 -0.518 . . . . 51.42 110.544 -176.069 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -101.17 115.26 30.08 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.048 -0.524 . . . . 74.22 110.561 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.608 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 42.5 t -108.37 102.3 11.42 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.782 -0.644 . . . . 73.4 109.844 178.556 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.4 t70 68.2 8.39 6.53 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.878 -0.601 . . . . 72.2 111.435 174.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 129.52 -32.06 3.28 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.476 -0.869 . . . . 75.14 112.654 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.763 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 11.6 pt-20 -92.71 141.65 28.23 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.783 0.325 . . . . 74.11 110.602 -178.644 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.4 mm -85.88 120.71 36.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.708 -0.478 . . . . 72.32 109.708 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.763 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 26.7 mmmt -108.4 119.22 38.88 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.032 0.444 . . . . 73.13 110.634 -177.567 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.4 p -95.5 108.58 20.82 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.34 0.591 . . . . 65.25 111.838 -179.087 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -129.71 145.98 51.5 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.4 -0.818 . . . . 74.34 109.616 176.069 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.6 m -131.24 14.51 5.11 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.031 0.443 . . . . 71.1 110.576 178.164 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -152.3 173.14 15.4 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.991 -0.55 . . . . 71.34 109.631 177.523 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.1 mt -90.53 -25.68 20.12 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.264 0.468 . . . . 72.51 112.264 -174.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 51.0 tp60 -73.23 -43.55 61.02 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.651 0.262 . . . . 71.24 110.786 -173.431 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.0 p -68.09 -40.85 82.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.231 -0.44 . . . . 71.43 110.672 179.353 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.482 ' O ' HD23 ' A' ' 66' ' ' LEU . 6.3 tt -67.35 -36.65 81.82 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.05 -0.523 . . . . 72.5 109.969 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.642 ' HG3' HD13 ' A' ' 84' ' ' LEU . 66.7 ttt180 -58.21 -34.51 70.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.953 -0.567 . . . . 73.33 110.618 -179.269 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -59.27 -51.81 68.35 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.909 -0.587 . . . . 74.44 110.59 175.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -70.8 -45.94 63.73 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.024 -0.989 . . . . 72.52 111.195 -174.051 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.59 -31.22 71.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.298 -0.41 . . . . 62.2 111.859 -178.062 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.7 t -72.79 -40.88 65.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.706 0.289 . . . . 65.32 110.933 -178.644 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -82.85 -12.77 57.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.012 0.434 . . . . 74.44 111.226 -176.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.608 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 31.0 mmmt -80.78 143.37 32.92 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.244 -0.434 . . . . 74.25 110.141 174.216 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 5.5 m -77.18 -46.43 23.38 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.085 0.469 . . . . 61.3 109.949 178.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 14.0 p -70.15 -50.23 42.59 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.756 -0.657 . . . . 74.25 111.413 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.55 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 68.2 mtp -66.36 -20.13 65.99 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.409 -0.359 . . . . 74.45 111.571 -175.77 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 4.5 ttmp? -61.23 -31.76 71.55 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.017 0.437 . . . . 61.24 110.492 177.624 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -97.36 1.42 49.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.452 0.644 . . . . 50.31 110.585 -177.291 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.476 ' HB3' HG21 ' B' ' 133' ' ' ILE . 81.4 mt -98.12 -47.59 5.43 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.377 -0.828 . . . . 64.43 109.433 177.665 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.577 ' HB3' HD12 ' A' ' 84' ' ' LEU . 4.2 mm? -85.5 -8.57 58.27 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.492 -0.776 . . . . 65.13 111.463 -177.035 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -56.84 -20.63 23.82 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.868 0.366 . . . . 54.51 111.284 176.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -72.73 -45.54 58.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.192 -0.458 . . . . 74.11 111.46 -176.378 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 27.1 m -105.67 -22.6 4.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 112.494 0.553 . . . . 74.5 112.494 -174.149 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.642 HD13 ' HG3' ' A' ' 67' ' ' ARG . 94.2 mt . . . . . 0 C--N 1.324 -0.537 0 C-N-CA 120.753 -0.379 . . . . 70.32 110.107 -179.444 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 131' ' ' PHE . . . . . 0.779 ' HB3' HD11 ' A' ' 49' ' ' LEU . 53.8 p90 . . . . . 0 CA--C 1.52 -0.176 0 CA-C-O 120.743 0.306 . . . . 74.45 110.823 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 132' ' ' ASN . . . . . 0.409 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 7.5 t30 -62.79 -50.63 70.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.018 -0.537 . . . . 73.33 111.151 -173.614 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 133' ' ' ILE . . . . . 0.476 HG21 ' HB3' ' A' ' 79' ' ' LEU . 3.4 mp -68.39 -41.52 83.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.176 0.512 . . . . 73.22 110.456 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.409 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 88.8 mt -62.95 -29.22 70.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.739 -0.664 . . . . 43.23 111.172 -178.878 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -72.02 -40.11 68.7 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.197 -0.456 . . . . 70.43 110.692 179.77 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 136' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 9.6 mm-40 -72.8 -32.09 65.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.13 -0.486 . . . . 70.44 110.79 -178.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -95.48 3.72 53.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.005 -0.543 . . . . 72.51 111.072 -179.37 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 53.19 58.14 5.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.435 -0.802 . . . . 74.41 112.8 177.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 139' ' ' PHE . . . . . 0.409 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 3.4 m-85 -89.31 -1.07 57.92 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.282 0.563 . . . . 63.02 109.604 170.472 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 63.58 84.05 0.19 Allowed Pre-proline 0 C--O 1.233 0.225 0 CA-C-N 114.508 -1.224 . . . . 74.43 111.534 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 141' ' ' PRO . . . . . 0.488 ' HB3' ' HB2' ' B' ' 131' ' ' PHE . 60.0 Cg_endo -75.19 132.83 15.6 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.463 2.109 . . . . 52.32 110.604 172.849 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 142' ' ' LYS . . . . . 0.548 ' HG2' ' HB3' ' A' ' 50' ' ' ALA . 0.2 OUTLIER . . . . . 0 C--N 1.324 -0.533 0 N-CA-C 112.605 0.595 . . . . 74.33 112.605 -173.205 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 148' ' ' LYS . . . . . 0.416 ' HE3' ' HB2' ' B' ' 150' ' ' ALA . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.489 0 N-CA-C 109.896 -0.409 . . . . 71.25 109.896 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.628 ' HB3' ' HD1' ' B' ' 151' ' ' PHE . 4.2 mm? -53.44 -46.15 69.74 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 123.48 0.488 . . . . 72.14 109.963 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.416 ' HB2' ' HE3' ' B' ' 148' ' ' LYS . . . 48.14 36.35 6.48 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 124.118 0.886 . . . . 22.13 111.871 174.634 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 151' ' ' PHE . . . . . 0.628 ' HD1' ' HB3' ' B' ' 149' ' ' LEU . 42.3 p90 -82.59 169.68 16.02 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.099 -0.5 . . . . 72.31 109.952 -178.846 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 28.4 ttmt -106.39 125.34 50.87 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.214 -0.448 . . . . 65.34 110.581 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 153' ' ' CYS . . . . . . . . . . . . . 35.4 t -124.96 105.2 9.03 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.279 -0.637 . . . . 60.54 109.279 177.693 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 34.7 t70 67.19 28.6 8.09 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.529 0.68 . . . . 62.01 110.81 176.536 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 107.12 -35.76 4.83 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.552 -0.832 . . . . 73.21 112.877 175.616 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 156' ' ' GLU . . . . . 0.401 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 10.7 pt-20 -92.87 145.26 24.52 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.047 0.451 . . . . 54.32 110.762 -177.495 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 50.0 mm -84.74 125.13 40.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.755 -0.657 . . . . 54.24 110.06 -179.139 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 158' ' ' LYS . . . . . 0.401 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 28.6 mmmt -106.17 110.77 23.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.141 0.496 . . . . 72.31 110.063 -178.579 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -98.34 107.49 19.97 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.924 -0.58 . . . . 72.11 112.119 -175.471 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -131.53 151.97 51.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.54 -0.755 . . . . 75.44 109.928 176.821 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 64.3 m -131.29 5.63 4.45 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.346 0.594 . . . . 63.15 109.89 173.464 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -125.4 145.13 50.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.541 -0.754 . . . . 64.31 109.894 -179.418 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.58 -35.11 70.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.098 0.475 . . . . 51.11 109.776 178.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 164' ' ' GLN . . . . . 0.473 ' O ' ' HG2' ' B' ' 168' ' ' LYS . 50.5 tp60 -66.72 -42.73 85.86 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.934 -0.575 . . . . 72.14 111.414 -176.29 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 10.3 p -69.6 -39.22 77.38 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.846 0.355 . . . . 64.13 110.925 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 54.0 tp -65.53 -36.24 83.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.964 0.412 . . . . 72.42 109.973 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 167' ' ' ARG . . . . . 0.429 ' HB3' ' O ' ' B' ' 164' ' ' GLN . 61.4 ttt180 -57.29 -39.84 76.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.711 -0.677 . . . . 74.4 110.57 174.176 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 168' ' ' LYS . . . . . 0.491 ' HB3' ' NZ ' ' B' ' 168' ' ' LYS . 2.8 mmmp? -60.39 -39.24 86.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.717 -0.674 . . . . 62.35 110.91 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -77.66 -45.02 26.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.081 -0.509 . . . . 64.21 110.799 -178.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 170' ' ' ALA . . . . . 0.755 ' HB2' HD12 ' B' ' 180' ' ' LEU . . . -59.19 -38.1 79.02 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.115 -0.493 . . . . 75.43 111.666 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 8.7 t -65.55 -31.68 72.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.092 -0.504 . . . . 72.32 111.157 -176.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -94.17 4.62 53.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.988 0.423 . . . . 71.44 110.718 -179.474 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -105.55 140.84 38.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.23 -0.441 . . . . 74.55 110.477 177.629 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.4 p -67.26 -54.92 16.47 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.994 -0.548 . . . . 71.22 111.166 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 175' ' ' SER . . . . . 0.444 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 25.0 p -76.55 -46.99 24.06 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.829 -0.623 . . . . 71.43 111.653 -174.548 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 69.8 mtp -66.49 -21.59 66.18 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.127 0.417 . . . . 74.23 112.127 -174.322 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 177' ' ' LYS . . . . . 0.417 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 4.2 ttmp? -64.94 -29.26 70.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.21 0.528 . . . . 63.12 109.828 176.132 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -94.7 -13.77 25.45 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 115.578 -0.737 . . . . 62.54 110.084 -176.713 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 179' ' ' LEU . . . . . 0.586 ' HB3' HG21 ' A' ' 33' ' ' ILE . 81.6 mt -86.71 -47.94 8.7 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.389 -0.823 . . . . 60.45 109.823 178.845 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 180' ' ' LEU . . . . . 0.755 HD12 ' HB2' ' B' ' 170' ' ' ALA . 8.9 mt -89.81 -2.17 58.16 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.759 -0.655 . . . . 64.45 111.339 -173.212 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 181' ' ' LYS . . . . . 0.417 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 64.1 pttt -64.92 -9.07 18.41 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.298 0.571 . . . . 74.42 110.518 173.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -61.71 -33.88 74.81 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.571 -0.741 . . . . 55.25 109.914 175.646 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 14.3 p -113.15 -29.4 2.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 115.845 -0.616 . . . . 62.5 110.99 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 184' ' ' LEU . . . . . . . . . . . . . 91.8 mt . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 116.431 -0.35 . . . . 75.03 110.975 -176.796 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 13.4 p90 . . . . . 0 C--O 1.233 0.186 0 CA-C-O 121.145 0.497 . . . . 70.22 110.292 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -65.38 -43.04 92.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.548 -0.751 . . . . 72.52 111.074 -176.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.839 HG21 ' HB3' ' B' ' 179' ' ' LEU . 38.5 mm -60.41 -40.27 83.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-O 121.478 0.656 . . . . 72.4 110.594 177.176 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.705 HD12 HD21 ' B' ' 149' ' ' LEU . 82.9 mt -69.23 -25.84 64.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.489 -0.778 . . . . 73.1 110.71 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 54.1 ttt180 -67.47 -47.49 69.95 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.117 -0.492 . . . . 71.55 110.085 175.681 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -64.11 -39.3 93.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.499 -0.773 . . . . 63.14 111.777 -177.366 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -97.43 8.37 44.74 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.348 -0.387 . . . . 52.3 111.036 -175.386 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 14.3 t70 53.32 64.38 1.87 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.213 -0.903 . . . . 70.4 111.949 177.131 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.667 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 16.8 m-85 -92.82 -6.24 49.29 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.307 -0.627 . . . . 73.1 109.307 167.85 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 69.43 88.43 0.1 Allowed Pre-proline 0 CA--C 1.53 0.182 0 CA-C-N 114.789 -1.096 . . . . 71.2 111.233 -178.883 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.443 ' HA ' HD11 ' B' ' 149' ' ' LEU . 16.8 Cg_exo -67.23 135.03 35.63 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.633 2.222 . . . . 71.42 110.505 174.119 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.657 ' H ' HD12 ' B' ' 149' ' ' LEU . 33.4 tptt . . . . . 0 C--N 1.329 -0.322 0 C-N-CA 120.284 -0.566 . . . . 53.13 111.565 -171.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.451 -0.396 0 N-CA-C 109.637 -0.505 . . . . 61.2 109.637 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.735 ' HB3' ' HD1' ' A' ' 51' ' ' PHE . 7.1 mp -57.74 -44.77 86.29 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.334 0.494 . . . . 72.45 112.334 -173.896 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.858 ' HB3' ' HD2' ' B' ' 142' ' ' LYS . . . 39.49 49.48 1.94 Allowed 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.806 0.691 . . . . 74.34 111.85 -179.422 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.735 ' HD1' ' HB3' ' A' ' 49' ' ' LEU . 48.4 p90 -88.48 167.92 13.05 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.889 -0.596 . . . . 74.42 110.415 -175.467 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.411 ' HE3' ' HB2' ' A' ' 52' ' ' LYS . 29.3 ttmt -99.68 115.0 28.46 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.223 0.535 . . . . 74.52 110.809 -178.161 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.553 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 34.9 t -110.47 95.23 5.44 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.668 -0.696 . . . . 74.34 110.018 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 69.08 12.45 8.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.998 -1.001 . . . . 43.55 112.3 176.23 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 138.78 -40.87 1.41 Allowed Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.523 -0.846 . . . . 44.21 112.675 176.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.485 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 9.8 pt-20 -96.42 150.91 20.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.106 0.479 . . . . 73.02 111.157 -175.258 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.6 mm -83.44 120.57 34.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.585 -0.734 . . . . 45.4 110.533 178.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.555 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 29.1 mmmt -106.25 106.92 17.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.02 -0.536 . . . . 73.15 110.124 -179.574 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -81.44 98.49 8.26 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.952 0.406 . . . . 74.14 111.256 178.545 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.555 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 41.3 m-85 -117.74 138.26 52.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.228 -0.442 . . . . 73.33 110.953 179.455 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 4.3 p -136.78 3.96 2.76 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.565 -0.743 . . . . 53.31 109.979 175.023 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.464 ' OD2' ' HB3' ' A' ' 64' ' ' GLN . 29.9 t70 -125.18 122.44 37.07 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.416 -0.811 . . . . 65.31 109.965 -178.885 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.1 tt -66.98 -42.82 84.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 72.43 110.032 -176.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.464 ' HB3' ' OD2' ' A' ' 62' ' ' ASP . 51.1 tt0 -51.77 -50.69 60.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.815 -0.629 . . . . 74.23 111.376 -179.719 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 10.5 m -69.21 -38.02 78.36 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.855 -0.611 . . . . 60.23 110.934 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.5 tp -68.79 -38.68 80.16 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.234 -0.439 . . . . 62.2 111.001 -178.018 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -57.28 -43.15 82.85 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.076 -0.511 . . . . 73.04 111.135 179.065 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -63.48 -40.43 97.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 72.42 110.429 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.506 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 81.3 t80 -67.55 -42.41 82.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.757 -0.656 . . . . 75.43 110.598 179.124 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.98 -32.52 73.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.998 -0.547 . . . . 72.32 111.293 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.4 m -71.61 -31.81 67.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.401 -0.363 . . . . 63.14 111.377 -179.278 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.506 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 20.6 pt20 -85.21 -9.5 57.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.229 0.538 . . . . 54.13 110.394 179.285 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.553 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 28.3 mmmt -93.42 111.24 22.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.713 -0.676 . . . . 73.3 109.651 174.46 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.6 m -55.55 -37.11 67.56 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.669 0.271 . . . . 74.31 111.137 -178.058 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.548 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 21.6 m -75.33 -42.92 53.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.569 -0.287 . . . . 71.43 111.325 -178.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.464 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 80.8 mtp -77.87 -24.16 48.6 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.659 0.266 . . . . 72.22 111.614 -174.436 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -60.13 -36.7 78.08 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.853 0.359 . . . . 73.41 111.31 -179.315 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -84.42 -16.11 43.81 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.953 0.883 . . . . 72.31 109.473 -174.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 75' ' ' SER . 59.6 mt -81.1 -51.78 8.09 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 114.312 -1.313 . . . . 54.4 109.697 178.366 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 80' ' ' LEU . 4.2 mm? -78.49 -30.45 47.24 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.374 -0.83 . . . . 72.2 112.638 -174.001 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -64.53 -10.18 24.09 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 118.367 0.531 . . . . 72.04 112.003 -173.097 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -75.55 -39.66 57.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.912 0.387 . . . . 73.31 110.98 -177.91 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 27.7 m -114.59 -5.92 11.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.091 -0.504 . . . . 70.32 110.92 -178.828 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 67.9 tp . . . . . 0 C--N 1.321 -0.649 0 CA-C-N 115.777 -0.647 . . . . 75.34 109.841 -178.849 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 48.3 p90 . . . . . 0 N--CA 1.456 -0.164 0 N-CA-C 111.775 0.287 . . . . 65.24 111.775 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 132' ' ' ASN . . . . . 0.544 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 63.7 t30 -59.75 -50.25 74.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.096 0.474 . . . . 72.14 110.201 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 133' ' ' ILE . . . . . 0.545 ' CG2' ' HB3' ' A' ' 79' ' ' LEU . 46.8 mm -59.38 -48.19 87.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.679 -0.691 . . . . 73.24 110.966 -179.033 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 80.9 mt -57.86 -36.58 72.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.022 -0.535 . . . . 73.14 111.263 177.039 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 36.9 ttt180 -67.17 -44.21 80.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.231 -0.44 . . . . 75.34 110.532 179.393 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 136' ' ' GLU . . . . . 0.544 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 10.6 mm-40 -68.3 -39.67 81.98 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.923 -0.581 . . . . 73.42 111.562 -178.046 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 52.4 m-80 -90.0 5.16 47.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.996 0.427 . . . . 74.52 110.695 -179.258 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 11.8 t70 56.53 57.03 5.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.112 -0.949 . . . . 74.4 112.19 173.781 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -90.61 8.9 31.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.791 -0.64 . . . . 72.05 109.996 173.052 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 60.61 80.93 0.25 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 114.926 -1.034 . . . . 73.42 111.488 -176.434 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -71.15 156.12 60.02 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 121.732 1.622 . . . . 61.33 109.831 171.389 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 142' ' ' LYS . . . . . 0.858 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.551 0 C-N-CA 120.239 -0.585 . . . . 70.23 111.739 -176.804 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.59 0 N-CA-C 108.14 -1.059 . . . . 74.21 108.14 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.705 HD21 HD12 ' A' ' 34' ' ' LEU . 63.0 tp -73.68 85.79 1.64 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.101 -0.5 . . . . 75.21 110.173 -176.446 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -90.71 86.51 6.37 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.366 -0.833 . . . . 73.22 110.485 178.528 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 151' ' ' PHE . . . . . 0.599 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 51.6 p90 -103.24 171.23 7.49 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.934 -0.575 . . . . 65.43 109.785 178.492 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -106.5 125.76 51.41 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.088 0.47 . . . . 54.24 111.009 -179.07 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 153' ' ' CYS . . . . . 0.43 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 48.6 t -122.09 104.29 9.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.74 -0.663 . . . . 72.23 109.746 176.647 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 65.38 26.48 12.0 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.809 -0.632 . . . . 65.13 111.504 176.304 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 114.94 -35.95 4.15 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.719 -0.753 . . . . 53.21 113.148 176.573 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -92.64 145.13 24.66 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.971 0.415 . . . . 73.24 110.909 -176.184 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.2 mm -83.0 131.31 34.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.893 -0.594 . . . . 64.45 109.669 175.611 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 158' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -117.05 100.7 7.92 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.319 -0.401 . . . . 55.55 110.468 -177.786 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.09 103.45 10.91 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.127 0.489 . . . . 44.31 111.318 178.313 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -116.6 113.87 23.31 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.962 -0.563 . . . . 74.31 110.84 177.315 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 14.5 m -103.79 -0.14 29.66 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.454 0.645 . . . . 60.3 109.753 174.329 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 162' ' ' ASP . . . . . 0.418 ' OD2' ' HB3' ' B' ' 164' ' ' GLN . 0.3 OUTLIER -133.65 141.78 47.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.3 -0.864 . . . . 73.14 110.612 -175.936 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 44.8 tp -71.6 -34.33 69.8 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.952 -0.567 . . . . 74.34 111.341 -177.347 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 164' ' ' GLN . . . . . 0.467 ' O ' ' HG3' ' B' ' 168' ' ' LYS . 46.9 tt0 -60.09 -49.19 78.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.071 0.462 . . . . 73.11 110.238 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 20.9 m -58.43 -42.5 87.43 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.559 -0.746 . . . . 63.42 111.21 178.332 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 67.4 tp -68.66 -40.34 80.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.451 -0.341 . . . . 64.32 110.756 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 167' ' ' ARG . . . . . 1.098 ' HG3' HD21 ' B' ' 184' ' ' LEU . 15.1 ttp180 -61.11 -44.64 97.03 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.357 -0.383 . . . . 74.14 110.38 -178.783 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 168' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' B' ' 164' ' ' GLN . 48.9 mtmt -60.32 -29.77 69.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.978 -0.555 . . . . 71.14 111.317 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -84.7 -50.19 7.84 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.337 -0.392 . . . . 54.23 110.762 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.53 -32.82 74.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.084 -0.507 . . . . 70.42 111.968 -176.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 17.6 t -69.6 -19.0 63.66 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.886 0.328 . . . . 71.55 111.886 -176.497 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -104.88 2.34 29.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.912 0.387 . . . . 74.42 110.485 177.489 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 173' ' ' LYS . . . . . 0.43 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 29.6 mmmt -103.04 111.48 23.84 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.767 -0.651 . . . . 72.52 110.056 179.003 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 69.5 m -55.41 -34.38 64.34 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.8 0.333 . . . . 75.12 111.775 -178.152 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 175' ' ' SER . . . . . 0.46 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 6.8 m -77.03 -46.49 23.56 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.899 0.38 . . . . 75.13 110.975 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.401 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 73.9 mtp -78.31 -21.97 48.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.588 -0.278 . . . . 74.02 111.471 -173.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 177' ' ' LYS . . . . . 0.473 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 79.2 tttt -58.65 -37.46 76.01 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.164 0.507 . . . . 74.1 110.393 178.283 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -85.36 -13.95 47.9 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.6 0.714 . . . . 72.12 109.916 -175.519 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 179' ' ' LEU . . . . . 0.839 ' HB3' HG21 ' A' ' 33' ' ' ILE . 59.3 mt -84.28 -50.03 8.23 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 114.674 -1.148 . . . . 75.14 110.351 -179.296 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -88.84 -20.09 25.08 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.594 0.59 . . . . 71.03 112.594 -173.471 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 181' ' ' LYS . . . . . 0.473 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 62.7 pttt -59.95 -18.41 45.09 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.2 0.445 . . . . 64.31 112.2 -174.287 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -55.76 -49.42 73.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.004 0.43 . . . . 64.33 110.879 -177.272 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 18.4 m -109.71 3.66 9.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.768 -0.651 . . . . 42.43 110.48 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 184' ' ' LEU . . . . . 1.098 HD21 ' HG3' ' B' ' 167' ' ' ARG . 46.1 tp . . . . . 0 N--CA 1.447 -0.614 0 CA-C-N 115.956 -0.565 . . . . 73.3 110.352 -175.823 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 44.3 p90 . . . . . 0 N--CA 1.474 0.735 0 N-CA-C 112.887 0.699 . . . . 73.45 112.887 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -61.72 -53.33 57.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 64.24 111.108 -174.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.509 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 48.9 mm -59.3 -43.65 90.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.924 -0.58 . . . . 73.45 110.832 -177.597 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 86.5 mt -63.26 -35.13 79.33 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.759 -0.655 . . . . 74.41 111.012 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.439 HH11 ' HD3' ' A' ' 35' ' ' ARG . 35.0 ttt180 -70.58 -46.6 63.17 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.92 0.391 . . . . 64.35 110.322 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -59.21 -46.4 88.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.903 -0.59 . . . . 61.34 111.308 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -86.89 1.34 52.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.983 -0.553 . . . . 73.15 111.227 -177.03 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.6 t70 60.64 71.26 0.57 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.33 -0.85 . . . . 74.0 112.455 175.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -96.41 -6.8 36.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.508 -0.769 . . . . 74.43 110.105 167.474 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 57.84 73.69 0.72 Allowed Pre-proline 0 CA--C 1.53 0.199 0 CA-C-N 115.263 -0.881 . . . . 62.14 110.582 -176.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -78.44 150.35 25.05 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 122.918 2.412 . . . . 73.53 112.629 -177.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.554 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 5.5 mptp? . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 115.859 -0.61 . . . . 74.12 109.681 177.027 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.485 ' HB3' ' OG ' ' A' ' 61' ' ' SER . 0.1 OUTLIER . . . . . 0 CA--C 1.51 -0.568 0 N-CA-C 110.092 -0.336 . . . . 73.14 110.092 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.562 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.0 mp -69.64 82.06 0.42 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.155 -0.475 . . . . 52.24 109.957 175.065 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.454 ' H ' ' HB2' ' B' ' 142' ' ' LYS . . . -82.56 67.38 8.59 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.259 0.552 . . . . 74.31 110.365 178.14 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.562 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 49.2 p90 -97.85 164.51 12.35 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.883 -0.599 . . . . 75.14 110.672 -177.714 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.411 ' HD2' ' C ' ' A' ' 55' ' ' GLY . 11.2 tppt? -88.41 123.97 33.49 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.636 -0.711 . . . . 73.3 110.57 -178.894 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 17.6 t -141.72 119.84 12.12 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.326 -0.397 . . . . 63.15 109.954 176.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 69.99 13.9 7.87 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.711 -0.677 . . . . 73.54 112.194 177.561 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.411 ' C ' ' HD2' ' A' ' 52' ' ' LYS . . . 104.64 -18.53 43.95 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.33 -0.938 . . . . 54.21 112.351 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -110.37 153.04 25.5 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.86 0.362 . . . . 65.3 110.08 179.454 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 47.6 mm -81.31 115.48 23.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.739 -0.467 . . . . 72.34 109.739 177.308 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -101.19 103.17 14.19 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.403 -0.362 . . . . 70.42 110.223 -177.63 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.58 124.82 28.57 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.391 -0.368 . . . . 72.12 111.526 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.428 ' CE2' ' HA ' ' A' ' 66' ' ' LEU . 74.6 m-85 -124.38 104.04 8.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.144 0.497 . . . . 70.31 111.44 176.837 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.485 ' OG ' ' HB3' ' A' ' 48' ' ' LYS . 5.8 m -95.2 -2.81 48.92 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.389 -0.823 . . . . 73.14 109.407 173.988 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -130.86 136.94 49.1 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.225 -0.898 . . . . 72.34 110.783 -177.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.6 tp -81.95 -27.24 33.37 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.909 -0.587 . . . . 65.03 110.801 -177.144 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 63.5 tp60 -65.91 -44.2 85.93 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.244 0.545 . . . . 75.32 110.112 -178.742 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.424 ' HA ' ' HZ2' ' A' ' 68' ' ' LYS . 45.5 m -65.66 -41.16 92.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.665 -0.698 . . . . 73.01 110.567 175.522 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.428 ' HA ' ' CE2' ' A' ' 60' ' ' PHE . 45.8 tp -61.1 -46.8 89.14 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 63.25 111.05 -178.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.449 ' HG3' HD21 ' A' ' 84' ' ' LEU . 50.3 ttt-85 -55.31 -48.34 74.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.135 -0.484 . . . . 65.11 111.063 178.292 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.424 ' HZ2' ' HA ' ' A' ' 65' ' ' SER . 9.9 mtmp? -70.52 -30.39 67.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.199 -0.455 . . . . 72.54 111.333 -177.713 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.514 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 81.7 t80 -70.22 -45.86 65.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.309 -0.405 . . . . 53.22 110.149 176.952 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.21 -30.48 71.62 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.095 0.474 . . . . 73.12 110.465 178.17 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.5 t -71.02 -29.61 65.58 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.721 -0.672 . . . . 64.11 111.226 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.514 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 9.7 pt20 -86.66 -9.48 55.9 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.215 0.531 . . . . 71.32 110.01 177.828 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.917 ' HE2' ' HA ' ' A' ' 73' ' ' LYS . 9.0 mmpt? -81.79 164.03 21.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.653 -0.703 . . . . 74.11 109.945 176.073 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.2 t -100.45 -42.82 6.44 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.239 -0.652 . . . . 71.23 109.239 173.585 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.49 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 15.1 p -73.16 -58.8 3.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.648 -0.706 . . . . 71.4 110.778 179.018 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.457 ' HA ' HD12 ' A' ' 79' ' ' LEU . 86.9 mtp -65.09 -17.2 64.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.68 -0.691 . . . . 75.13 111.746 -176.564 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.535 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 24.8 ttpp -59.02 -38.32 78.99 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.272 -0.422 . . . . 65.25 110.825 -178.792 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -106.8 5.05 28.2 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.164 0.507 . . . . 72.01 110.816 -178.753 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.763 ' HB3' HG21 ' B' ' 133' ' ' ILE . 31.2 mt -81.41 -54.0 5.83 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.819 -0.628 . . . . 72.23 110.301 176.682 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.53 -5.59 50.61 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.095 -0.502 . . . . 75.34 111.98 -174.13 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 62.7 pttt -65.93 -9.07 26.29 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.958 0.408 . . . . 72.14 111.19 -178.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -61.02 -37.53 82.89 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.774 -0.648 . . . . 75.13 110.406 176.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 14.8 p -115.54 -23.18 4.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.801 -0.636 . . . . 74.03 110.453 178.46 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.462 ' O ' ' HA ' ' A' ' 81' ' ' LYS . 58.8 tp . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 115.975 -0.557 . . . . 75.13 110.315 -179.638 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 39.0 p90 . . . . . 0 N--CA 1.478 0.928 0 N-CA-C 113.27 0.841 . . . . 73.5 113.27 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 132' ' ' ASN . . . . . 0.479 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 27.3 p-10 -58.55 -48.49 80.7 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.77 0.319 . . . . 61.25 111.431 -174.272 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 133' ' ' ILE . . . . . 0.763 HG21 ' HB3' ' A' ' 79' ' ' LEU . 43.0 mm -64.73 -41.21 91.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.101 0.477 . . . . 73.41 111.156 -177.766 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.447 HD22 HD23 ' A' ' 49' ' ' LEU . 9.8 mp -65.45 -35.87 82.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.737 -0.665 . . . . 75.44 110.613 179.535 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -69.92 -41.65 74.36 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.79 -0.641 . . . . 62.31 110.264 177.498 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 136' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 5.8 mm-40 -64.25 -42.2 96.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.964 -0.562 . . . . 75.44 111.456 178.732 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -94.17 7.43 45.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.328 -0.396 . . . . 55.44 111.672 -175.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 10.4 t70 60.97 43.32 11.69 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.794 -0.639 . . . . 74.21 112.233 172.528 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -74.05 -10.56 59.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.877 0.37 . . . . 71.2 110.66 172.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 58.09 78.26 0.37 Allowed Pre-proline 0 C--O 1.232 0.182 0 CA-C-N 115.325 -0.852 . . . . 63.21 110.313 -174.033 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 141' ' ' PRO . . . . . 0.414 ' HG3' ' HB3' ' B' ' 134' ' ' LEU . 10.9 Cg_endo -86.17 145.71 8.58 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 122.887 2.391 . . . . 52.11 112.418 -178.77 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 142' ' ' LYS . . . . . 0.454 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 4.7 mptp? . . . . . 0 C--N 1.323 -0.555 0 CA-C-N 116.097 -0.502 . . . . 70.54 110.028 178.587 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.507 -0.707 0 N-CA-C 109.553 -0.536 . . . . 73.42 109.553 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.477 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.8 mp -68.42 75.76 0.26 Allowed 'General case' 0 C--O 1.219 -0.535 0 O-C-N 123.91 0.756 . . . . 72.22 109.558 174.463 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.554 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -81.98 59.25 4.26 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.202 0.525 . . . . 62.5 110.451 -179.123 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 151' ' ' PHE . . . . . 0.477 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 44.2 p90 -86.84 162.78 17.58 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.662 -0.699 . . . . 71.32 110.588 -177.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 152' ' ' LYS . . . . . 0.432 ' HD3' ' CD1' ' B' ' 157' ' ' ILE . 21.6 tptt -92.76 113.47 25.75 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.518 -0.765 . . . . 64.34 109.659 -177.283 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 153' ' ' CYS . . . . . 0.536 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 29.9 t -123.29 96.12 4.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.01 0.433 . . . . 62.43 110.44 -176.982 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 57.91 55.05 5.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.174 -0.921 . . . . 70.45 111.628 179.282 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 95.17 -35.85 4.08 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.596 -0.729 . . . . 73.14 113.054 172.251 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -107.31 141.13 39.13 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.22 0.533 . . . . 60.1 111.277 -175.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 157' ' ' ILE . . . . . 0.432 ' CD1' ' HD3' ' B' ' 152' ' ' LYS . 43.3 mm -76.01 119.51 24.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.522 -0.763 . . . . 74.41 109.525 174.717 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 158' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -106.28 97.79 7.55 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.909 -0.316 . . . . 74.24 110.386 -177.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 2.6 p -76.47 124.24 27.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.221 -0.445 . . . . 73.42 111.815 -177.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 86.9 m-85 -125.37 107.32 10.57 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.27 -0.423 . . . . 64.22 111.206 176.093 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 39.6 m -97.21 -0.67 46.39 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.748 -0.66 . . . . 51.21 109.448 172.108 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -129.56 131.84 46.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.198 -0.91 . . . . 75.01 109.797 -179.233 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 51.0 tp -76.49 -35.35 58.44 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.354 -0.385 . . . . 73.11 110.79 -175.501 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -62.27 -44.64 96.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.936 0.398 . . . . 71.42 110.491 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 165' ' ' SER . . . . . 0.674 ' HA ' ' HE2' ' B' ' 168' ' ' LYS . 32.0 m -61.55 -32.14 72.2 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.976 -0.557 . . . . 72.53 110.932 178.411 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 49.5 tp -68.09 -40.16 82.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 75.42 110.414 179.064 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 167' ' ' ARG . . . . . 0.555 ' HG3' HD21 ' B' ' 184' ' ' LEU . 24.2 ttt180 -57.22 -45.65 83.67 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.047 0.451 . . . . 74.41 110.543 175.745 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 168' ' ' LYS . . . . . 0.674 ' HE2' ' HA ' ' B' ' 165' ' ' SER . 52.0 mtmt -63.34 -36.46 83.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.519 -0.764 . . . . 62.2 111.195 -179.086 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -71.26 -44.95 64.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.092 -0.504 . . . . 74.5 110.736 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.08 -28.65 69.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.212 -0.449 . . . . 72.51 110.972 -179.514 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 33.2 t -66.29 -30.92 71.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.96 -0.564 . . . . 64.31 111.29 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -100.53 10.93 40.52 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.098 0.475 . . . . 74.21 110.695 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 173' ' ' LYS . . . . . 0.536 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 30.7 mmmt -108.05 117.88 35.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.939 -0.573 . . . . 61.4 110.738 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 39.8 t -64.27 -37.13 86.38 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.956 -0.565 . . . . 71.13 110.456 -178.227 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 16.9 p -78.25 -35.75 47.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.748 -0.66 . . . . 71.51 111.778 -177.054 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 76.9 mtp -90.7 -16.64 28.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.317 -0.401 . . . . 74.23 111.824 -172.168 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -56.68 -37.73 71.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.495 -0.321 . . . . 70.23 111.558 -177.87 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -96.73 0.15 49.13 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.305 0.574 . . . . 63.5 110.529 -174.358 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 179' ' ' LEU . . . . . 0.509 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 59.6 mt -88.72 -51.97 5.38 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.245 -0.889 . . . . 31.43 109.408 176.076 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.0 -19.64 59.99 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.368 -0.833 . . . . 74.22 111.797 -176.826 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -60.34 -15.08 22.25 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.057 0.391 . . . . 63.12 112.057 -177.65 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -75.05 -32.54 61.56 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.086 0.47 . . . . 62.5 110.659 -173.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 27.0 m -117.05 -15.39 9.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.811 -0.631 . . . . 60.42 110.997 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 184' ' ' LEU . . . . . 0.555 HD21 ' HG3' ' B' ' 167' ' ' ARG . 42.5 tp . . . . . 0 C--N 1.325 -0.467 0 CA-C-N 116.024 -0.534 . . . . 71.15 109.969 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.49 ' HB2' ' HB2' ' A' ' 41' ' ' PRO . 14.0 p90 . . . . . 0 N--CA 1.456 -0.17 0 CA-C-O 120.491 0.186 . . . . 73.35 110.991 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.418 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 12.1 t30 -61.58 -53.68 53.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.454 -0.339 . . . . 73.42 111.114 -173.387 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.447 ' H ' HD12 ' A' ' 33' ' ' ILE . 3.6 mp -62.77 -39.73 85.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.134 0.493 . . . . 72.4 110.378 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.498 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 88.8 mt -62.49 -34.79 77.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.014 -0.539 . . . . 64.45 110.736 178.362 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -69.88 -38.67 76.46 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.141 -0.481 . . . . 75.1 110.441 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 34.1 mm-40 -65.93 -31.3 72.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.052 -0.522 . . . . 71.21 111.08 178.854 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -100.39 4.35 43.82 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.13 -0.486 . . . . 73.44 111.281 -177.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.5 t0 67.69 47.09 1.21 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.617 -0.719 . . . . 74.02 112.054 171.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.498 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 28.7 m-85 -81.21 -7.63 59.6 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.525 -0.307 . . . . 64.21 111.608 173.215 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.93 69.53 1.35 Allowed Pre-proline 0 CA--C 1.538 0.515 0 CA-C-O 121.321 0.581 . . . . 71.14 110.076 -175.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.551 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 87.2 Cg_endo -89.07 175.75 3.38 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 123.017 2.478 . . . . 75.55 112.637 -177.928 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.431 ' HD2' ' C ' ' A' ' 41' ' ' PRO . 12.7 mptt . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 116.276 -0.42 . . . . 72.22 111.125 -178.03 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.509 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.727 0.298 . . . . 63.52 111.022 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.653 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.9 mp -73.67 92.18 1.95 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.904 -0.589 . . . . 72.02 110.889 -177.859 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -94.11 68.18 3.7 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.272 -0.64 . . . . 73.2 109.272 171.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.653 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 44.9 p90 -91.68 165.12 13.47 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.994 -0.548 . . . . 75.41 111.132 -173.288 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.2 tptm -92.24 116.61 29.11 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.568 -0.742 . . . . 65.11 110.338 -176.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.554 ' HB3' ' HG2' ' A' ' 58' ' ' LYS . 47.3 t -120.06 100.49 7.24 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.993 0.425 . . . . 65.31 110.362 178.871 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 64.41 15.9 9.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.265 -0.88 . . . . 64.22 112.317 174.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.63 -32.26 3.92 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.297 -0.954 . . . . 74.14 112.638 177.201 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -100.66 153.74 19.17 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 110.117 -0.327 . . . . 75.53 110.117 -179.666 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 48.1 mm -83.9 116.48 27.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.401 -0.363 . . . . 72.33 110.166 177.243 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.739 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 31.8 mmmt -101.01 115.9 31.56 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.381 -0.6 . . . . 73.23 109.381 177.006 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -97.8 112.06 24.11 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.864 -0.607 . . . . 72.45 111.16 -174.716 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.739 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 23.8 m-85 -121.6 140.72 51.89 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.839 -0.619 . . . . 64.22 111.228 -178.239 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.509 ' HB3' ' HB3' ' A' ' 48' ' ' LYS . 17.1 p -137.08 15.55 3.04 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.811 -0.631 . . . . 74.22 109.75 175.713 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.466 ' OD2' ' HB3' ' A' ' 64' ' ' GLN . 4.9 t70 -148.1 127.55 13.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.488 -0.778 . . . . 73.32 110.692 -177.681 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 56.1 tp -68.25 -29.61 68.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.915 -0.584 . . . . 74.04 111.144 -177.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.466 ' HB3' ' OD2' ' A' ' 62' ' ' ASP . 44.3 tt0 -62.1 -47.92 82.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.26 0.552 . . . . 61.33 109.674 178.339 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 42.6 m -58.03 -45.05 87.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.389 -0.823 . . . . 75.04 111.109 177.097 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 37.1 tp -68.71 -34.63 75.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.285 -0.416 . . . . 73.41 110.977 -177.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 67' ' ' ARG . 46.4 ttp180 -61.96 -31.91 72.29 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.143 0.497 . . . . 71.45 110.463 177.663 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 64' ' ' GLN . 3.8 mtmp? -75.71 -42.62 50.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.988 -0.551 . . . . 74.32 110.343 176.514 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.469 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 63.7 t80 -65.98 -41.98 90.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.652 -0.703 . . . . 74.34 111.011 -176.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.38 -26.89 64.88 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.524 -0.307 . . . . 63.0 111.009 177.504 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.7 t -75.58 -28.6 59.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.915 0.388 . . . . 73.1 110.522 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 19.9 pt20 -87.69 -10.53 50.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.383 0.611 . . . . 72.3 109.847 176.059 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.458 ' O ' ' HE3' ' A' ' 77' ' ' LYS . 26.9 mmmt -94.03 163.33 13.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.334 -0.848 . . . . 71.21 109.431 173.016 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.1 t -105.42 -44.86 4.61 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.645 -0.502 . . . . 65.41 109.645 176.177 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.594 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 17.7 p -65.91 -53.35 40.57 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.969 -0.56 . . . . 70.51 110.891 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 81.3 mtp -64.87 -26.63 68.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.786 -0.643 . . . . 74.12 111.383 -177.005 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.458 ' HE3' ' O ' ' A' ' 73' ' ' LYS . 37.1 ttmt -61.12 -34.12 74.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.268 0.556 . . . . 63.34 110.47 178.468 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -102.88 8.08 39.25 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.631 0.729 . . . . 72.31 109.799 -176.672 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 75' ' ' SER . 45.6 mt -94.14 -52.87 4.19 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.063 -0.971 . . . . 72.33 108.912 172.041 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.483 ' HA ' HG13 ' B' ' 133' ' ' ILE . 9.1 mt -80.25 6.67 11.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.427 -0.806 . . . . 75.31 111.306 -173.319 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -54.36 -20.81 8.0 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.628 0.58 . . . . 71.22 112.481 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.586 ' HB3' HD11 ' B' ' 133' ' ' ILE . 27.6 t70 -67.69 -41.99 82.78 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.972 0.415 . . . . 72.4 110.365 175.451 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 35.6 t -91.33 -42.55 13.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.069 -0.514 . . . . 73.41 110.405 -178.316 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.1 mp . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 116.107 -0.497 . . . . 74.32 110.495 -179.247 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 26.0 p90 . . . . . 0 N--CA 1.463 0.191 0 N-CA-C 112.219 0.451 . . . . 74.52 112.219 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 132' ' ' ASN . . . . . 0.466 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 54.7 t30 -55.52 -60.14 3.84 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.142 0.276 . . . . 75.51 111.661 -171.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 133' ' ' ILE . . . . . 0.586 HD11 ' HB3' ' A' ' 82' ' ' ASP . 39.5 mm -59.52 -46.52 92.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.27 0.557 . . . . 75.42 111.482 -176.007 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.432 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 88.0 mt -58.22 -30.71 66.71 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.587 -0.733 . . . . 54.32 111.613 -179.564 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -77.73 -33.61 52.91 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.751 0.31 . . . . 63.03 110.599 -178.477 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 136' ' ' GLU . . . . . 0.469 ' OE1' ' HA ' ' B' ' 133' ' ' ILE . 33.5 mt-10 -64.72 -46.56 81.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.406 0.622 . . . . 62.24 110.296 177.609 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 39.3 m-80 -90.83 5.25 49.19 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.363 -0.835 . . . . 65.11 110.796 -175.162 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 31.5 t70 60.2 65.13 1.12 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.982 -1.008 . . . . 64.41 112.754 173.638 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 139' ' ' PHE . . . . . 0.432 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 9.7 m-85 -95.92 1.29 52.82 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.667 -0.697 . . . . 65.21 109.938 169.756 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 60.34 76.5 0.42 Allowed Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.647 -0.706 . . . . 62.01 110.796 -178.747 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -79.86 157.19 24.15 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.814 2.342 . . . . 75.21 112.087 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 11.8 mptt . . . . . 0 C--N 1.325 -0.481 0 CA-C-O 120.925 0.393 . . . . 75.21 111.766 -176.134 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.516 -0.344 0 CA-C-O 120.502 0.191 . . . . 65.02 110.504 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.569 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.9 mp -73.04 88.2 1.39 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.294 -0.412 . . . . 72.01 110.576 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -91.69 72.06 5.82 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.424 -0.584 . . . . 65.32 109.424 174.501 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 151' ' ' PHE . . . . . 0.569 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 50.3 p90 -102.09 166.08 10.8 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.04 -0.527 . . . . 74.32 110.584 -176.102 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.8 tppp? -94.69 124.36 38.68 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.014 -0.539 . . . . 63.5 110.212 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 153' ' ' CYS . . . . . 0.538 ' HB3' ' CG ' ' B' ' 158' ' ' LYS . 32.5 t -138.64 117.09 12.02 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.321 -0.399 . . . . 73.21 110.194 178.158 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 73.2 4.51 4.91 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.235 -0.893 . . . . 54.23 112.087 174.017 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 119.6 -19.46 9.75 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.439 -0.886 . . . . 55.13 112.822 178.415 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -114.51 156.1 25.22 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.984 -0.376 . . . . 73.14 109.984 177.656 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 46.4 mm -78.35 117.55 23.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 110.039 -0.356 . . . . 65.43 110.039 177.222 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 158' ' ' LYS . . . . . 0.705 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 29.0 mmmt -100.34 103.62 15.03 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.192 -0.67 . . . . 70.25 109.192 178.622 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 159' ' ' THR . . . . . 0.464 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.2 OUTLIER -89.51 113.39 24.77 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.048 -0.523 . . . . 73.2 111.165 -176.228 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 160' ' ' PHE . . . . . 0.705 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 34.3 m-85 -115.17 134.3 55.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.115 0.484 . . . . 75.22 110.989 -179.888 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 16.6 p -114.38 1.68 14.47 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.692 -0.686 . . . . 74.41 110.616 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 162' ' ' ASP . . . . . 0.577 ' HB2' ' CB ' ' B' ' 165' ' ' SER . 4.1 m-20 -134.65 150.17 50.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.891 -0.595 . . . . 74.01 110.077 -174.475 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 5.6 tt -79.12 -51.03 10.08 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.006 -0.739 . . . . 72.22 109.006 177.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 61.4 tt0 -60.82 -35.78 77.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.515 -0.766 . . . . 71.41 110.771 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 165' ' ' SER . . . . . 0.665 ' HA ' ' HE3' ' B' ' 168' ' ' LYS . 13.4 t -65.02 -36.27 83.85 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.732 -0.667 . . . . 72.55 110.624 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 166' ' ' LEU . . . . . 0.509 ' HA ' ' CE2' ' B' ' 160' ' ' PHE . 52.4 tp -71.25 -31.8 67.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.797 0.332 . . . . 72.34 110.408 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 167' ' ' ARG . . . . . 0.42 ' HG3' HD11 ' B' ' 184' ' ' LEU . 56.5 ttp180 -61.54 -36.12 79.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.964 -0.562 . . . . 75.52 110.124 177.147 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 168' ' ' LYS . . . . . 0.665 ' HE3' ' HA ' ' B' ' 165' ' ' SER . 9.8 mtmp? -59.63 -43.62 93.76 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.903 -0.59 . . . . 74.0 110.558 176.713 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 169' ' ' PHE . . . . . 0.483 ' O ' ' HG2' ' B' ' 172' ' ' GLN . 40.4 t80 -70.7 -40.76 72.69 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.453 -0.794 . . . . 65.23 110.007 -178.34 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 170' ' ' ALA . . . . . 0.462 ' HB2' HD12 ' B' ' 180' ' ' LEU . . . -61.88 -31.44 71.72 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.995 -0.548 . . . . 64.43 111.179 177.653 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 9.1 t -78.33 -28.95 47.42 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 121.062 -0.255 . . . . 72.44 111.233 -176.573 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 172' ' ' GLN . . . . . 0.483 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 21.0 pt20 -85.82 -5.94 59.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.468 0.651 . . . . 71.24 109.937 177.563 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 10.7 mmmm -118.41 98.09 6.09 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.232 -0.894 . . . . 63.41 110.101 -179.479 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 16.8 t -51.35 -34.85 35.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.083 0.468 . . . . 32.4 110.454 -179.352 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 175' ' ' SER . . . . . 0.577 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 3.9 m -62.06 -47.29 85.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.799 -0.637 . . . . 65.44 111.059 178.852 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 86.3 mtp -82.89 -21.65 34.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.929 -0.578 . . . . 71.11 111.224 -175.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 20.5 ttmm -66.57 -23.73 66.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.678 0.752 . . . . 75.34 109.296 175.547 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -100.15 4.28 44.36 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.947 -1.024 . . . . 72.34 109.655 -177.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 179' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' B' ' 175' ' ' SER . 57.7 mt -103.16 -49.96 3.61 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.293 -0.867 . . . . 73.43 109.325 175.525 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 180' ' ' LEU . . . . . 0.462 HD12 ' HB2' ' B' ' 170' ' ' ALA . 9.8 mt -86.91 5.74 35.45 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.821 -0.627 . . . . 74.13 110.477 -176.461 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 181' ' ' LYS . . . . . 0.403 ' HA ' ' HB2' ' B' ' 184' ' ' LEU . 63.4 pttt -59.7 -11.84 5.85 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.474 -0.784 . . . . 73.23 111.673 178.317 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -63.54 -35.02 79.09 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.368 0.604 . . . . 73.15 109.683 175.25 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 23.9 t -102.76 -37.74 5.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.048 -0.978 . . . . 64.41 110.098 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 184' ' ' LEU . . . . . 0.42 HD11 ' HG3' ' B' ' 167' ' ' ARG . 10.7 mp . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 115.617 -0.72 . . . . 52.23 110.497 -178.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.438 ' HB3' HD21 ' B' ' 149' ' ' LEU . 32.4 p90 . . . . . 0 C--O 1.233 0.225 0 N-CA-C 111.895 0.332 . . . . 74.3 111.895 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.552 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 50.1 t30 -54.62 -54.91 35.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.052 0.453 . . . . 73.14 111.046 -176.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.752 HG21 ' HB3' ' B' ' 179' ' ' LEU . 36.1 mm -58.55 -38.47 70.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.678 -0.692 . . . . 65.12 111.489 -176.324 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.6 mt -62.66 -34.51 77.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.84 -0.618 . . . . 74.14 111.771 -177.141 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 74.8 ttt180 -81.02 -36.72 30.25 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.492 -0.483 . . . . 71.51 110.366 178.618 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.552 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 8.5 mm-40 -67.04 -31.4 71.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.76 0.314 . . . . 62.11 111.139 -178.486 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -98.33 -1.15 42.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.9 0.381 . . . . 65.11 111.003 178.121 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 19.5 t70 59.84 74.95 0.42 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.926 0.87 . . . . 73.04 111.749 176.195 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.484 ' HB3' ' HB2' ' B' ' 151' ' ' PHE . 3.7 m-85 -94.54 -4.21 48.42 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.986 -1.007 . . . . 71.12 109.865 169.002 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 59.39 74.7 0.56 Allowed Pre-proline 0 N--CA 1.463 0.22 0 O-C-N 124.178 0.924 . . . . 70.23 110.252 -174.131 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -80.32 -165.2 0.32 Allowed 'Trans proline' 0 N--CA 1.458 -0.599 0 C-N-CA 123.277 2.651 . . . . 54.43 112.221 -177.668 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.932 ' HD3' ' HB3' ' B' ' 150' ' ' ALA . 6.9 tptp . . . . . 0 C--N 1.327 -0.399 0 CA-C-N 116.134 -0.485 . . . . 73.13 110.327 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.531 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.399 0 CA-C-O 121.398 0.618 . . . . 72.21 109.802 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.521 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 9.3 mp -67.33 91.15 0.24 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.997 -1.001 . . . . 74.24 111.171 -176.387 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' B' ' 142' ' ' LYS . . . -90.38 96.72 10.79 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.911 -0.774 . . . . 71.43 108.911 170.281 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.639 ' HB3' ' HA ' ' B' ' 141' ' ' PRO . 49.5 p90 -129.93 170.01 14.49 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.71 -0.677 . . . . 54.22 110.34 -176.185 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.7 tppp? -85.08 131.22 34.48 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.257 -0.429 . . . . 73.32 110.65 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 39.4 t -146.89 119.31 8.42 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.646 -0.502 . . . . 52.11 109.646 174.522 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 31.4 t70 71.39 2.74 4.38 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.668 -0.696 . . . . 33.35 112.404 175.5 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 117.76 -20.06 11.04 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.415 -0.898 . . . . 74.42 112.15 -179.737 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -107.77 163.83 12.76 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.819 -0.437 . . . . 64.13 109.819 178.233 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.7 mm -93.03 125.41 45.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.734 -0.469 . . . . 74.34 109.734 177.803 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.559 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 30.6 mmmt -107.46 141.13 39.36 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.337 -0.392 . . . . 74.42 110.023 -179.295 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -112.63 115.67 28.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.0 0.428 . . . . 45.34 111.169 176.695 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -120.75 106.28 11.55 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.162 -0.472 . . . . 63.21 110.834 178.168 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.531 ' HB3' ' HB3' ' A' ' 48' ' ' LYS . 5.4 p -96.96 -2.42 43.67 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.102 -0.499 . . . . 51.23 110.944 178.352 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -131.14 138.69 49.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.033 -0.53 . . . . 72.3 110.775 179.733 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 46.4 tp -70.36 -31.03 68.13 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.282 -0.636 . . . . 74.34 109.282 175.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -56.94 -47.17 81.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.782 -0.644 . . . . 74.52 110.389 174.537 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.6 m -63.77 -43.18 97.15 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.928 -0.578 . . . . 74.23 110.952 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 33.6 tp -72.94 -32.08 65.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.414 . . . . 72.24 110.862 -177.135 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.404 ' HG2' HD21 ' A' ' 84' ' ' LEU . 55.4 ttp180 -59.29 -44.45 92.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.055 -0.52 . . . . 75.1 110.19 178.947 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -62.79 -46.82 86.23 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.728 -0.669 . . . . 74.53 110.827 178.177 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.46 ' CE2' ' HE3' ' A' ' 73' ' ' LYS . 46.5 t80 -63.72 -45.42 90.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.249 -0.887 . . . . 71.43 110.883 -176.388 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.73 -24.98 64.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.134 -0.484 . . . . 70.3 112.018 -176.659 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.1 m -65.05 -38.11 89.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.813 0.34 . . . . 75.2 111.231 -179.106 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -92.27 0.11 57.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.09 0.472 . . . . 70.22 111.217 -178.677 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 66.4 mmtt -97.5 116.91 30.61 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.909 -0.587 . . . . 75.0 110.247 177.278 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.2 m -64.61 -35.0 79.59 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.093 0.473 . . . . 42.44 110.561 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 23.3 t -78.78 -34.05 45.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.689 -0.687 . . . . 53.0 110.916 -179.302 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.509 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 82.4 mtp -92.15 -12.47 32.77 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.652 0.263 . . . . 61.43 111.64 -175.67 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.58 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 40.4 tttp -52.27 -43.11 64.24 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.04 -0.527 . . . . 61.11 110.972 174.406 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.467 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 28.7 mm-40 -90.88 -2.53 57.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.485 0.66 . . . . 63.1 110.444 -172.037 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.549 ' HB2' HD22 ' A' ' 80' ' ' LEU . 36.1 mt -90.48 -53.7 4.32 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.162 -0.926 . . . . 72.2 109.872 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.549 HD22 ' HB2' ' A' ' 79' ' ' LEU . 3.0 mm? -94.93 3.45 54.95 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.768 -0.651 . . . . 53.43 111.515 -176.15 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.58 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 65.3 pttt -55.98 -16.41 4.81 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.274 0.472 . . . . 70.01 112.274 178.875 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -58.63 -30.56 67.38 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.935 0.398 . . . . 74.13 111.228 177.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 19.7 m -123.18 10.34 5.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.215 0.531 . . . . 71.52 111.01 178.27 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.446 ' HB2' ' HA ' ' A' ' 81' ' ' LYS . 3.1 mt . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 115.903 -0.59 . . . . 53.43 110.602 -177.476 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 43.4 p90 . . . . . 0 CA--C 1.535 0.386 0 N-CA-C 111.76 0.281 . . . . 74.22 111.76 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -54.92 -48.47 73.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.082 -0.508 . . . . 75.53 110.959 179.258 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 133' ' ' ILE . . . . . 0.515 HG21 ' HB3' ' A' ' 79' ' ' LEU . 43.2 mm -61.99 -42.54 95.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.339 0.59 . . . . 62.31 110.777 -179.279 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.518 HD12 HD23 ' A' ' 49' ' ' LEU . 98.9 mt -70.29 -26.31 63.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.613 -0.722 . . . . 52.43 111.784 -174.267 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -76.37 -35.18 58.81 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.336 -0.546 . . . . 75.12 109.875 176.591 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -63.83 -30.24 71.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.838 -0.619 . . . . 72.23 110.723 176.739 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -102.62 5.74 39.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.045 -0.525 . . . . 63.13 111.263 -179.472 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 57.41 51.3 10.05 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.708 -0.678 . . . . 62.33 112.317 174.811 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 139' ' ' PHE . . . . . 0.488 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 7.6 m-85 -82.72 -8.0 59.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.109 -0.496 . . . . 64.45 110.221 172.537 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 140' ' ' GLU . . . . . 0.41 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 37.0 tt0 58.42 75.89 0.5 Allowed Pre-proline 0 N--CA 1.464 0.232 0 CA-C-N 115.487 -0.779 . . . . 71.2 110.785 -176.525 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 141' ' ' PRO . . . . . 0.639 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 78.1 Cg_endo -80.2 173.61 12.36 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.669 2.246 . . . . 74.33 112.491 -178.39 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 142' ' ' LYS . . . . . 0.82 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 11.5 tptp . . . . . 0 C--N 1.324 -0.539 0 CA-C-N 116.091 -0.504 . . . . 63.52 109.795 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 148' ' ' LYS . . . . . 0.771 ' HB3' ' HB3' ' B' ' 161' ' ' SER . 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.368 0 N-CA-C 108.911 -0.774 . . . . 70.41 108.911 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.627 HD22 ' H ' ' B' ' 149' ' ' LEU . 1.5 mm? -60.72 107.92 0.77 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.316 -0.857 . . . . 73.44 111.298 -171.634 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.932 ' HB3' ' HD3' ' A' ' 42' ' ' LYS . . . -97.08 87.47 4.22 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.835 -0.802 . . . . 54.31 108.835 171.799 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 151' ' ' PHE . . . . . 0.518 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 45.4 p90 -119.85 167.05 12.5 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.704 -0.68 . . . . 71.53 110.593 -175.544 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -93.65 122.25 35.91 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.997 -0.547 . . . . 72.41 110.079 177.544 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 153' ' ' CYS . . . . . 0.431 ' HB2' ' HE1' ' B' ' 151' ' ' PHE . 20.8 t -137.13 121.61 18.31 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.067 -0.515 . . . . 75.32 110.097 177.686 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 20.9 t70 73.54 1.8 4.07 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.874 -0.603 . . . . 61.32 111.545 171.604 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 116.3 -11.59 16.79 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.782 -0.723 . . . . 72.12 112.495 -179.551 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 156' ' ' GLU . . . . . 0.833 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 10.4 pt-20 -117.31 145.32 44.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.838 0.351 . . . . 71.32 110.667 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 46.2 mm -77.28 127.03 38.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 109.361 -0.607 . . . . 73.12 109.361 175.91 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 158' ' ' LYS . . . . . 0.833 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 30.6 mmmt -120.57 126.94 51.59 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.005 -0.543 . . . . 73.21 110.279 -176.379 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 159' ' ' THR . . . . . 0.58 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.9 OUTLIER -103.01 115.42 30.57 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 123.249 0.343 . . . . 71.43 110.169 172.749 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 160' ' ' PHE . . . . . 0.418 ' CE2' ' HB3' ' B' ' 158' ' ' LYS . 59.9 m-85 -115.28 102.84 10.24 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.349 0.595 . . . . 63.14 111.758 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 161' ' ' SER . . . . . 0.771 ' HB3' ' HB3' ' B' ' 148' ' ' LYS . 34.1 p -108.12 12.35 26.83 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.174 -0.921 . . . . 65.22 108.714 168.717 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -132.0 108.12 9.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.766 -1.106 . . . . 53.4 110.243 -179.114 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 50.9 tp -66.25 -26.33 67.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.656 -0.702 . . . . 73.34 110.66 -178.453 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.09 -52.1 65.26 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.093 -0.503 . . . . 73.3 110.67 -179.117 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 30.9 m -72.32 -28.71 63.24 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.645 -0.252 . . . . 61.54 110.743 178.736 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 60.6 tp -64.98 -39.88 94.14 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.054 -0.351 . . . . 70.31 110.054 178.03 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 167' ' ' ARG . . . . . 0.545 ' HG3' ' HG ' ' B' ' 184' ' ' LEU . 29.1 ttp180 -61.73 -36.56 81.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.12 0.486 . . . . 63.02 110.3 177.747 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -66.08 -51.45 57.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.856 -0.611 . . . . 74.21 110.882 175.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -68.56 -46.06 70.45 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.787 -0.642 . . . . 75.31 111.651 -174.043 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -60.9 -37.43 82.19 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.147 0.425 . . . . 33.11 112.147 -176.709 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 171' ' ' SER . . . . . 0.481 ' HB3' HD23 ' B' ' 184' ' ' LEU . 22.8 p -73.02 -23.51 60.62 Favored 'General case' 0 C--N 1.323 -0.543 0 N-CA-C 112.054 0.391 . . . . 72.21 112.054 -174.649 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -95.89 -8.71 33.3 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.839 0.352 . . . . 75.12 111.138 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 173' ' ' LYS . . . . . 1.092 ' HE2' ' HA ' ' B' ' 173' ' ' LYS . 7.2 mmpt? -86.61 129.88 34.7 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 110.049 -0.352 . . . . 62.23 110.049 177.188 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 19.2 m -58.31 -43.17 88.01 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.841 0.353 . . . . 75.55 111.541 -176.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 175' ' ' SER . . . . . 0.586 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 47.1 t -77.21 -49.29 15.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.049 0.452 . . . . 74.44 110.143 -179.484 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.811 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 73.0 mtp -66.11 -23.94 66.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.757 -0.656 . . . . 72.21 111.789 -175.352 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 177' ' ' LYS . . . . . 0.648 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 28.5 tttp -59.26 -35.94 74.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 65.53 110.788 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -88.86 -21.38 23.71 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 121.519 0.676 . . . . 72.12 110.314 -176.25 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 179' ' ' LEU . . . . . 0.752 ' HB3' HG21 ' A' ' 33' ' ' ILE . 35.8 mt -75.88 -46.24 31.24 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.845 -1.07 . . . . 74.5 110.466 -178.093 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 180' ' ' LEU . . . . . 0.821 ' HB3' HD13 ' B' ' 184' ' ' LEU . 3.7 mm? -98.57 -3.35 36.5 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.532 -0.758 . . . . 75.51 112.027 -174.726 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 181' ' ' LYS . . . . . 0.648 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 64.9 pttt -56.12 -18.24 9.35 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.904 0.705 . . . . 65.31 112.904 -177.459 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -70.04 -38.62 75.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.002 0.43 . . . . 61.02 110.937 179.161 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 18.7 m -108.63 -9.01 11.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.996 -0.547 . . . . 72.41 111.605 -175.636 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 184' ' ' LEU . . . . . 0.821 HD13 ' HB3' ' B' ' 180' ' ' LEU . 8.6 mp . . . . . 0 C--N 1.325 -0.488 0 N-CA-C 110.221 -0.289 . . . . 62.05 110.221 177.208 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 35.3 p90 . . . . . 0 N--CA 1.478 0.925 0 N-CA-C 113.095 0.776 . . . . 61.2 113.095 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -65.11 -46.11 82.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.013 0.435 . . . . 61.0 110.437 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.4 HG21 ' O ' ' B' ' 179' ' ' LEU . 40.6 mm -58.97 -34.35 52.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.718 -0.674 . . . . 72.42 110.769 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.479 ' CD1' HD21 ' B' ' 149' ' ' LEU . 80.2 mt -72.14 -28.41 63.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.795 -0.639 . . . . 74.13 110.524 -178.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.99 -44.3 63.7 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.497 -0.557 . . . . 64.22 109.497 174.381 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -60.32 -45.95 91.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.558 -0.746 . . . . 74.33 111.355 -179.151 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -85.36 0.54 51.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.445 -0.343 . . . . 75.41 111.16 -178.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 21.4 t70 58.1 69.09 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.475 -0.784 . . . . 75.24 111.609 178.416 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.6 m-30 -101.63 -2.21 30.93 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.906 -0.588 . . . . 72.22 110.861 174.155 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.638 ' HG3' ' HE2' ' A' ' 42' ' ' LYS . 7.5 tp10 62.59 80.87 0.24 Allowed Pre-proline 0 N--CA 1.466 0.35 0 O-C-N 123.68 0.613 . . . . 75.15 110.624 -174.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -88.92 138.0 3.4 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.048 2.499 . . . . 72.42 113.352 -176.398 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.678 ' O ' ' HA ' ' B' ' 149' ' ' LEU . 5.6 mptp? . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 63.24 109.758 177.511 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.419 ' HD3' ' CG2' ' A' ' 59' ' ' THR . 0.2 OUTLIER . . . . . 0 CA--C 1.513 -0.463 0 N-CA-C 110.028 -0.36 . . . . 70.53 110.028 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.565 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.9 mp -71.52 82.41 0.81 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.001 0.429 . . . . 74.32 110.765 -178.55 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.09 58.19 4.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.792 -0.64 . . . . 75.14 109.343 173.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.565 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 52.3 p90 -89.24 169.42 11.46 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.674 -0.694 . . . . 72.41 110.723 -175.132 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.509 ' HE3' HD13 ' A' ' 57' ' ' ILE . 3.8 tppp? -100.95 124.27 46.4 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.86 -0.609 . . . . 71.1 111.035 -177.355 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.47 ' HB3' ' CG ' ' A' ' 58' ' ' LYS . 45.2 t -143.04 132.12 23.05 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.947 -0.57 . . . . 64.32 109.535 175.676 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 65.15 11.71 7.4 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.043 -0.526 . . . . 73.42 112.399 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 102.32 -6.35 53.13 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.74 -0.743 . . . . 60.05 112.734 177.467 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -123.72 159.05 30.25 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.841 0.353 . . . . 72.32 110.293 177.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.509 HD13 ' HE3' ' A' ' 52' ' ' LYS . 41.3 mm -78.43 123.97 36.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 109.787 -0.449 . . . . 75.14 109.787 176.406 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.47 ' CG ' ' HB3' ' A' ' 53' ' ' CYS . 27.7 mmmt -104.48 85.26 2.31 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.429 -0.582 . . . . 75.32 109.429 178.605 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.419 ' CG2' ' HD3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -74.07 112.08 9.86 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.021 -0.536 . . . . 73.51 111.525 -174.744 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -123.45 116.01 22.53 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.901 0.381 . . . . 74.42 110.992 178.39 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.5 m -91.1 -12.66 34.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.431 0.634 . . . . 63.3 109.451 172.227 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.462 ' OD2' ' HB3' ' A' ' 64' ' ' GLN . 33.4 t70 -115.6 118.87 34.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.34 -0.845 . . . . 54.32 109.923 -179.565 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -74.11 -25.61 59.88 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.018 0.437 . . . . 62.53 110.511 -176.244 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.463 ' O ' ' HB3' ' A' ' 67' ' ' ARG . 28.5 tt0 -63.23 -39.72 95.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.962 -0.563 . . . . 63.14 109.963 176.267 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.7 m -70.98 -29.05 64.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.641 -0.709 . . . . 75.11 110.77 177.84 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 69.4 tp -64.74 -38.75 92.06 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.768 -0.456 . . . . 74.02 109.768 175.293 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.463 ' HB3' ' O ' ' A' ' 64' ' ' GLN . 16.5 ttt-85 -56.34 -40.95 75.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.706 -0.679 . . . . 72.02 110.647 174.762 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 60.4 mmtt -60.94 -48.83 79.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.164 -0.471 . . . . 73.12 110.913 177.333 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.509 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 63.3 t80 -67.23 -46.65 73.18 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.673 -0.694 . . . . 75.34 111.194 -177.489 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.5 -29.76 70.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.338 -0.392 . . . . 73.53 111.818 -177.79 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.4 m -69.21 -25.82 64.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.518 -0.31 . . . . 52.2 111.608 -178.694 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.509 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 11.6 pt20 -99.37 -0.68 40.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.141 0.496 . . . . 74.24 110.524 -179.335 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.774 ' HE2' ' HA ' ' A' ' 73' ' ' LYS . 9.1 mmpt? -95.96 120.02 35.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.776 -0.647 . . . . 64.05 109.984 177.709 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.6 m -57.0 -42.96 81.25 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.933 0.396 . . . . 41.02 110.813 179.495 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.472 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 4.7 m -78.35 -42.61 30.03 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.034 -0.53 . . . . 74.41 111.212 -176.374 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.734 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 86.9 mtp -74.28 -19.9 60.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.401 -0.363 . . . . 75.12 111.339 -175.39 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.442 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 1.8 tmtm? -56.23 -41.91 76.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.181 -0.463 . . . . 71.51 110.024 177.329 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -85.13 -20.72 29.86 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.621 0.724 . . . . 61.44 110.041 -174.324 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.701 ' HB3' HG21 ' B' ' 133' ' ' ILE . 83.6 mt -75.3 -53.04 9.44 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.734 -1.121 . . . . 73.03 110.235 179.448 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.514 ' HB3' HD12 ' A' ' 84' ' ' LEU . 4.1 mm? -82.62 -16.07 49.74 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.564 -0.744 . . . . 74.55 112.516 -173.886 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.417 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 63.7 pttt -62.79 -14.69 48.31 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 120.755 0.312 . . . . 35.35 111.636 -178.102 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -68.51 -42.94 77.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.128 0.49 . . . . 65.42 110.37 179.269 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.523 HG13 ' HG ' ' A' ' 84' ' ' LEU . 7.7 p -99.09 -37.1 5.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.94 -0.573 . . . . 74.01 111.102 -178.492 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.523 ' HG ' HG13 ' A' ' 83' ' ' VAL . 90.7 mt . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 116.473 -0.33 . . . . 71.12 110.946 -177.059 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 52.3 p90 . . . . . 0 C--O 1.233 0.215 0 CA-C-O 120.793 0.33 . . . . 72.31 110.533 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 132' ' ' ASN . . . . . 0.45 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 7.3 t30 -55.41 -55.08 35.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.761 -0.654 . . . . 61.43 111.226 -179.555 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 133' ' ' ILE . . . . . 0.701 HG21 ' HB3' ' A' ' 79' ' ' LEU . 49.0 mm -54.75 -46.89 74.42 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.155 -0.475 . . . . 74.42 111.201 -178.54 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.545 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 84.7 mt -62.82 -37.22 85.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.71 -0.677 . . . . 73.43 111.021 -177.503 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.437 HH11 ' HG2' ' B' ' 136' ' ' GLU . 0.1 OUTLIER -65.61 -41.6 92.55 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.673 0.273 . . . . 53.43 110.53 177.944 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 136' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' B' ' 132' ' ' ASN . 16.6 mt-10 -69.75 -28.13 65.53 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.399 -0.364 . . . . 71.14 111.2 -176.621 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -101.48 8.13 42.17 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.157 0.503 . . . . 73.32 110.439 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 60.27 45.93 10.82 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.11 -0.95 . . . . 65.53 112.395 173.319 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 139' ' ' PHE . . . . . 0.545 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 8.1 m-85 -79.83 -8.92 59.56 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.12 -0.491 . . . . 70.14 109.926 172.663 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 140' ' ' GLU . . . . . 0.437 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 10.5 tp10 63.21 70.69 0.71 Allowed Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 115.306 -0.861 . . . . 73.45 110.679 179.386 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 141' ' ' PRO . . . . . 0.409 ' C ' ' HD2' ' B' ' 142' ' ' LYS . 89.2 Cg_endo -87.93 151.11 7.15 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.792 2.328 . . . . 74.05 112.348 -179.355 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 142' ' ' LYS . . . . . 0.409 ' HD2' ' C ' ' B' ' 141' ' ' PRO . 4.2 mptp? . . . . . 0 C--N 1.323 -0.548 0 N-CA-C 109.562 -0.533 . . . . 63.44 109.562 179.354 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.508 -0.649 0 N-CA-C 110.041 -0.355 . . . . 44.23 110.041 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.678 ' HA ' ' O ' ' A' ' 42' ' ' LYS . 61.7 tp -71.81 79.32 0.87 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.672 -0.694 . . . . 65.2 109.488 176.682 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.641 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -83.81 74.93 10.14 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.941 -0.572 . . . . 73.41 110.997 -177.71 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 151' ' ' PHE . . . . . 0.584 ' CD1' ' HG ' ' B' ' 149' ' ' LEU . 15.0 p90 -107.09 161.63 14.58 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.986 -0.552 . . . . 73.23 110.229 179.131 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 152' ' ' LYS . . . . . 0.417 ' HE3' ' CD1' ' B' ' 157' ' ' ILE . 4.8 tppp? -90.94 117.36 29.48 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.413 -0.812 . . . . 62.34 110.325 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 153' ' ' CYS . . . . . 0.558 ' HB2' ' CE2' ' B' ' 151' ' ' PHE . 42.6 t -135.83 122.65 21.15 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.657 -0.701 . . . . 51.33 110.035 179.013 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.7 t70 73.64 4.27 4.7 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.757 -0.656 . . . . 72.01 111.182 172.767 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 109.12 -4.02 31.63 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.826 -0.702 . . . . 74.34 112.351 179.041 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -125.45 155.82 39.86 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 110.017 -0.364 . . . . 73.14 110.017 176.226 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 157' ' ' ILE . . . . . 0.417 ' CD1' ' HE3' ' B' ' 152' ' ' LYS . 44.5 mm -84.76 115.52 26.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 109.358 -0.608 . . . . 50.23 109.358 177.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 158' ' ' LYS . . . . . 0.487 ' HE2' ' CE1' ' B' ' 169' ' ' PHE . 31.9 mmmt -100.24 94.63 6.31 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.555 0.217 . . . . 74.13 111.025 -175.91 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 1.2 p -78.09 111.88 14.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.007 0.432 . . . . 72.03 111.941 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 160' ' ' PHE . . . . . 0.454 ' CD2' HD13 ' B' ' 166' ' ' LEU . 64.1 m-85 -121.16 126.66 50.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.899 -0.591 . . . . 72.12 110.623 175.3 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 54.1 m -99.92 9.86 42.26 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.025 0.44 . . . . 73.52 110.453 174.536 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -143.51 138.75 29.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.93 -0.577 . . . . 71.4 110.943 -175.568 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 163' ' ' LEU . . . . . 0.478 ' O ' HD13 ' B' ' 163' ' ' LEU . 2.0 tm? -81.35 -33.41 32.44 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.781 -0.452 . . . . 74.01 109.781 -176.731 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 164' ' ' GLN . . . . . 0.449 ' O ' ' HB3' ' B' ' 167' ' ' ARG . 22.1 tt0 -57.97 -47.33 83.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.823 -0.626 . . . . 63.32 110.838 179.516 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 165' ' ' SER . . . . . 0.482 ' O ' ' HB2' ' B' ' 168' ' ' LYS . 18.5 m -70.02 -31.73 69.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.933 -0.576 . . . . 74.42 111.193 179.426 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 166' ' ' LEU . . . . . 0.454 HD13 ' CD2' ' B' ' 160' ' ' PHE . 54.9 tp -67.53 -33.64 75.47 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.709 -0.478 . . . . 73.32 109.709 175.905 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 167' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' B' ' 164' ' ' GLN . 50.5 ttp180 -59.87 -36.76 77.58 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.693 -0.685 . . . . 75.53 109.879 173.993 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 168' ' ' LYS . . . . . 0.482 ' HB2' ' O ' ' B' ' 165' ' ' SER . 67.2 mmtt -63.76 -51.69 63.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.761 -0.654 . . . . 75.02 110.522 176.287 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 169' ' ' PHE . . . . . 0.487 ' CE1' ' HE2' ' B' ' 158' ' ' LYS . 41.0 t80 -59.47 -41.6 90.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.797 -0.638 . . . . 54.1 110.509 -178.14 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 170' ' ' ALA . . . . . 0.543 ' HB2' HD12 ' B' ' 180' ' ' LEU . . . -62.79 -42.56 99.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.214 -0.448 . . . . 74.11 111.591 178.619 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 49.3 m -67.22 -28.81 68.38 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.492 -0.322 . . . . 40.13 111.598 -176.227 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -95.51 9.57 39.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.091 0.472 . . . . 71.21 110.731 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 55.6 mmtt -118.21 156.68 28.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.84 -0.618 . . . . 72.44 110.757 179.367 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.2 p -87.13 -56.18 3.49 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.17 0.509 . . . . 62.42 109.681 172.662 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 175' ' ' SER . . . . . 0.534 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 3.4 m -55.95 -53.74 53.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.449 -0.796 . . . . 73.02 111.427 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 19.0 mtp -74.7 -20.04 60.01 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.041 -0.527 . . . . 73.55 112.163 -172.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -64.36 -36.38 83.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.09 0.472 . . . . 74.23 110.671 178.295 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -94.21 -11.52 30.15 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 115.792 -0.64 . . . . 53.34 109.905 -173.082 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 179' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' B' ' 175' ' ' SER . 62.8 mt -76.03 -51.4 12.4 Favored 'General case' 0 N--CA 1.437 -1.101 0 N-CA-C 108.971 -0.752 . . . . 70.15 108.971 174.575 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 180' ' ' LEU . . . . . 0.543 HD12 ' HB2' ' B' ' 170' ' ' ALA . 8.5 mt -92.42 -1.48 56.98 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.524 -0.762 . . . . 64.2 111.574 -171.201 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -60.18 -13.22 11.15 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.769 0.319 . . . . 64.12 111.729 178.645 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -70.21 -29.44 66.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.991 0.424 . . . . 53.4 110.782 178.077 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 28.5 m -114.66 -19.9 6.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.185 -0.461 . . . . 63.43 111.355 179.327 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 184' ' ' LEU . . . . . . . . . . . . . 83.5 mt . . . . . 0 C--N 1.325 -0.489 0 N-CA-C 109.877 -0.416 . . . . 71.24 109.877 178.398 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.594 0 N-CA-C 112.029 -0.428 . . . . 63.51 112.029 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.9 p -105.0 147.35 10.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 109.114 -0.699 . . . . 74.5 109.114 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 18.7 tp -143.58 -113.26 0.11 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.13 0.491 . . . . 73.2 111.658 -174.314 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 69.9 mtp -144.36 101.05 3.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.615 -0.721 . . . . 71.21 110.168 -173.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -83.2 163.38 20.82 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 110.12 -0.326 . . . . 71.32 110.12 173.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -125.99 -177.98 4.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.402 -0.363 . . . . 54.11 110.362 177.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -88.52 -139.8 6.93 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.748 -0.739 . . . . 55.44 112.143 179.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -115.49 113.39 23.61 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.782 0.325 . . . . 54.42 110.571 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.6 p -108.84 136.85 43.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.076 0.465 . . . . 73.34 110.539 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.682 ' H ' HD23 ' A' ' 10' ' ' LEU . 2.5 pt? -115.84 176.08 5.25 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.939 -0.573 . . . . 73.52 109.68 179.547 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 15.2 t -115.72 176.84 4.9 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.783 0.325 . . . . 53.44 110.273 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 51.4 tp -113.85 142.54 45.97 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.286 -0.416 . . . . 73.22 110.017 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.65 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -69.88 117.95 12.11 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.43 -0.35 . . . . 33.21 110.589 176.603 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.533 ' HB2' HG23 ' B' ' 123' ' ' ILE . . . -69.55 94.11 0.74 Allowed 'General case' 0 C--N 1.321 -0.641 0 O-C-N 123.392 0.433 . . . . 72.21 111.213 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.0 OUTLIER 78.57 -16.48 0.66 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.834 -1.075 . . . . 74.33 111.668 172.251 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.65 ' HB3' ' HB1' ' A' ' 13' ' ' ALA . 6.9 tt -71.0 -43.0 68.87 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.274 -0.421 . . . . 71.22 110.062 178.758 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 34.8 t -101.25 -46.79 4.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.277 0.56 . . . . 72.03 109.974 179.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 69.4 m -146.36 149.11 33.14 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.971 -0.559 . . . . 43.1 109.549 176.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.35 124.4 21.17 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.949 0.404 . . . . 61.44 111.199 -177.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.455 ' OG1' ' HA ' ' A' ' 14' ' ' ALA . 35.0 m -92.86 115.02 27.73 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.061 -0.518 . . . . 72.31 109.79 179.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 8.2 tt -134.83 136.95 42.87 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.086 -0.506 . . . . 75.43 110.155 -174.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.524 ' O ' ' HE3' ' A' ' 48' ' ' LYS . 23.4 t70 -90.55 137.72 32.13 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.045 -0.525 . . . . 61.54 111.39 -177.099 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 6.0 tt -141.55 122.73 12.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.016 -0.538 . . . . 63.12 109.738 176.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.671 ' HA ' ' CD ' ' B' ' 146' ' ' GLU . 37.7 m -81.0 115.77 20.63 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.554 0.692 . . . . 74.45 112.355 -171.633 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.419 ' HD3' ' OE2' ' B' ' 146' ' ' GLU . 0.0 OUTLIER -123.92 5.19 8.7 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.946 -1.024 . . . . 75.44 109.496 173.242 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.412 ' HB2' ' OE2' ' B' ' 146' ' ' GLU . 0.0 OUTLIER -83.54 174.87 10.21 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 115.456 -0.793 . . . . 74.55 110.8 176.962 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.435 ' HB3' ' H ' ' A' ' 28' ' ' SER . 93.6 m95 -121.7 -151.62 0.48 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.037 -0.529 . . . . 75.23 111.848 -177.639 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.435 ' H ' ' HB3' ' A' ' 27' ' ' TRP . 9.5 m -66.53 -51.16 59.56 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 113.625 0.972 . . . . 72.13 113.625 -169.207 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -70.52 99.09 1.56 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.983 0.421 . . . . 72.42 110.792 -174.107 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.8 m -100.74 93.44 2.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.065 -0.516 . . . . 54.21 111.355 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.454 ' CD2' HD11 ' B' ' 149' ' ' LEU . 41.3 p90 44.82 28.92 0.39 Allowed 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.227 1.011 . . . . 70.32 113.518 175.285 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.505 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 54.0 t30 -59.53 -51.94 67.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.924 0.392 . . . . 73.24 111.334 -175.485 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.524 ' H ' HD12 ' A' ' 33' ' ' ILE . 3.4 mp -61.1 -39.51 82.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.822 -0.627 . . . . 63.23 111.25 -175.036 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.3 mt -62.19 -35.44 78.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.808 0.337 . . . . 74.14 110.964 179.352 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 47.8 ttt180 -69.46 -44.01 72.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.219 -0.446 . . . . 65.34 110.454 177.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.505 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 36.9 mt-10 -66.02 -26.19 67.42 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.136 -0.484 . . . . 64.23 111.263 -178.438 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -100.01 1.06 42.14 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.275 -0.421 . . . . 71.25 111.079 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 62.29 45.61 6.61 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 113.044 0.757 . . . . 72.13 113.044 173.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.458 ' HB3' ' HB2' ' B' ' 151' ' ' PHE . 13.5 m-85 -78.16 -8.01 57.77 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.287 -0.635 . . . . 74.14 109.287 169.434 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 54.24 79.4 0.34 Allowed Pre-proline 0 C--O 1.233 0.211 0 CA-C-N 114.706 -1.134 . . . . 73.32 111.286 -173.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.479 ' HB3' HD12 ' B' ' 149' ' ' LEU . 7.7 Cg_exo -72.45 165.72 31.86 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.48 2.12 . . . . 74.44 110.771 175.082 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.933 ' HD2' ' HB3' ' B' ' 150' ' ' ALA . 0.1 OUTLIER -92.57 -162.18 0.91 Allowed 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.313 -0.555 . . . . 75.43 110.315 -179.511 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 42.9 t80 177.24 -30.71 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.808 0.814 . . . . 64.43 109.25 -171.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 48.6 tp -74.81 102.42 4.69 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.719 -1.128 . . . . 74.02 109.914 177.121 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.586 ' SG ' ' HA ' ' B' ' 147' ' ' VAL . 51.7 m -145.7 175.34 10.46 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.57 -0.741 . . . . 63.52 110.037 -179.055 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.568 ' OE2' ' HA ' ' B' ' 124' ' ' SER . 9.8 mm-40 -78.88 85.35 4.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.467 0.651 . . . . 63.2 110.299 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.833 HG11 ' HA ' ' B' ' 143' ' ' PHE . 24.7 t -78.04 154.38 5.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.515 -0.766 . . . . 70.04 110.714 -178.166 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.613 ' HA ' ' HA ' ' A' ' 61' ' ' SER . 0.3 OUTLIER -93.86 123.71 37.39 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 108.884 -0.784 . . . . 73.23 108.884 174.892 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.555 ' HB3' ' CD1' ' A' ' 51' ' ' PHE . 8.5 mp -74.2 88.9 1.99 Allowed 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 109.705 -0.479 . . . . 70.13 109.705 172.327 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.936 ' HB3' ' HD2' ' B' ' 142' ' ' LYS . . . -90.62 86.66 6.45 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.709 -0.678 . . . . 71.14 109.337 173.632 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.555 ' CD1' ' HB3' ' A' ' 49' ' ' LEU . 44.9 p90 -124.03 167.23 14.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.343 -0.844 . . . . 71.32 110.741 -173.583 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.7 tppt? -90.85 112.36 24.16 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.934 -0.575 . . . . 73.25 110.448 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.533 ' HB2' ' CE2' ' A' ' 51' ' ' PHE . 46.1 t -124.76 113.71 18.31 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.032 -0.531 . . . . 73.21 110.162 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 t70 64.7 24.49 12.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.736 -0.666 . . . . 74.2 111.487 173.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 105.94 -19.3 38.45 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.239 -0.982 . . . . 72.13 113.381 177.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.461 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 10.3 pt-20 -115.68 147.48 40.8 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 117.262 0.531 . . . . 62.41 111.127 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 43.6 mm -81.31 120.48 33.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.057 -0.52 . . . . 73.34 110.033 176.397 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.737 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 28.9 mmmt -101.78 148.9 24.74 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.992 -0.549 . . . . 75.03 109.537 179.668 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -121.29 109.23 14.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.97 0.414 . . . . 74.54 110.927 173.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.421 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 69.0 m-85 -117.16 101.53 8.54 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.122 0.487 . . . . 54.21 111.027 177.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.613 ' HA ' ' HA ' ' A' ' 48' ' ' LYS . 3.2 p -85.58 -12.99 50.2 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.448 -0.797 . . . . 75.1 110.241 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.67 ' OD2' ' HB3' ' A' ' 64' ' ' GLN . 33.6 t70 -127.68 113.38 15.96 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.349 -0.841 . . . . 72.33 109.396 177.312 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.91 -23.01 62.19 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.088 -0.505 . . . . 50.33 111.113 -175.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.67 ' HB3' ' OD2' ' A' ' 62' ' ' ASP . 0.7 OUTLIER -58.27 -50.25 74.25 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.814 -0.81 . . . . 74.44 108.814 172.172 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.1 m -64.74 -27.8 69.15 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.335 -0.848 . . . . 51.53 110.855 177.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 64.1 tp -69.05 -32.47 71.99 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.78 0.324 . . . . 70.35 110.63 177.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 62.9 ttt180 -61.55 -34.61 75.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.938 0.399 . . . . 75.42 110.177 175.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.582 ' HE2' ' OE1' ' A' ' 64' ' ' GLN . 62.8 mttm -68.63 -26.09 65.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.204 0.526 . . . . 71.12 110.607 178.146 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.467 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 78.1 t80 -85.83 -52.9 5.45 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.691 -0.686 . . . . 71.14 111.257 -177.233 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.46 ' HA ' ' HB2' ' A' ' 73' ' ' LYS . . . -68.04 -14.56 63.06 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.282 0.475 . . . . 62.52 112.282 -175.346 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.0 p -78.55 -32.04 47.67 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.758 0.313 . . . . 62.22 110.723 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.467 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 10.5 pt20 -91.65 -21.62 20.7 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.092 0.473 . . . . 43.54 109.945 177.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.46 ' HB2' ' HA ' ' A' ' 70' ' ' ALA . 29.6 mmmt -79.97 106.3 11.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.784 -0.644 . . . . 75.21 110.375 175.189 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.8 t -58.22 -37.74 75.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.964 0.411 . . . . 74.23 110.351 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.4 m -58.8 -52.41 65.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.105 -0.498 . . . . 61.54 111.141 178.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 84.1 mtp -80.5 -17.07 52.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.197 -0.456 . . . . 72.5 111.11 -175.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.625 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 25.1 ttmm -62.66 -24.6 67.7 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-N 116.279 -0.419 . . . . 75.15 110.152 175.188 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -92.48 -9.23 42.2 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.301 0.572 . . . . 73.5 110.132 -177.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.61 ' HB3' HG21 ' B' ' 133' ' ' ILE . 78.5 mt -95.62 -50.87 4.77 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.857 -1.065 . . . . 51.22 109.978 178.556 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.9 mt -90.71 -5.52 55.63 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.967 -0.56 . . . . 62.44 111.94 -172.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.625 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 64.5 pttt -58.34 -19.01 31.73 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.228 0.455 . . . . 75.21 112.228 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -76.89 -29.54 55.81 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.784 0.326 . . . . 73.3 110.865 -178.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.464 HG23 ' HG ' ' A' ' 84' ' ' LEU . 27.6 m -108.35 -27.21 3.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.403 -0.362 . . . . 62.31 111.716 -178.423 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.464 ' HG ' HG23 ' A' ' 83' ' ' VAL . 93.9 mt -104.16 141.62 22.91 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.658 -0.246 . . . . 65.11 110.418 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -63.32 112.68 1.8 Allowed 'Trans proline' 0 C--O 1.231 0.155 0 C-N-CA 122.67 2.247 . . . . 74.5 112.213 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -127.11 123.62 37.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.046 -0.524 . . . . 70.01 109.979 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.48 ' NZ ' ' HB3' ' A' ' 87' ' ' LYS . 8.7 mtpm? -97.03 -12.1 23.66 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.29 0.566 . . . . 54.12 110.254 178.288 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 . . . . . 0 C--N 1.321 -0.646 0 CA-C-N 115.371 -0.832 . . . . 70.45 110.674 -178.945 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.491 0 N-CA-C 111.839 -0.504 . . . . 63.31 111.839 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 7.7 p -118.49 110.67 31.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.63 0.729 . . . . 75.13 110.601 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 50.2 tp -159.94 142.49 13.49 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.425 -0.807 . . . . 65.41 110.16 178.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 80.8 mtp -90.89 93.69 9.33 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.667 -0.864 . . . . 70.23 108.667 174.008 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -100.22 141.04 33.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.716 -0.675 . . . . 53.52 111.668 -170.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -105.07 159.89 15.48 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.149 -0.932 . . . . 60.44 109.476 176.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -89.88 -142.0 9.12 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.494 -0.86 . . . . 63.24 112.733 -177.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -122.35 112.12 17.72 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.816 0.341 . . . . 72.01 111.143 -176.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 7.2 p -101.02 129.9 51.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.173 -0.467 . . . . 70.34 110.704 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -72.83 159.4 33.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.823 -0.626 . . . . 71.12 111.08 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 33.2 m -106.27 138.35 42.61 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.051 -0.522 . . . . 63.33 110.642 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 53.8 tp -89.89 136.94 32.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.367 -0.378 . . . . 60.23 110.362 178.133 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -90.63 124.59 35.18 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.025 -0.534 . . . . 71.42 110.809 178.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.591 ' O ' ' HA ' ' B' ' 119' ' ' ALA . . . -78.53 -22.94 46.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.933 -0.576 . . . . 72.42 112.426 -174.381 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -115.24 -34.01 5.14 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.839 -0.344 . . . . 70.12 110.928 -178.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 91.9 mt -76.32 -51.44 11.95 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.431 -0.35 . . . . 61.42 111.549 -178.207 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 14.1 m -87.72 -67.72 0.81 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.504 -0.317 . . . . 54.1 111.156 -175.22 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 52.0 m -146.9 136.32 22.8 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.488 -0.324 . . . . 73.3 110.533 -177.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.591 ' HA ' ' O ' ' B' ' 114' ' ' ALA . . . -60.01 114.43 2.83 Favored 'General case' 0 C--N 1.331 -0.228 0 O-C-N 123.464 0.478 . . . . 71.14 110.95 -178.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 26.4 m -125.11 135.1 52.34 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.753 -0.658 . . . . 73.35 110.427 -177.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 121' ' ' LEU . . . . . 0.486 HD23 ' H ' ' B' ' 121' ' ' LEU . 2.6 pt? -130.35 -177.31 4.27 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.702 -0.481 . . . . 62.23 109.702 178.5 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 122' ' ' ASP . . . . . 0.468 ' OD1' ' HG3' ' B' ' 148' ' ' LYS . 0.0 OUTLIER -108.03 149.62 28.19 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.288 0.566 . . . . 74.41 111.062 -178.808 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 123' ' ' ILE . . . . . 0.533 HG23 ' HB2' ' A' ' 14' ' ' ALA . 9.3 tt -153.01 127.6 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.345 -0.843 . . . . 55.12 108.774 174.13 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.568 ' HA ' ' OE2' ' A' ' 46' ' ' GLU . 53.0 m -63.85 115.13 4.54 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.801 0.667 . . . . 65.24 112.801 -170.212 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 125' ' ' LYS . . . . . 0.493 ' HD2' ' HB1' ' A' ' 14' ' ' ALA . 0.6 OUTLIER -120.22 2.89 10.89 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.826 -0.625 . . . . 65.42 109.375 173.167 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.73 -173.37 2.84 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.59 -0.732 . . . . 71.05 111.109 -178.336 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -123.04 -153.3 0.55 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.359 -0.382 . . . . 70.33 111.385 -174.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 15.1 p -86.52 -33.31 20.34 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.778 0.659 . . . . 73.42 112.778 -171.039 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -78.08 96.6 5.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.924 0.393 . . . . 71.13 110.217 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.614 HG12 ' CD2' ' B' ' 131' ' ' PHE . 14.4 t -120.57 114.13 42.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.205 -0.452 . . . . 61.34 110.285 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 131' ' ' PHE . . . . . 0.614 ' CD2' HG12 ' B' ' 130' ' ' VAL . 20.2 p90 47.75 21.99 0.31 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.808 1.243 . . . . 74.34 114.024 178.093 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.463 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 53.3 t30 -59.86 -55.23 36.78 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.713 0.292 . . . . 72.13 111.096 -176.32 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 133' ' ' ILE . . . . . 0.61 HG21 ' HB3' ' A' ' 79' ' ' LEU . 39.3 mm -58.84 -38.38 72.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.484 0.659 . . . . 73.32 110.771 -179.006 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.484 HD22 HD23 ' A' ' 49' ' ' LEU . 10.2 mp -66.3 -34.36 77.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.304 -0.862 . . . . 74.21 111.094 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -67.47 -40.38 85.31 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.036 -0.529 . . . . 72.12 110.152 178.028 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 136' ' ' GLU . . . . . 0.463 ' HG3' ' O ' ' B' ' 132' ' ' ASN . 27.2 mt-10 -69.16 -42.74 75.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.883 -0.599 . . . . 74.12 111.086 -178.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -87.1 1.18 53.79 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.324 -0.398 . . . . 72.13 111.396 -178.098 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 37.5 t70 53.78 66.99 1.08 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.681 0.753 . . . . 62.13 111.581 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -90.38 -1.35 57.9 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.281 -0.872 . . . . 73.5 109.838 171.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 57.34 67.33 2.52 Favored Pre-proline 0 C--O 1.234 0.283 0 CA-C-N 114.855 -1.066 . . . . 44.1 110.902 -176.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -74.94 161.14 39.42 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.244 1.963 . . . . 74.43 111.299 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 142' ' ' LYS . . . . . 0.936 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -97.41 179.68 4.79 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.447 -0.501 . . . . 74.33 110.256 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 143' ' ' PHE . . . . . 0.833 ' HA ' HG11 ' A' ' 47' ' ' VAL . 0.2 OUTLIER -169.34 22.36 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.554 0.692 . . . . 61.4 109.347 -172.592 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 59.0 tp -118.14 120.47 37.83 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.296 -0.865 . . . . 73.12 109.868 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 145' ' ' CYS . . . . . 0.601 ' SG ' HG22 ' A' ' 47' ' ' VAL . 24.5 p -148.31 175.0 11.45 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.949 -0.568 . . . . 74.42 109.551 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 146' ' ' GLU . . . . . 0.671 ' CD ' ' HA ' ' A' ' 24' ' ' SER . 5.4 mm-40 -83.28 71.98 10.2 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.624 0.726 . . . . 72.04 109.337 179.286 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 147' ' ' VAL . . . . . 0.586 ' HA ' ' SG ' ' A' ' 45' ' ' CYS . 91.3 t -58.1 131.78 22.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 114.578 -1.192 . . . . 74.24 111.416 -176.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 148' ' ' LYS . . . . . 0.468 ' HG3' ' OD1' ' B' ' 122' ' ' ASP . 0.0 OUTLIER -84.64 112.93 20.9 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 109.33 -0.618 . . . . 72.3 109.33 176.278 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.63 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 1.8 mm? -67.49 92.73 0.31 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.463 -0.79 . . . . 75.43 110.99 -178.264 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.933 ' HB3' ' HD2' ' A' ' 42' ' ' LYS . . . -88.89 78.76 7.5 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.116 -0.947 . . . . 33.33 109.368 173.742 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 151' ' ' PHE . . . . . 0.63 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 49.5 p90 -111.22 164.45 12.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.557 -0.747 . . . . 73.04 110.802 -176.358 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 6.8 tppt? -90.22 116.4 28.18 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.861 -0.609 . . . . 70.24 110.85 -177.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 153' ' ' CYS . . . . . . . . . . . . . 44.6 t -130.69 114.07 14.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.291 -0.413 . . . . 65.42 110.328 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 64.26 22.8 12.92 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.578 -0.737 . . . . 73.41 112.56 173.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 109.75 -24.52 19.32 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.143 -1.027 . . . . 70.01 112.988 176.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -112.73 149.89 32.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 117.163 0.482 . . . . 73.12 110.889 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 46.9 mm -79.81 130.91 35.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.074 -0.512 . . . . 71.52 109.953 176.168 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 158' ' ' LYS . . . . . 0.852 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 26.5 mmmt -100.71 157.3 16.79 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.068 -0.716 . . . . 72.1 109.068 178.212 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -132.58 109.32 9.67 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.94 0.4 . . . . 73.22 110.919 174.07 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 160' ' ' PHE . . . . . 0.441 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 80.2 m-85 -120.73 115.41 23.26 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.115 -0.493 . . . . 73.33 111.149 -179.606 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 33.9 m -98.03 4.6 49.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.187 0.518 . . . . 72.2 110.603 178.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -147.14 126.55 13.16 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.065 -0.516 . . . . 74.11 109.751 -177.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 92.5 mt -71.82 -21.27 61.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.515 -0.311 . . . . 73.34 110.859 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 164' ' ' GLN . . . . . 0.536 ' OE1' ' HE3' ' B' ' 168' ' ' LYS . 0.6 OUTLIER -69.73 -41.77 74.86 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.779 -0.822 . . . . 65.13 108.779 176.103 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 32.6 t -67.69 -42.38 82.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.295 -0.866 . . . . 63.22 109.895 175.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 64.9 tp -63.66 -31.52 72.72 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.041 -0.527 . . . . 65.33 110.489 178.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 167' ' ' ARG . . . . . 0.524 ' HD2' HD22 ' B' ' 184' ' ' LEU . 56.3 ttt180 -56.8 -45.86 81.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.226 -0.443 . . . . 74.15 110.868 176.282 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 168' ' ' LYS . . . . . 0.536 ' HE3' ' OE1' ' B' ' 164' ' ' GLN . 93.1 mttt -63.8 -30.56 71.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.123 -0.489 . . . . 34.21 110.864 -178.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -80.46 -47.88 13.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.947 -0.57 . . . . 62.5 110.61 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -66.18 -29.6 69.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.948 -0.569 . . . . 40.23 111.619 -175.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 34.2 p -68.68 -45.4 71.76 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 121.124 -0.23 . . . . 75.34 110.914 -179.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -82.88 -3.87 57.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.191 0.52 . . . . 63.41 110.858 -178.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 173' ' ' LYS . . . . . 0.423 ' HB3' ' HE3' ' B' ' 173' ' ' LYS . 24.2 mmmt -86.74 111.02 20.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.078 -0.51 . . . . 73.02 110.035 173.439 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 48.3 t -55.82 -37.48 68.72 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.797 0.332 . . . . 75.3 111.711 -177.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 8.6 p -78.26 -46.64 19.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.845 0.355 . . . . 51.13 111.602 -178.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 81.6 mtp -76.29 -12.79 60.14 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.352 -0.385 . . . . 61.24 111.688 -175.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 177' ' ' LYS . . . . . 0.548 ' O ' ' HG3' ' B' ' 186' ' ' GLN . 19.0 ttmm -57.24 -30.09 64.34 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.869 -0.605 . . . . 74.31 111.15 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -100.58 5.02 43.85 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.356 0.598 . . . . 75.44 110.716 -175.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 179' ' ' LEU . . . . . 0.493 ' HB3' HG21 ' A' ' 33' ' ' ILE . 63.4 mt -97.51 -53.59 3.4 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.578 -0.737 . . . . 74.24 110.217 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 180' ' ' LEU . . . . . 0.502 ' HB3' HD12 ' B' ' 184' ' ' LEU . 3.5 mm? -86.39 1.39 51.42 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.807 -0.633 . . . . 60.34 111.322 -176.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -49.33 -29.14 5.65 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.111 0.782 . . . . 75.31 113.111 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -73.12 -28.51 62.3 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.413 0.523 . . . . 64.14 112.413 -174.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 183' ' ' VAL . . . . . 0.748 HG23 ' HG ' ' B' ' 184' ' ' LEU . 31.5 m -112.01 -14.32 10.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.864 0.364 . . . . 51.52 111.122 179.437 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 184' ' ' LEU . . . . . 0.748 ' HG ' HG23 ' B' ' 183' ' ' VAL . 42.5 mt -128.54 119.63 20.49 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.12 -0.491 . . . . 70.1 110.133 -178.477 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.66 122.14 10.99 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 122.919 2.413 . . . . 74.22 112.52 -178.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 186' ' ' GLN . . . . . 0.548 ' HG3' ' O ' ' B' ' 177' ' ' LYS . 81.5 mm-40 -113.94 -149.0 0.44 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.913 -0.585 . . . . 71.52 110.948 -178.454 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 187' ' ' LYS . . . . . 0.462 ' HE2' ' HB3' ' B' ' 187' ' ' LYS . 29.5 mtpt 70.27 96.43 0.07 Allowed 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 124.109 0.964 . . . . 65.33 111.198 -175.837 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 . . . . . 0 C--N 1.306 -1.297 0 CA-C-N 114.376 -1.284 . . . . 64.42 109.399 176.898 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.659 0 N-CA-C 111.526 -0.63 . . . . 74.11 111.526 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.1 m -98.28 164.32 2.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.754 0.311 . . . . 73.54 110.716 -178.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -90.37 146.06 24.47 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.951 0.405 . . . . 73.31 110.434 -177.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 87.8 mtp -89.95 101.53 14.24 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.955 -0.566 . . . . 74.03 110.097 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -73.11 114.68 11.55 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.907 -0.588 . . . . 73.02 110.31 178.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -74.38 123.21 24.23 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.458 -0.792 . . . . 74.11 110.902 -178.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.99 51.09 3.16 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.043 -0.598 . . . . 72.4 112.101 -178.36 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -132.25 123.29 26.67 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.802 0.334 . . . . 71.42 110.696 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 49.1 t -79.11 129.6 37.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 109.567 -0.531 . . . . 74.43 109.567 176.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.422 HD22 ' HB3' ' B' ' 110' ' ' LEU . 85.8 mt -74.33 132.75 42.33 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.924 0.392 . . . . 54.05 111.446 -176.221 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.7 m -70.78 105.32 3.17 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.84 -0.618 . . . . 74.34 110.136 174.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 28.8 tp -74.4 116.92 15.62 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.085 0.469 . . . . 73.11 110.596 -178.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -83.01 -6.38 59.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.805 -0.634 . . . . 63.41 111.223 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 70.58 -53.84 0.65 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.637 0.775 . . . . 72.33 112.972 175.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -78.59 48.5 0.8 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.899 0.38 . . . . 64.33 111.778 -173.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.4 mp 49.3 32.76 4.64 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.842 0.682 . . . . 72.2 112.842 174.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.0 t -71.67 -27.01 62.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.141 0.496 . . . . 51.14 110.054 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.9 t -154.76 138.57 16.21 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.616 -0.883 . . . . 63.31 108.616 174.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -84.46 120.88 26.82 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.105 0.479 . . . . 41.42 112.151 -174.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.1 m -88.65 143.26 27.05 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.383 -0.826 . . . . 73.41 109.697 174.047 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.476 ' HG ' ' HG ' ' B' ' 112' ' ' LEU . 66.9 mt -82.26 162.54 22.28 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.069 0.462 . . . . 74.13 111.327 -179.088 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -131.13 151.0 51.9 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.382 -0.826 . . . . 72.42 109.927 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.6 tp -119.43 125.48 74.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 121.321 0.581 . . . . 74.23 110.805 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.8 p -140.66 104.88 4.82 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.753 -0.658 . . . . 61.25 110.343 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.499 ' C ' ' HG3' ' A' ' 26' ' ' GLN . 0.0 OUTLIER -114.61 89.53 3.12 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.501 -0.318 . . . . 73.25 111.323 176.719 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.499 ' HG3' ' C ' ' A' ' 25' ' ' LYS . 0.1 OUTLIER 40.99 92.94 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 114.435 1.272 . . . . 71.53 114.435 174.755 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -87.7 -29.19 21.3 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.656 -0.702 . . . . 73.22 109.984 177.026 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.2 m -90.19 15.9 9.49 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.495 -0.775 . . . . 73.34 111.914 -174.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.48 ' OD1' ' HB3' ' A' ' 32' ' ' ASN . 47.0 t30 -77.52 74.04 4.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.603 0.716 . . . . 74.44 109.899 177.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 42.3 t -120.95 -59.29 2.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.209 -0.905 . . . . 73.54 109.849 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -74.46 -18.98 60.56 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.673 -0.694 . . . . 75.14 110.838 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.519 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 6.8 t30 -62.42 -44.15 97.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.319 -0.4 . . . . 55.42 111.124 -178.217 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 39.5 mm -55.39 -46.22 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-O 121.332 0.587 . . . . 60.23 110.705 177.199 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.524 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 68.7 mt -65.46 -32.59 74.29 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.684 -0.689 . . . . 64.33 111.178 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -70.0 -38.99 76.15 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.798 0.332 . . . . 61.4 110.219 177.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 6.0 mm-40 -70.21 -23.08 62.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.172 -0.467 . . . . 75.43 110.819 179.133 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 28.9 m-80 -99.59 1.95 44.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.227 -0.442 . . . . 73.32 110.927 177.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 60.85 43.47 11.9 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.543 -0.753 . . . . 74.2 112.185 176.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.524 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 3.4 m-85 -80.06 -11.66 59.75 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.875 -0.602 . . . . 74.13 109.451 171.388 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 57.32 73.93 0.72 Allowed Pre-proline 0 C--O 1.231 0.108 0 CA-C-N 114.806 -1.088 . . . . 71.23 111.054 -175.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.558 ' C ' ' HE2' ' A' ' 42' ' ' LYS . 83.3 Cg_endo -86.42 147.27 8.66 Favored 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.735 2.29 . . . . 71.4 111.685 177.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.558 ' HE2' ' C ' ' A' ' 41' ' ' PRO . 1.4 mpmm? -95.19 159.07 15.18 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.326 0.584 . . . . 72.04 111.072 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.406 ' HA ' HG13 ' B' ' 147' ' ' VAL . 28.9 t80 -157.21 31.34 0.29 Allowed 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 107.754 -1.202 . . . . 74.33 107.754 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 59.7 tp -69.2 105.12 2.39 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.47 -1.241 . . . . 74.31 111.017 -175.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.458 ' C ' ' H ' ' A' ' 47' ' ' VAL . 78.2 m -86.08 99.9 11.8 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.781 -0.645 . . . . 64.32 110.023 176.599 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -76.57 23.78 0.15 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.834 -0.621 . . . . 71.41 110.653 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.458 ' H ' ' C ' ' A' ' 45' ' ' CYS . 43.4 t -82.81 99.07 5.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.378 0.609 . . . . 64.14 111.237 -174.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.0 112.35 5.26 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.145 -0.934 . . . . 75.11 108.867 172.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.858 ' H ' HD23 ' A' ' 49' ' ' LEU . 0.3 OUTLIER -76.15 91.47 3.16 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.32 0.581 . . . . 54.52 110.891 -175.404 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.638 ' HB2' HG23 ' A' ' 59' ' ' THR . . . -84.54 78.32 9.86 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.177 -0.92 . . . . 72.24 109.638 173.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.443 ' HB3' ' HA ' ' B' ' 141' ' ' PRO . 52.1 p90 -97.98 162.57 13.16 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.012 -0.54 . . . . 63.4 110.791 -174.277 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -93.17 119.73 32.69 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.118 -0.492 . . . . 73.35 110.078 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.479 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 45.4 t -128.7 108.96 10.9 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.372 -0.376 . . . . 54.15 110.621 178.45 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.5 t70 72.88 2.15 4.27 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.581 -0.736 . . . . 70.35 111.97 171.183 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 129.39 -25.87 4.46 Favored Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.184 -1.008 . . . . 63.21 112.587 179.539 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.493 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 11.2 pt-20 -106.07 149.18 26.96 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.643 -0.423 . . . . 63.44 110.788 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 44.6 mm -84.39 117.14 29.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.032 -0.531 . . . . 71.14 109.778 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.584 ' HB3' ' CE1' ' A' ' 60' ' ' PHE . 30.1 mmmt -99.2 102.43 14.08 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.328 -0.396 . . . . 64.44 110.362 -177.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.638 HG23 ' HB2' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -82.86 101.91 11.3 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.242 -0.435 . . . . 75.51 110.588 178.186 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.584 ' CE1' ' HB3' ' A' ' 58' ' ' LYS . 4.8 m-85 -108.25 136.1 48.47 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.43 -0.35 . . . . 64.41 111.576 -177.45 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.4 p -118.73 -0.46 11.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.996 -0.547 . . . . 71.33 111.006 174.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -130.43 135.58 48.14 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 120.853 0.359 . . . . 74.04 111.841 -177.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.9 tp -70.69 -34.96 72.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.713 -0.676 . . . . 74.24 109.594 174.011 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -57.45 -44.98 85.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.607 -0.724 . . . . 75.15 110.615 176.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.435 ' O ' ' HG3' ' A' ' 68' ' ' LYS . 50.9 m -69.75 -33.12 72.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.842 -0.617 . . . . 75.35 110.829 179.399 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 46.6 tp -68.22 -37.79 81.21 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.993 -0.373 . . . . 72.5 109.993 177.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 51.6 ttp180 -58.6 -50.16 74.82 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.874 -0.603 . . . . 73.42 111.0 178.227 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.528 ' HD3' ' N ' ' A' ' 69' ' ' PHE . 0.0 OUTLIER -67.7 -39.59 84.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.799 0.333 . . . . 65.31 111.396 -178.202 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.528 ' N ' ' HD3' ' A' ' 68' ' ' LYS . 74.0 t80 -67.11 -44.83 78.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.897 -0.592 . . . . 72.34 110.933 -178.58 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.74 -30.01 70.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.347 -0.388 . . . . 61.42 111.134 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.8 t -72.72 -35.16 67.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.34 -0.391 . . . . 53.03 110.818 -178.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -86.81 -11.9 49.57 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.035 0.445 . . . . 74.55 110.729 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.479 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 27.3 mmmt -89.82 122.77 33.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.095 -0.502 . . . . 74.02 110.2 175.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.5 m -63.99 -38.65 91.85 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.585 0.231 . . . . 65.14 111.344 -178.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.408 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 10.7 p -72.98 -40.23 65.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.882 0.372 . . . . 55.41 111.367 -179.544 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.469 ' HA ' HD12 ' A' ' 79' ' ' LEU . 74.3 mtp -85.18 -15.21 44.46 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.935 0.346 . . . . 53.32 111.935 -174.187 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 81.0 tttt -59.84 -37.47 79.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.217 -0.447 . . . . 65.25 111.79 -174.111 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.631 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 28.2 mt-10 -102.51 7.74 40.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.644 0.735 . . . . 54.12 110.651 -176.221 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.649 ' HB3' HG21 ' B' ' 133' ' ' ILE . 70.0 mt -87.3 -41.18 13.85 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.138 -0.937 . . . . 75.34 109.549 174.037 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -101.02 6.44 43.46 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.609 -0.723 . . . . 64.03 110.509 -178.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.631 ' HB3' ' HA ' ' A' ' 78' ' ' GLU . 18.8 ptmt -61.27 -12.83 14.86 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.447 -0.797 . . . . 74.33 112.124 -178.147 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -81.57 -46.08 14.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.751 0.31 . . . . 73.33 110.931 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 24.6 m -84.62 -18.83 9.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.1 0.476 . . . . 73.55 110.66 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 55.3 mt -107.61 98.24 23.41 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 108.448 -0.945 . . . . 72.43 108.448 171.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -46.57 91.02 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 123.983 3.122 . . . . 41.43 114.849 -168.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -144.75 104.57 4.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.372 -0.831 . . . . 75.11 108.988 174.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -83.32 -32.46 26.29 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.969 0.414 . . . . 75.51 110.373 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.451 -0.418 0 CA-C-N 115.91 -0.586 . . . . 63.45 110.55 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.239 0 N-CA-C 112.288 -0.325 . . . . 73.12 112.288 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 31.2 m -131.46 157.0 43.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.972 -0.381 . . . . 63.52 109.972 177.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 80.8 mt -74.81 118.84 18.22 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.404 -0.362 . . . . 63.04 110.809 178.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 24.5 ptp -71.95 114.35 9.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.236 0.541 . . . . 75.1 109.695 175.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -80.56 92.8 5.97 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 122.033 0.921 . . . . 73.13 110.48 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -73.25 118.52 16.3 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.341 -1.3 . . . . 54.54 110.445 178.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -77.56 61.01 3.63 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 121.121 -0.562 . . . . 73.02 112.014 178.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -96.38 106.38 18.6 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.707 0.289 . . . . 62.22 110.318 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 39.3 t -71.99 110.53 5.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.473 -0.565 . . . . 75.03 109.473 177.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 110' ' ' LEU . . . . . 0.422 ' HB3' HD22 ' A' ' 10' ' ' LEU . 92.0 mt -92.66 134.42 35.04 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.17 0.509 . . . . 74.53 110.98 -175.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 91.3 m -81.87 119.33 23.78 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.683 -0.69 . . . . 70.32 110.207 177.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 112' ' ' LEU . . . . . 0.476 ' HG ' ' HG ' ' A' ' 21' ' ' LEU . 0.2 OUTLIER -62.65 130.74 46.37 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.229 -0.656 . . . . 74.13 109.229 177.546 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.61 4.15 1.54 Allowed 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.518 0.562 . . . . 73.31 112.518 -177.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . 68.96 -74.08 0.08 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.68 0.792 . . . . 70.42 112.933 174.301 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -81.73 63.65 6.09 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.454 0.539 . . . . 55.21 112.454 -166.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 94.3 mt 59.51 8.73 1.29 Allowed 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.51 0.929 . . . . 73.22 113.51 170.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 22.4 t -68.78 -44.8 72.88 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.065 0.459 . . . . 62.4 110.85 -176.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 26.6 t -134.71 89.92 2.59 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.859 0.361 . . . . 60.21 110.165 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -138.67 90.72 2.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.146 -0.479 . . . . 44.21 110.448 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 89.7 m -156.76 125.54 5.87 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.988 -0.551 . . . . 71.45 109.608 179.273 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 121' ' ' LEU . . . . . 0.676 HD21 HG22 ' B' ' 123' ' ' ILE . 8.8 tt -154.41 139.16 17.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.489 -0.323 . . . . 74.44 110.508 -176.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -143.2 101.38 3.8 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.167 0.508 . . . . 74.34 110.288 173.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 123' ' ' ILE . . . . . 0.676 HG22 HD21 ' B' ' 121' ' ' LEU . 7.1 tp -146.71 114.03 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 109.023 -0.732 . . . . 70.12 109.023 173.032 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 19.9 p -170.02 165.65 9.37 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.918 -0.583 . . . . 73.03 109.863 -172.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -128.77 -60.19 1.11 Allowed 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 116.35 -0.386 . . . . 75.14 111.021 -178.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -143.39 122.27 12.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.157 -0.474 . . . . 74.12 110.968 -173.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -109.76 -34.61 6.41 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.293 -0.412 . . . . 74.35 110.886 177.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 5.4 m -90.08 13.32 15.25 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.216 -0.447 . . . . 61.34 112.026 -173.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -81.56 81.29 7.7 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.334 0.588 . . . . 61.01 111.259 -175.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.55 HG13 ' HD1' ' B' ' 131' ' ' PHE . 3.2 p -134.74 -44.44 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.383 -0.826 . . . . 73.22 109.018 170.488 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 131' ' ' PHE . . . . . 0.55 ' HD1' HG13 ' B' ' 130' ' ' VAL . 40.5 p90 -104.2 -1.03 27.75 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.865 -0.607 . . . . 74.12 109.604 174.473 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -63.02 -63.54 1.17 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.136 -0.938 . . . . 64.31 111.72 -173.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 133' ' ' ILE . . . . . 0.649 HG21 ' HB3' ' A' ' 79' ' ' LEU . 48.6 mm -60.45 -37.58 75.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.399 0.618 . . . . 64.23 110.609 -178.326 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.542 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 79.0 mt -60.94 -40.03 91.71 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.473 -0.785 . . . . 52.54 111.143 179.351 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' B' ' 135' ' ' ARG . 28.4 ttt180 -65.61 -42.93 91.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.733 0.301 . . . . 54.11 110.359 177.408 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -61.33 -35.62 77.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.867 -0.606 . . . . 64.24 111.317 -179.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -98.09 9.21 43.42 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.186 -0.461 . . . . 74.34 110.841 -179.401 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 63.1 41.09 8.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.422 -0.808 . . . . 74.22 112.619 171.308 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 139' ' ' PHE . . . . . 0.542 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 26.3 m-85 -74.01 -15.39 61.09 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.541 -0.54 . . . . 73.42 109.541 170.052 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 52.5 74.62 0.75 Allowed Pre-proline 0 C--O 1.234 0.262 0 CA-C-N 114.89 -1.05 . . . . 71.11 110.952 -176.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.443 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 95.8 Cg_endo -88.22 178.42 3.04 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.875 2.383 . . . . 74.44 111.904 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 142' ' ' LYS . . . . . 0.476 ' H ' ' HA ' ' A' ' 49' ' ' LEU . 0.7 OUTLIER -127.07 141.54 51.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.33 0.586 . . . . 51.44 111.211 -179.77 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -141.31 50.37 1.61 Allowed 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 107.267 -1.383 . . . . 70.34 107.267 177.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.55 86.71 1.59 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.702 -1.135 . . . . 74.44 111.301 -171.723 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 71.3 m -83.06 69.97 9.95 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.229 0.538 . . . . 72.54 110.051 175.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.34 44.67 1.16 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.455 0.645 . . . . 74.23 109.609 177.124 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 147' ' ' VAL . . . . . 0.406 HG13 ' HA ' ' A' ' 43' ' ' PHE . 85.8 t -76.72 101.9 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 115.26 -0.882 . . . . 63.42 109.825 178.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -131.93 111.27 11.41 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.276 -0.874 . . . . 74.14 109.756 178.333 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.787 ' H ' HD23 ' B' ' 149' ' ' LEU . 0.3 OUTLIER -76.96 90.11 3.54 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.273 -0.421 . . . . 71.23 110.692 -178.34 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.589 ' HA ' ' O ' ' B' ' 158' ' ' LYS . . . -80.15 85.0 5.76 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.531 -0.759 . . . . 71.3 109.831 174.358 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 151' ' ' PHE . . . . . 0.408 ' HB2' ' HB3' ' A' ' 39' ' ' PHE . 52.1 p90 -104.67 165.5 11.02 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.924 -0.58 . . . . 74.1 110.319 -177.579 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 2.4 tppp? -93.65 116.11 28.59 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.006 -0.543 . . . . 65.32 110.032 176.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 153' ' ' CYS . . . . . . . . . . . . . 23.1 t -88.85 -131.61 0.08 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.322 -0.854 . . . . 75.41 110.028 178.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -74.06 35.98 0.09 Allowed 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 123.962 0.905 . . . . 71.44 111.556 -179.068 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 110.59 -17.18 28.39 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.676 -0.773 . . . . 60.41 111.541 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 156' ' ' GLU . . . . . 0.431 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 13.1 pt-20 -106.06 140.85 38.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.879 0.371 . . . . 74.45 110.631 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 41.3 mm -82.93 120.65 34.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 109.494 -0.558 . . . . 64.44 109.494 176.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 158' ' ' LYS . . . . . 0.589 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 31.6 mmmt -103.99 132.75 49.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.682 0.277 . . . . 63.33 111.084 -176.292 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -112.58 103.7 11.76 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.212 -0.449 . . . . 74.43 111.377 177.133 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 160' ' ' PHE . . . . . 0.461 ' CD2' HD13 ' B' ' 166' ' ' LEU . 64.6 m-85 -120.01 143.69 47.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.135 -0.484 . . . . 63.45 110.722 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 18.9 p -118.57 -18.37 9.08 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.49 0.662 . . . . 50.33 109.481 173.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -111.16 138.66 47.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.293 -0.867 . . . . 63.33 109.206 178.217 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.9 pp -81.69 -10.96 59.25 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.858 -0.423 . . . . 72.35 109.858 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -65.49 -51.98 56.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.364 0.602 . . . . 72.14 109.83 175.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 165' ' ' SER . . . . . 0.519 ' O ' ' HG3' ' B' ' 168' ' ' LYS . 0.3 OUTLIER -70.42 -31.64 68.91 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.363 -0.835 . . . . 53.33 110.623 179.287 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 166' ' ' LEU . . . . . 0.461 HD13 ' CD2' ' B' ' 160' ' ' PHE . 68.7 tp -69.99 -41.36 74.51 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.179 -0.464 . . . . 72.13 110.593 177.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 167' ' ' ARG . . . . . 0.67 ' HG3' HD13 ' B' ' 184' ' ' LEU . 50.6 ttp180 -61.88 -47.63 84.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.364 -0.38 . . . . 74.31 110.772 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 168' ' ' LYS . . . . . 0.519 ' HG3' ' O ' ' B' ' 165' ' ' SER . 0.0 OUTLIER -65.22 -36.54 84.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.925 0.393 . . . . 40.44 110.879 -179.711 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -65.52 -48.62 71.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.738 -0.665 . . . . 74.12 110.606 175.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.02 -37.04 83.41 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.403 -0.362 . . . . 60.13 111.446 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 10.9 t -68.43 -22.31 64.61 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.401 -0.363 . . . . 50.42 111.26 -177.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -102.05 3.53 38.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.955 0.407 . . . . 73.41 110.633 178.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 173' ' ' LYS . . . . . 0.45 ' O ' ' HB2' ' B' ' 177' ' ' LYS . 27.4 mmmt -104.27 111.81 24.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.181 -0.463 . . . . 72.44 110.747 -179.528 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 25.2 m -52.8 -31.75 40.38 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 123.241 0.338 . . . . 43.43 111.898 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 11.0 p -81.84 -49.49 10.3 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.757 0.313 . . . . 63.42 111.622 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.457 ' HA ' HD12 ' B' ' 179' ' ' LEU . 82.1 mtp -80.78 -18.61 47.04 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.201 0.445 . . . . 72.11 112.201 -172.369 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 177' ' ' LYS . . . . . 0.45 ' HB2' ' O ' ' B' ' 173' ' ' LYS . 79.8 tttt -60.88 -31.31 70.79 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.183 -0.462 . . . . 74.43 110.936 -176.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 178' ' ' GLU . . . . . 0.925 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 44.4 mt-10 -99.15 3.28 46.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.457 0.646 . . . . 65.44 110.641 -174.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 179' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' B' ' 176' ' ' MET . 86.3 mt -93.38 -56.44 2.94 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.464 -0.789 . . . . 54.22 110.378 178.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 180' ' ' LEU . . . . . 0.43 ' HB3' HD12 ' B' ' 184' ' ' LEU . 3.5 mm? -76.54 -10.98 59.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.665 -0.698 . . . . 64.31 111.666 -176.206 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 181' ' ' LYS . . . . . 0.925 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 17.5 ptmt -61.37 -9.43 5.36 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.851 0.686 . . . . 72.31 112.851 -174.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -76.09 -31.91 58.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.998 0.428 . . . . 65.41 110.585 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 20.8 m -113.24 -10.77 12.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.016 -0.538 . . . . 61.31 110.806 178.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 184' ' ' LEU . . . . . 0.67 HD13 ' HG3' ' B' ' 167' ' ' ARG . 95.7 mt -110.62 109.43 57.95 Favored Pre-proline 0 C--N 1.327 -0.388 0 N-CA-C 108.977 -0.749 . . . . 71.24 108.977 173.769 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -45.04 96.47 0.03 OUTLIER 'Trans proline' 0 C--O 1.238 0.477 0 C-N-CA 124.201 3.267 . . . . 71.21 114.57 -170.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 186' ' ' GLN . . . . . 0.751 ' HB2' ' HB2' ' B' ' 181' ' ' LYS . 79.2 mt-30 -139.63 104.76 5.0 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.717 -0.846 . . . . 74.21 108.717 172.181 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -72.46 -47.71 46.72 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.233 -0.439 . . . . 61.44 111.735 -173.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 . . . . . 0 C--O 1.245 0.83 0 CA-C-O 118.529 -0.748 . . . . 73.45 110.269 -177.98 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.71 0 N-CA-C 111.623 -0.591 . . . . 64.44 111.623 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 42.6 t -91.43 -55.4 6.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.734 -0.469 . . . . 74.03 109.734 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 19.8 tp -90.6 151.48 21.29 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.766 -0.652 . . . . 72.05 109.696 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -76.84 104.55 7.4 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.412 0.625 . . . . 61.11 110.435 178.617 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -107.73 156.09 19.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.797 -0.638 . . . . 73.41 110.033 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -133.8 135.73 44.03 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.156 -0.474 . . . . 60.14 110.199 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -96.64 -95.65 1.85 Allowed Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.613 -0.803 . . . . 53.31 112.201 -179.413 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -147.89 168.31 22.55 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.667 0.27 . . . . 74.11 111.115 -177.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 24.3 m -98.97 153.67 4.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.118 -0.492 . . . . 64.34 110.549 177.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.1 pp -91.32 173.03 8.13 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.244 -0.435 . . . . 62.44 110.356 177.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.3 m -124.61 120.73 32.74 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.289 0.566 . . . . 73.21 111.388 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.551 HD23 ' N ' ' A' ' 13' ' ' ALA . 4.4 tt -114.33 142.4 46.37 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.213 -1.032 . . . . 74.14 108.213 176.465 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.843 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -104.57 102.79 12.39 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.836 0.351 . . . . 63.12 111.281 -176.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 18' ' ' SER . . . -67.29 -34.22 76.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.179 -0.464 . . . . 71.11 111.707 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -100.48 -41.79 6.85 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.867 0.365 . . . . 72.55 111.304 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.843 ' HB3' ' HB1' ' A' ' 13' ' ' ALA . 57.0 tp -72.85 -27.2 61.79 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.18 -0.464 . . . . 74.14 111.804 -175.721 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 31.4 t -119.34 -47.81 2.44 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.886 -0.326 . . . . 74.22 111.087 -177.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 19.8 m -84.56 52.67 2.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.893 0.378 . . . . 50.43 111.648 -178.211 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -94.16 174.41 7.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.355 -0.384 . . . . 64.11 110.048 177.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.9 t -91.72 158.64 16.26 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.74 -0.384 . . . . 74.02 110.561 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.431 HD23 ' N ' ' A' ' 21' ' ' LEU . 2.2 pt? -139.74 20.15 2.51 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.321 -0.4 . . . . 74.42 111.171 -177.454 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -95.1 173.44 7.57 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.216 -0.29 . . . . 74.03 110.216 -179.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 10.7 tt -126.7 -43.77 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 C-N-CA 120.953 -0.299 . . . . 74.34 111.709 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.4 m -153.65 157.03 38.98 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.057 -0.402 . . . . 73.4 111.872 -176.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.827 ' HD3' ' HA ' ' B' ' 164' ' ' GLN . 0.0 OUTLIER -168.07 21.2 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.733 -0.667 . . . . 71.1 109.333 175.325 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -68.13 122.78 19.01 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.586 -0.734 . . . . 75.41 111.399 -171.182 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 8.1 t-105 -150.32 -174.2 4.67 Favored 'General case' 0 N--CA 1.442 -0.831 0 N-CA-C 108.329 -0.989 . . . . 72.32 108.329 178.4 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 15.2 m -96.83 -1.59 45.81 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.315 0.579 . . . . 63.02 110.762 -172.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -84.17 14.22 4.47 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.836 -0.62 . . . . 65.12 111.392 -175.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.599 HG12 HD13 ' B' ' 163' ' ' LEU . 17.4 m -60.82 -47.67 92.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 112.346 0.499 . . . . 74.43 112.346 -176.199 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -104.99 2.34 29.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.637 0.256 . . . . 63.31 111.062 -176.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.591 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 6.5 t30 -65.69 -42.5 91.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.27 -0.423 . . . . 63.54 110.922 -173.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.63 HG21 ' HB3' ' B' ' 179' ' ' LEU . 30.2 mm -74.26 -32.8 32.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.643 0.735 . . . . 62.24 110.479 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.507 HD12 HD23 ' B' ' 149' ' ' LEU . 76.6 mt -70.75 -34.48 71.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.387 -0.824 . . . . 70.01 111.749 -175.581 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.569 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 7.9 ptm180 -69.62 -37.24 76.76 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.969 0.414 . . . . 61.11 110.536 178.548 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.591 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 38.2 mt-10 -63.33 -44.68 94.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.61 -0.723 . . . . 75.14 111.387 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 -95.41 5.99 50.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.255 -0.43 . . . . 75.2 110.973 -175.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 55.48 65.77 1.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.355 -0.839 . . . . 74.01 112.685 177.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.409 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 4.6 m-85 -90.53 -3.61 57.48 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.461 -0.791 . . . . 73.31 109.397 170.185 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.402 ' O ' ' HA ' ' B' ' 151' ' ' PHE . 45.3 mt-10 56.98 71.17 1.18 Allowed Pre-proline 0 CA--C 1.53 0.186 0 CA-C-N 114.958 -1.019 . . . . 64.42 111.565 -179.329 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.402 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 85.1 Cg_endo -85.18 170.11 9.69 Favored 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 122.456 2.104 . . . . 63.41 111.693 177.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.651 ' HD3' ' HB3' ' B' ' 150' ' ' ALA . 5.1 mptp? -93.46 -178.58 4.77 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 121.07 -0.252 . . . . 73.43 110.359 179.648 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 73.8 t80 172.93 -40.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.426 0.631 . . . . 74.41 110.469 -169.037 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -78.16 98.15 5.73 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.104 -0.953 . . . . 73.44 110.667 -177.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 37.1 t -130.63 157.71 42.0 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.953 -0.567 . . . . 73.43 109.561 179.075 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.5 mp0 -73.22 92.47 1.76 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.178 0.513 . . . . 71.53 110.488 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.631 HG22 ' SG ' ' B' ' 145' ' ' CYS . 3.0 t -81.37 163.04 3.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.818 -0.628 . . . . 61.23 109.927 179.077 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.74 118.77 36.52 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.475 0.655 . . . . 74.42 109.79 174.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.79 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.9 mp -75.55 94.8 3.22 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.353 -0.84 . . . . 70.41 110.949 -175.724 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -87.25 59.33 5.5 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.637 -0.505 . . . . 63.34 109.637 172.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.79 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 54.9 p90 -88.08 166.94 14.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.097 -0.501 . . . . 74.24 110.713 -176.058 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.4 tppp? -96.15 131.51 42.52 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.524 -0.762 . . . . 73.44 110.415 179.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.473 ' SG ' ' HE2' ' A' ' 69' ' ' PHE . 49.7 t -139.35 107.73 5.82 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.869 0.366 . . . . 73.22 110.478 175.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 t70 70.54 13.56 7.36 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.429 -0.805 . . . . 74.04 111.56 172.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 120.17 -29.6 5.92 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.291 -0.957 . . . . 64.51 112.702 177.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.449 ' CD ' ' HD3' ' A' ' 58' ' ' LYS . 12.7 pt-20 -102.17 155.2 18.36 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 110.064 -0.347 . . . . 75.3 110.064 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 47.8 mm -86.86 129.2 38.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.494 -0.558 . . . . 74.32 109.494 176.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.561 ' HB3' ' CE2' ' A' ' 60' ' ' PHE . 31.7 mmmt -117.56 97.01 5.65 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 121.266 -0.174 . . . . 44.45 110.767 -176.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.58 ' HA ' ' O ' ' A' ' 49' ' ' LEU . 0.6 OUTLIER -79.09 110.31 14.22 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.872 0.323 . . . . 70.13 111.872 -179.855 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.561 ' CE2' ' HB3' ' A' ' 58' ' ' LYS . 82.6 m-85 -129.47 140.1 51.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.803 0.335 . . . . 65.5 110.369 176.604 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.7 p -124.01 13.32 9.09 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.234 0.54 . . . . 62.43 110.557 176.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -140.01 -177.74 5.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.849 -0.614 . . . . 72.21 110.738 -176.439 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.47 HD13 HG22 ' B' ' 130' ' ' VAL . 26.6 tp -127.91 32.6 4.91 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.746 -0.661 . . . . 33.55 109.972 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -120.82 -42.66 2.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.171 0.51 . . . . 64.33 109.871 177.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.6 m -81.14 -43.05 19.96 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.641 -0.503 . . . . 55.43 109.641 174.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.544 HD12 ' HB2' ' A' ' 60' ' ' PHE . 5.9 tt -63.4 -41.52 98.76 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.447 -0.575 . . . . 62.41 109.447 177.51 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.6 ttt180 -60.0 -38.66 83.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.808 -0.633 . . . . 73.04 110.996 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.1 mtmm -64.71 -43.24 94.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.935 0.397 . . . . 70.35 110.673 175.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.473 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 64.1 t80 -63.44 -44.91 93.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.002 -0.545 . . . . 74.42 110.541 179.331 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.46 -25.58 66.79 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.855 -0.612 . . . . 64.53 111.95 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.1 t -80.71 -28.48 36.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.506 0.193 . . . . 73.41 111.21 -177.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -88.38 -19.32 26.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.209 0.528 . . . . 75.44 110.16 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -86.68 118.8 26.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.586 -0.733 . . . . 70.13 110.67 176.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.4 m -62.21 -40.33 95.75 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.004 0.43 . . . . 74.04 110.303 178.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.402 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 36.4 t -63.67 -49.11 74.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.679 -0.691 . . . . 73.42 110.787 -179.182 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 68.9 mtp -78.62 -14.99 59.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.295 -0.411 . . . . 70.11 111.183 -175.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.434 ' HE3' ' HB2' ' A' ' 77' ' ' LYS . 38.8 ttmt -64.3 -32.65 74.34 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.082 -0.508 . . . . 61.22 110.549 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.469 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 20.6 mm-40 -88.99 -4.26 58.48 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 121.639 0.733 . . . . 65.12 110.127 -178.319 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.612 ' HB3' HG21 ' B' ' 133' ' ' ILE . 49.0 mt -95.19 -52.96 3.97 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.835 -1.075 . . . . 73.03 109.583 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.682 ' HB3' HD13 ' A' ' 84' ' ' LEU . 4.1 mm? -84.8 -0.75 54.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.298 -0.864 . . . . 71.33 111.412 -176.744 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.469 ' HD3' ' HA ' ' A' ' 78' ' ' GLU . 64.7 pttt -56.74 -14.44 3.34 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 111.895 0.331 . . . . 62.15 111.895 176.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -63.4 -42.11 98.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.995 0.426 . . . . 75.23 110.862 176.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.411 HG13 HD12 ' A' ' 84' ' ' LEU . 7.5 p -111.52 -15.64 9.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.308 0.575 . . . . 64.12 111.009 -176.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.682 HD13 ' HB3' ' A' ' 80' ' ' LEU . 11.2 mp -90.33 129.45 45.37 Favored Pre-proline 0 C--N 1.327 -0.412 0 N-CA-C 109.882 -0.414 . . . . 54.52 109.882 173.686 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 84' ' ' LEU . 27.4 Cg_exo -61.45 102.15 0.22 Allowed 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 123.024 2.483 . . . . 73.34 112.527 -177.444 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -141.79 145.46 34.79 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.147 -0.478 . . . . 64.53 109.72 -178.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt 52.32 37.58 22.67 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 123.861 0.726 . . . . 75.12 111.66 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 . . . . . 0 C--N 1.317 -0.821 0 CA-C-N 115.404 -0.816 . . . . 62.13 111.103 -179.358 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.301 0 N-CA-C 112.023 -0.431 . . . . 32.52 112.023 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 48.7 t -87.76 -45.51 16.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 109.513 -0.551 . . . . 45.44 109.513 178.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 3.5 pp -140.64 153.12 45.9 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.373 -0.831 . . . . 64.23 109.914 175.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 89.6 mmm -115.29 108.35 16.45 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.906 0.384 . . . . 73.24 111.16 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -75.17 119.04 18.77 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.107 -0.701 . . . . 62.25 109.107 171.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -138.47 104.15 5.07 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.036 -0.529 . . . . 74.13 110.423 -172.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -176.27 -35.91 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.727 -0.749 . . . . 74.2 112.369 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -79.16 75.97 5.69 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.31 0.576 . . . . 64.33 111.244 -178.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 70.2 t -97.76 128.36 49.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.718 -0.674 . . . . 75.03 110.324 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 110' ' ' LEU . . . . . 0.792 ' H ' HD13 ' B' ' 110' ' ' LEU . 0.0 OUTLIER -92.31 178.41 5.85 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.331 -0.395 . . . . 62.24 110.616 178.455 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 11.2 t -147.92 163.54 36.51 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.877 -0.416 . . . . 62.42 109.877 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 5.1 tt -143.09 127.21 17.48 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.136 -0.691 . . . . 73.54 109.136 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 113' ' ' ALA . . . . . 0.561 ' HB3' ' HB2' ' B' ' 117' ' ' SER . . . -84.35 103.87 13.89 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.768 0.318 . . . . 74.51 110.157 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -60.7 -45.29 94.78 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.601 -0.727 . . . . 74.3 112.159 -172.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -91.57 -36.48 13.67 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.758 0.313 . . . . 65.42 111.492 -177.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.535 ' HB3' ' HB1' ' B' ' 113' ' ' ALA . 47.9 tp -82.22 -59.88 2.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 74.54 111.941 -172.828 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.561 ' HB2' ' HB3' ' B' ' 113' ' ' ALA . 5.6 t -71.01 -41.29 71.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.015 0.436 . . . . 75.42 109.872 -176.169 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 24.4 m -92.65 87.07 5.77 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.588 -0.523 . . . . 64.31 109.588 174.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -81.53 111.01 17.45 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.02 -0.537 . . . . 73.11 110.796 -175.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 120' ' ' THR . . . . . 0.412 HG22 ' H ' ' B' ' 122' ' ' ASP . 21.4 m -60.71 111.93 1.82 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.0 -0.546 . . . . 63.5 111.31 -178.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 121' ' ' LEU . . . . . 0.816 HD23 ' H ' ' B' ' 121' ' ' LEU . 2.5 pt? -99.82 22.23 11.38 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.931 -0.577 . . . . 75.13 110.407 -179.187 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 122' ' ' ASP . . . . . 0.412 ' H ' HG22 ' B' ' 120' ' ' THR . 18.4 t70 -64.4 117.52 7.4 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.829 -0.623 . . . . 74.14 110.169 -177.174 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 123' ' ' ILE . . . . . 0.898 HG12 ' H ' ' B' ' 124' ' ' SER . 13.0 tt -86.09 -168.93 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-N 115.5 -0.773 . . . . 73.01 111.379 -170.252 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.898 ' H ' HG12 ' B' ' 123' ' ' ILE . 7.8 m -80.24 141.64 35.38 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 120.917 0.389 . . . . 73.04 111.628 -178.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 125' ' ' LYS . . . . . 0.421 ' HE3' ' HB3' ' B' ' 125' ' ' LYS . 0.0 OUTLIER -162.68 32.2 0.1 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.318 0.58 . . . . 52.31 109.743 176.148 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -64.67 113.76 3.97 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.404 -0.816 . . . . 63.23 110.612 -174.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 9.8 t-105 -132.91 -162.86 1.28 Allowed 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.172 -0.922 . . . . 75.51 108.904 -173.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 15.6 m -105.49 -0.55 25.81 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.202 0.525 . . . . 63.31 110.739 -178.08 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -83.44 56.25 3.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.799 -0.637 . . . . 73.41 110.994 -176.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.47 HG22 HD13 ' A' ' 63' ' ' LEU . 32.3 t -119.18 -68.54 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.114 -0.494 . . . . 74.54 110.644 -178.719 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -70.85 -19.44 62.64 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.044 -0.526 . . . . 75.04 111.291 -177.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.487 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 50.4 t30 -59.2 -51.1 71.44 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 116.117 -0.492 . . . . 74.32 110.965 -178.435 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 133' ' ' ILE . . . . . 0.612 HG21 ' HB3' ' A' ' 79' ' ' LEU . 4.0 mp -67.88 -34.09 65.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.367 0.603 . . . . 72.53 110.563 -177.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.615 HD12 HD23 ' A' ' 49' ' ' LEU . 92.4 mt -73.47 -25.24 60.39 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.834 -0.621 . . . . 74.43 111.985 -175.508 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.601 ' HG3' ' N ' ' B' ' 136' ' ' GLU . 3.5 ptp180 -75.96 -40.43 53.96 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.54 -0.464 . . . . 74.35 109.82 175.097 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 136' ' ' GLU . . . . . 0.601 ' N ' ' HG3' ' B' ' 135' ' ' ARG . 10.4 mm-40 -58.7 -45.51 89.35 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.355 -0.839 . . . . 62.03 111.142 -179.183 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -95.81 5.83 50.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.783 -0.644 . . . . 63.14 111.323 -175.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 52.54 70.11 0.61 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.512 -0.767 . . . . 73.21 112.742 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -96.09 4.88 52.21 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.55 -0.75 . . . . 71.32 109.989 172.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 55.57 67.69 2.87 Favored Pre-proline 0 C--O 1.232 0.155 0 CA-C-N 115.023 -0.989 . . . . 73.24 111.238 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.474 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 90.1 Cg_endo -88.2 165.31 6.93 Favored 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 122.528 2.152 . . . . 74.2 112.415 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -93.04 172.75 8.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.816 -0.629 . . . . 61.43 109.512 175.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 143' ' ' PHE . . . . . 0.453 ' CA ' HG11 ' A' ' 47' ' ' VAL . 64.1 t80 179.24 -32.72 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.582 0.706 . . . . 64.25 110.237 -170.319 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -80.57 99.3 8.02 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.165 -0.925 . . . . 71.11 109.749 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 145' ' ' CYS . . . . . 0.631 ' SG ' HG22 ' A' ' 47' ' ' VAL . 13.5 p -117.47 175.8 5.46 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.791 -0.64 . . . . 71.22 110.443 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 -83.52 81.88 8.54 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.079 0.466 . . . . 73.32 110.41 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 31.1 t -84.77 152.27 3.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.445 -0.798 . . . . 75.43 109.718 178.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 148' ' ' LYS . . . . . 0.698 ' H ' ' HD3' ' B' ' 148' ' ' LYS . 0.3 OUTLIER -110.75 130.28 55.62 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 109.123 -0.695 . . . . 72.0 109.123 176.501 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.717 ' HB3' ' HD1' ' B' ' 151' ' ' PHE . 9.7 mp -71.65 90.61 1.05 Allowed 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.51 -0.768 . . . . 73.44 110.511 -178.233 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.651 ' HB3' ' HD3' ' A' ' 42' ' ' LYS . . . -87.7 68.29 9.43 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.621 -0.511 . . . . 63.31 109.621 174.654 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 151' ' ' PHE . . . . . 0.717 ' HD1' ' HB3' ' B' ' 149' ' ' LEU . 53.5 p90 -100.17 164.91 11.76 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.763 -0.653 . . . . 72.44 110.622 -176.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 5.3 tppp? -93.98 120.16 33.86 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.744 -0.662 . . . . 74.24 110.431 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 153' ' ' CYS . . . . . 0.477 ' SG ' ' HE2' ' B' ' 169' ' ' PHE . 43.5 t -125.77 108.77 11.82 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 116.448 -0.342 . . . . 61.54 110.528 177.316 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 2.0 t70 68.8 10.25 7.8 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.527 -0.76 . . . . 71.24 111.852 170.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 119.99 -19.94 9.35 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.314 -0.946 . . . . 75.24 112.824 179.079 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 156' ' ' GLU . . . . . 0.578 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 9.9 pt-20 -112.95 139.04 48.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.798 0.333 . . . . 75.34 110.284 178.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 44.0 mm -75.48 118.4 21.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.216 -0.447 . . . . 74.44 109.919 177.437 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 158' ' ' LYS . . . . . 0.578 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 31.7 mmmt -107.78 94.52 5.12 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.557 -0.292 . . . . 53.14 110.896 -175.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 159' ' ' THR . . . . . 0.499 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.7 OUTLIER -74.44 117.21 15.99 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.954 0.406 . . . . 63.3 110.852 177.852 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 160' ' ' PHE . . . . . 0.526 ' CD2' HD13 ' B' ' 166' ' ' LEU . 41.4 m-85 -126.29 120.09 29.07 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.139 -0.482 . . . . 74.43 110.003 176.765 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 25.5 p -101.1 6.7 43.37 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.378 0.609 . . . . 73.33 109.844 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -150.29 162.22 40.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.322 -0.854 . . . . 65.03 110.137 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 163' ' ' LEU . . . . . 0.599 HD13 HG12 ' A' ' 30' ' ' VAL . 35.3 tp -96.28 -1.61 47.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.171 0.51 . . . . 74.11 111.151 -176.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 164' ' ' GLN . . . . . 0.827 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 61.5 tt0 -81.42 -52.03 7.69 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.727 -0.472 . . . . 72.43 109.727 -178.344 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 3.2 m -67.25 -28.56 68.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.576 -0.738 . . . . 71.13 110.104 177.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 166' ' ' LEU . . . . . 0.526 HD13 ' CD2' ' B' ' 160' ' ' PHE . 43.5 tp -64.54 -39.47 93.82 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.16 -0.473 . . . . 73.01 110.258 178.486 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 75.2 ttt180 -65.04 -38.0 89.44 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.818 -0.438 . . . . 52.5 109.818 175.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 168' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' B' ' 164' ' ' GLN . 13.1 mmmm -56.51 -36.95 69.76 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.583 -0.735 . . . . 71.44 110.576 179.31 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 169' ' ' PHE . . . . . 0.528 ' O ' ' HG2' ' B' ' 173' ' ' LYS . 58.0 t80 -89.54 -47.73 7.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.463 -0.79 . . . . 73.44 110.945 -177.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.18 -33.18 74.05 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.664 0.616 . . . . 75.23 112.664 -176.188 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 6.5 t -67.54 -20.13 65.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.658 0.266 . . . . 34.52 111.441 -175.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 172' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 11.4 pt20 -105.49 -3.2 22.75 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.913 0.387 . . . . 75.42 110.534 179.034 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 173' ' ' LYS . . . . . 0.602 ' HB2' ' HB2' ' B' ' 176' ' ' MET . 29.8 mmmt -87.23 129.89 34.79 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.176 -0.466 . . . . 63.34 111.017 -178.492 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 3.5 m -56.66 -45.6 81.56 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.701 -0.681 . . . . 51.25 110.593 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 175' ' ' SER . . . . . 0.472 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 40.1 t -82.92 -49.17 9.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.018 -0.537 . . . . 73.12 111.703 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.602 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 66.1 mtp -70.75 -20.53 62.62 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.405 0.52 . . . . 72.03 112.405 -169.324 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 177' ' ' LYS . . . . . 0.498 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 88.8 tttt -62.11 -35.01 77.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.982 0.42 . . . . 74.52 110.641 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 178' ' ' GLU . . . . . 0.458 ' HA ' ' HD3' ' B' ' 181' ' ' LYS . 25.9 mm-40 -91.22 -8.76 47.56 Favored 'General case' 0 CA--C 1.511 -0.519 0 CA-C-O 121.619 0.723 . . . . 73.53 110.213 -176.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 179' ' ' LEU . . . . . 0.63 ' HB3' HG21 ' A' ' 33' ' ' ILE . 81.2 mt -89.9 -48.41 7.24 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.883 -1.053 . . . . 75.32 109.798 178.535 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 180' ' ' LEU . . . . . 0.651 ' HB3' HD13 ' B' ' 184' ' ' LEU . 4.2 mm? -86.17 -11.05 53.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.574 -0.739 . . . . 45.15 111.778 -176.228 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 181' ' ' LYS . . . . . 0.498 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 64.1 pttt -55.71 -18.3 7.83 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 111.625 0.232 . . . . 73.24 111.625 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -60.16 -46.85 88.27 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.821 0.343 . . . . 75.11 110.879 177.087 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 17.4 m -105.98 -14.46 9.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.128 -0.487 . . . . 45.23 111.375 -176.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 184' ' ' LEU . . . . . 0.651 HD13 ' HB3' ' B' ' 180' ' ' LEU . 8.2 mp -81.95 137.09 46.87 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 109.739 -0.467 . . . . 64.02 109.739 176.418 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 185' ' ' PRO . . . . . 0.492 ' HD3' ' HA ' ' B' ' 184' ' ' LEU . 12.6 Cg_exo -70.14 74.75 1.43 Allowed 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 122.823 2.348 . . . . 62.33 112.108 179.464 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -130.64 158.78 39.11 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.721 -0.672 . . . . 73.35 109.901 178.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp 54.77 80.87 0.12 Allowed 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.37 1.044 . . . . 73.41 112.406 175.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 . . . . . 0 C--O 1.247 0.967 0 CA-C-N 115.08 -0.964 . . . . 75.3 109.672 175.597 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.795 0 N-CA-C 111.496 -0.642 . . . . 41.04 111.496 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 3.4 p -150.4 110.7 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.512 0.672 . . . . 61.33 110.765 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -104.15 137.19 42.44 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.758 -0.656 . . . . 71.4 110.016 178.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -94.3 25.41 3.85 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.89 -0.596 . . . . 63.11 110.572 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -96.7 150.42 20.7 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.311 -0.859 . . . . 71.43 110.704 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -115.32 83.31 1.9 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.92 -0.771 . . . . 72.34 108.92 172.11 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -105.13 30.17 10.41 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.474 -0.785 . . . . 74.21 112.283 -176.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -101.85 84.97 2.62 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.672 -0.492 . . . . 75.23 109.672 177.036 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 58.1 t -125.3 119.92 56.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.669 -0.696 . . . . 73.51 110.23 -175.207 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.6 pp -90.24 153.57 20.38 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.943 -0.571 . . . . 72.43 110.955 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 13.1 t -146.58 -173.49 4.22 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.208 -0.664 . . . . 75.12 109.208 178.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.404 ' HB3' ' HG3' ' B' ' 126' ' ' GLN . 4.0 pp -114.54 156.76 24.03 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.278 0.561 . . . . 63.21 111.155 177.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.668 ' HB3' ' HA ' ' A' ' 17' ' ' SER . . . -82.44 -167.15 1.48 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.146 -0.934 . . . . 75.01 111.753 -176.899 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.9 -39.1 2.75 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.111 -0.495 . . . . 35.42 110.751 176.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -90.18 -44.98 9.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.954 -0.566 . . . . 71.24 110.661 178.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.433 ' C ' ' HB3' ' A' ' 13' ' ' ALA . 23.0 tp -119.7 53.34 1.05 Allowed 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 107.608 -1.256 . . . . 71.33 107.608 175.49 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.668 ' HA ' ' HB3' ' A' ' 13' ' ' ALA . 2.5 m -43.43 -39.65 3.36 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 114.609 -1.178 . . . . 75.04 113.196 -169.363 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.3 p -170.7 158.58 6.16 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.8 -0.636 . . . . 75.34 110.677 -174.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -152.1 108.7 3.46 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.453 -0.339 . . . . 55.44 110.692 178.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 14.5 t -96.74 -5.08 39.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.633 0.73 . . . . 71.53 109.447 175.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 59.0 tp -131.79 116.56 17.41 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.16 -0.927 . . . . 53.43 109.769 178.365 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.44 ' OD2' ' HD2' ' A' ' 25' ' ' LYS . 2.3 p-10 -84.87 126.04 33.14 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.253 0.549 . . . . 64.41 110.628 179.235 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 9.0 tt -81.71 -51.17 15.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.916 -0.584 . . . . 71.21 111.483 -176.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.3 t -113.53 109.03 17.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.396 0.617 . . . . 75.4 111.901 -173.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.44 ' HD2' ' OD2' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -115.13 67.72 0.7 Allowed 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.249 -0.887 . . . . 72.43 109.346 171.473 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -73.77 -12.95 60.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.681 -0.691 . . . . 73.52 110.636 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.418 ' HB3' ' H ' ' A' ' 28' ' ' SER . 90.5 m95 -99.31 -156.13 0.53 Allowed 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.557 -0.747 . . . . 74.11 109.236 174.136 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.418 ' H ' ' HB3' ' A' ' 27' ' ' TRP . 79.9 p 56.69 6.34 0.28 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.296 1.039 . . . . 73.12 113.683 178.09 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.629 ' HB3' HG21 ' B' ' 183' ' ' VAL . 47.0 t30 -78.6 69.26 4.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.664 0.745 . . . . 71.2 109.613 176.259 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.664 HG13 HD11 ' B' ' 180' ' ' LEU . 46.1 t -119.16 -46.27 3.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.206 -0.906 . . . . 71.24 109.748 179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -56.35 -43.45 79.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.683 -0.689 . . . . 72.23 110.44 178.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.535 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 8.5 t30 -60.0 -51.7 68.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.629 -0.714 . . . . 75.22 110.698 178.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.482 HG22 ' OD1' ' A' ' 37' ' ' ASN . 50.1 mm -58.67 -53.59 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 116.39 -0.368 . . . . 74.24 110.718 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 88.7 mt -54.92 -32.55 61.25 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.148 -0.478 . . . . 73.34 111.759 -178.766 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 34.6 ttt180 -69.29 -41.28 77.0 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.854 -0.339 . . . . 74.42 110.361 176.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.535 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 30.2 mt-10 -68.69 -35.53 77.31 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.299 -0.41 . . . . 71.04 110.353 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.482 ' OD1' HG22 ' A' ' 33' ' ' ILE . 4.3 m120 -73.48 -13.62 61.09 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.122 -0.49 . . . . 64.34 109.806 177.152 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.4 t70 68.4 36.4 3.02 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.202 -0.908 . . . . 62.14 110.982 -178.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -75.67 -22.92 56.26 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.848 -0.615 . . . . 73.41 109.522 172.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 60.31 82.66 0.22 Allowed Pre-proline 0 N--CA 1.463 0.191 0 CA-C-N 114.806 -1.088 . . . . 70.4 111.046 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.709 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 60.1 Cg_endo -87.83 178.24 3.28 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.878 2.385 . . . . 73.34 111.929 177.242 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.448 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 0.0 OUTLIER -121.25 149.19 43.23 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.744 0.307 . . . . 73.12 110.989 -177.772 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.482 ' HA ' HG13 ' B' ' 147' ' ' VAL . 78.4 t80 -162.33 84.53 0.56 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.62 -0.718 . . . . 71.12 109.37 -174.86 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.411 HD13 ' HA ' ' A' ' 44' ' ' LEU . 4.2 mm? -87.9 80.63 7.75 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.143 0.496 . . . . 75.03 110.391 -178.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 42.5 t -132.52 81.87 1.98 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.785 -0.643 . . . . 74.14 109.807 -179.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.88 23.3 1.56 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.537 -0.756 . . . . 64.33 109.288 178.273 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.576 HG11 ' HB2' ' B' ' 145' ' ' CYS . 4.6 m -66.75 154.93 7.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.774 -1.103 . . . . 71.33 112.047 -167.472 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -131.62 133.8 45.33 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 107.737 -1.209 . . . . 74.15 107.737 176.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 35.5 tp -79.96 68.42 6.07 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.497 -0.927 . . . . 61.43 108.497 173.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.584 ' HB2' HG22 ' A' ' 59' ' ' THR . . . -84.3 97.86 9.68 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 114.892 -1.049 . . . . 51.42 110.616 -176.755 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -111.39 165.99 11.49 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.974 -0.557 . . . . 52.1 110.376 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -90.28 124.9 35.27 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.139 -0.482 . . . . 71.54 110.275 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 14.7 t -138.54 116.88 11.94 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.777 -0.453 . . . . 62.21 109.777 178.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 64.63 16.22 10.2 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.714 0.635 . . . . 63.34 112.714 176.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 107.69 -17.5 36.0 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.068 -1.063 . . . . 65.33 112.412 177.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -111.78 146.66 37.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.777 0.323 . . . . 72.51 110.433 177.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 45.2 mm -79.84 126.9 39.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.165 -0.47 . . . . 74.11 110.14 178.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.483 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 27.6 mmmt -107.33 117.3 33.71 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.113 -0.329 . . . . 74.11 110.113 -179.134 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.584 HG22 ' HB2' ' A' ' 50' ' ' ALA . 2.6 p -93.91 123.88 37.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.166 -0.47 . . . . 74.33 111.044 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.461 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 71.9 m-85 -131.2 135.2 47.19 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.303 -0.408 . . . . 72.33 111.21 178.436 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.7 p -126.55 -5.02 6.51 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.826 -0.624 . . . . 64.24 109.983 175.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -125.32 130.57 52.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.724 -0.671 . . . . 75.33 110.181 178.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.603 HD21 ' HA ' ' B' ' 128' ' ' SER . 10.1 mp -73.72 -33.23 64.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.443 . . . . 74.55 111.665 -175.298 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -60.43 -46.04 91.47 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.32 0.581 . . . . 74.25 110.474 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.0 t -61.54 -46.89 88.01 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.717 -0.674 . . . . 53.41 110.533 177.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.647 HD21 HG11 ' B' ' 130' ' ' VAL . 48.3 tp -65.95 -36.61 83.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.015 -0.538 . . . . 74.51 111.436 -177.048 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -56.78 -41.5 77.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.079 0.466 . . . . 63.23 110.541 176.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.465 ' HZ2' ' HB2' ' A' ' 68' ' ' LYS . 10.4 mtmp? -69.94 -30.86 68.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.891 -0.595 . . . . 74.11 111.08 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.542 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 46.9 t80 -74.49 -45.75 43.93 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.94 -0.573 . . . . 74.4 110.647 -178.198 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.41 -27.53 67.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.295 -0.412 . . . . 74.23 111.364 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 43.8 t -67.29 -42.18 84.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.302 -0.408 . . . . 63.31 111.371 -178.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.542 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 13.9 pt20 -73.96 -25.04 59.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.123 0.487 . . . . 74.54 110.618 -176.736 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.611 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 71.1 mmtt -70.57 139.31 51.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.928 -0.578 . . . . 74.3 110.374 178.347 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 29.2 m -75.39 -39.87 58.59 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.993 0.425 . . . . 54.3 110.576 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.429 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 15.7 m -78.06 -50.49 11.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.212 -0.449 . . . . 64.24 111.136 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.611 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 83.4 mtp -67.78 -19.86 65.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 75.4 111.792 -174.668 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.433 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 4.6 ttmp? -58.79 -35.3 72.59 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.023 0.439 . . . . 72.51 110.769 177.068 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.402 ' O ' ' HE3' ' A' ' 81' ' ' LYS . 35.6 mt-10 -100.74 2.02 40.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.135 0.493 . . . . 74.12 110.333 -176.024 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.446 ' HB3' ' CG2' ' B' ' 133' ' ' ILE . 68.0 mt -89.0 -48.61 7.31 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.859 -0.609 . . . . 61.41 110.094 177.163 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.788 HD11 HG13 ' B' ' 130' ' ' VAL . 3.5 mm? -90.94 7.54 39.67 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.708 -0.678 . . . . 53.14 111.218 -176.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.402 ' HE3' ' O ' ' A' ' 78' ' ' GLU . 21.3 pttp -56.19 -24.48 42.0 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.532 -0.758 . . . . 63.24 112.112 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -81.06 -9.11 59.87 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 111.997 0.369 . . . . 62.14 111.997 -175.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.661 HG11 ' HB3' ' B' ' 129' ' ' ASN . 12.6 m -127.0 -33.42 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 C-N-CA 120.983 -0.287 . . . . 72.34 111.422 178.139 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.678 HD13 ' HB3' ' A' ' 80' ' ' LEU . 10.3 mp -83.26 130.07 58.24 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.629 -0.26 . . . . 74.14 110.402 178.735 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -56.97 110.48 0.6 Allowed 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.84 2.36 . . . . 73.23 111.877 178.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -90.51 -161.16 0.77 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.515 -0.766 . . . . 64.04 110.773 -178.234 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -67.68 -23.19 65.28 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.99 -0.55 . . . . 74.53 110.952 -177.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 . . . . . 0 N--CA 1.442 -0.847 0 CA-C-N 116.1 -0.5 . . . . 74.31 110.575 -174.723 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 N-CA-C 112.273 -0.331 . . . . 63.45 112.273 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 49.0 t -77.34 115.89 19.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 120.797 0.332 . . . . 73.44 110.414 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 74.0 mt -99.8 112.04 24.32 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.934 0.397 . . . . 73.35 110.212 178.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.56 6.77 9.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.621 -0.718 . . . . 72.41 110.775 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -95.45 133.98 38.81 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.645 -0.707 . . . . 75.33 109.971 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -105.23 109.36 21.32 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.14 -0.318 . . . . 65.14 110.14 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -100.65 -93.01 2.13 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.441 -0.885 . . . . 72.22 113.351 -174.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -89.04 104.6 17.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.958 0.409 . . . . 72.02 111.354 -173.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 46.6 t -95.54 -56.6 5.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.012 -0.54 . . . . 74.32 110.134 178.248 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 3.7 pp -168.03 159.22 11.03 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.258 -0.883 . . . . 71.52 110.947 -179.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 11.8 t -154.28 -176.94 6.12 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.034 -0.728 . . . . 64.33 109.034 178.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 112' ' ' LEU . . . . . 0.613 HD13 ' HB3' ' B' ' 117' ' ' SER . 4.5 pp -126.44 155.82 41.61 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.914 0.387 . . . . 44.22 110.529 177.182 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 113' ' ' ALA . . . . . 0.689 ' HB3' ' HA ' ' B' ' 117' ' ' SER . . . -76.6 -170.83 1.66 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.659 -0.701 . . . . 72.43 112.396 -173.725 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -117.67 -49.02 2.56 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.202 -0.453 . . . . 75.1 110.94 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -73.83 -58.99 2.93 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.335 -0.617 . . . . 74.22 109.335 177.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.458 ' O ' ' HB3' ' B' ' 113' ' ' ALA . 3.4 mm? -116.29 80.6 1.48 Allowed 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.508 -0.923 . . . . 64.53 108.508 174.735 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.689 ' HA ' ' HB3' ' B' ' 113' ' ' ALA . 5.3 m -66.68 -9.56 37.42 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.475 -0.784 . . . . 72.15 112.801 -168.37 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 6.3 p -152.28 139.58 19.42 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.56 -0.291 . . . . 74.23 110.984 -178.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -107.28 134.1 50.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.29 -0.413 . . . . 53.02 110.784 178.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 64.4 m -115.7 -45.77 2.88 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.799 0.809 . . . . 74.03 110.33 178.09 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 45.6 tp -138.52 156.11 47.8 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 114.512 -1.222 . . . . 54.44 109.181 176.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -74.46 159.29 32.47 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.165 0.507 . . . . 64.35 110.955 -177.698 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 12.3 tt -96.64 -35.65 5.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.801 -0.636 . . . . 72.22 110.238 175.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 23.3 t -170.96 122.71 0.58 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.267 -0.424 . . . . 74.23 110.657 -179.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 125' ' ' LYS . . . . . 0.622 ' HD3' ' H ' ' B' ' 125' ' ' LYS . 0.0 OUTLIER -114.46 80.39 1.39 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.677 0.751 . . . . 72.31 109.544 172.113 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 126' ' ' GLN . . . . . 0.404 ' HG3' ' HB3' ' A' ' 12' ' ' LEU . 13.4 mm100 -84.03 -1.99 55.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.459 -0.791 . . . . 75.54 110.703 179.511 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -98.86 -167.37 1.48 Allowed 'General case' 0 N--CA 1.441 -0.912 0 N-CA-C 109.54 -0.541 . . . . 74.41 109.54 176.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 128' ' ' SER . . . . . 0.603 ' HA ' HD21 ' A' ' 63' ' ' LEU . 23.1 t 65.06 5.86 3.18 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.378 -0.828 . . . . 63.45 111.594 -178.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 129' ' ' ASN . . . . . 0.661 ' HB3' HG11 ' A' ' 83' ' ' VAL . 59.9 t30 -83.38 76.94 9.88 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 121.551 0.691 . . . . 71.34 110.291 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.788 HG13 HD11 ' A' ' 80' ' ' LEU . 54.6 t -129.06 -38.04 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.018 -0.992 . . . . 74.11 109.296 176.474 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 131' ' ' PHE . . . . . 0.459 ' HE1' HH11 ' B' ' 135' ' ' ARG . 53.0 t80 -54.83 -45.77 74.5 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.119 -0.946 . . . . 65.03 110.126 178.118 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.613 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 15.2 t-20 -57.92 -48.92 78.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.934 -0.576 . . . . 75.31 111.439 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 133' ' ' ILE . . . . . 0.446 ' CG2' ' HB3' ' A' ' 79' ' ' LEU . 2.4 mp -61.49 -47.52 93.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 CA-C-O 121.056 0.455 . . . . 72.33 110.691 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 87.1 mt -62.65 -31.32 72.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.945 -0.57 . . . . 64.22 110.543 178.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.459 HH11 ' HE1' ' B' ' 131' ' ' PHE . 24.9 ttt180 -73.02 -42.07 63.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.159 -0.473 . . . . 70.1 110.762 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 136' ' ' GLU . . . . . 0.613 ' HG3' ' O ' ' B' ' 132' ' ' ASN . 41.2 mt-10 -60.07 -47.08 87.34 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.204 0.526 . . . . 75.32 110.8 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -86.83 -0.71 56.93 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.693 -0.685 . . . . 74.41 111.083 -177.031 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 25.6 t0 57.92 67.91 0.9 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.382 -0.826 . . . . 71.53 111.894 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -96.53 -3.91 42.3 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.193 -0.912 . . . . 72.14 109.032 169.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 140' ' ' GLU . . . . . 0.407 ' HG2' ' HE3' ' B' ' 142' ' ' LYS . 37.6 tt0 55.69 78.07 0.4 Allowed Pre-proline 0 C--O 1.232 0.161 0 CA-C-N 114.566 -1.197 . . . . 72.55 111.275 -176.186 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.432 ' C ' ' HD2' ' B' ' 142' ' ' LYS . 92.8 Cg_endo -82.99 163.41 15.65 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 123.076 2.517 . . . . 73.55 111.432 176.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 142' ' ' LYS . . . . . 0.432 ' HD2' ' C ' ' B' ' 141' ' ' PRO . 0.8 OUTLIER -122.59 148.98 44.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.096 0.474 . . . . 71.44 111.321 -175.437 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -167.79 82.07 0.19 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.408 -0.815 . . . . 73.52 109.561 -178.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -90.37 40.8 1.02 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.849 -0.614 . . . . 72.11 110.42 -177.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 145' ' ' CYS . . . . . 0.576 ' HB2' HG11 ' A' ' 47' ' ' VAL . 46.5 t -100.38 91.42 4.7 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.112 0.482 . . . . 71.32 111.277 -175.153 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -125.57 80.88 1.93 Allowed 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.756 -0.831 . . . . 74.41 108.756 170.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 147' ' ' VAL . . . . . 0.482 HG13 ' HA ' ' A' ' 43' ' ' PHE . 61.2 t -88.62 111.04 21.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.254 -0.884 . . . . 74.12 111.321 -171.439 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.16 135.29 46.27 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.544 -0.91 . . . . 64.32 108.544 172.721 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 5.4 mp -73.92 86.83 1.78 Allowed 'General case' 0 C--N 1.317 -0.816 0 O-C-N 123.244 0.34 . . . . 75.11 110.104 177.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.578 ' HA ' ' O ' ' B' ' 158' ' ' LYS . . . -91.58 97.61 11.15 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.414 -0.812 . . . . 75.52 109.561 174.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 151' ' ' PHE . . . . . 0.709 ' HB3' ' HA ' ' A' ' 41' ' ' PRO . 47.4 p90 -132.55 166.55 21.83 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.087 -0.506 . . . . 62.51 110.817 -176.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -94.23 114.03 26.06 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.133 -0.485 . . . . 73.45 110.053 178.422 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 153' ' ' CYS . . . . . 0.461 ' HB2' ' HE1' ' B' ' 151' ' ' PHE . 49.0 t -126.32 120.8 30.83 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.095 -0.502 . . . . 73.12 110.166 178.384 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 19.6 t70 70.48 6.0 5.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.875 -0.602 . . . . 55.44 111.789 170.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 111.19 -6.4 28.75 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.502 -0.856 . . . . 63.14 112.316 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 156' ' ' GLU . . . . . 0.523 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 12.6 pt-20 -120.91 145.74 47.36 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 110.023 -0.362 . . . . 74.31 110.023 177.542 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 42.5 mm -77.92 126.94 38.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 109.723 -0.473 . . . . 71.2 109.723 176.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 158' ' ' LYS . . . . . 0.578 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 29.1 mmmt -109.78 137.52 47.46 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.872 -0.418 . . . . 74.25 109.872 179.431 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.01 104.6 8.99 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 123.194 0.309 . . . . 73.34 110.791 178.443 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 160' ' ' PHE . . . . . 0.606 ' CD2' HD13 ' B' ' 166' ' ' LEU . 94.9 m-85 -117.11 122.62 44.62 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.782 -0.367 . . . . 72.44 111.017 178.666 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 10.5 p -92.81 -5.78 50.34 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.161 -0.472 . . . . 52.41 110.557 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -132.81 157.1 45.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.872 -0.604 . . . . 72.22 109.884 177.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -89.18 -16.84 30.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.274 -0.421 . . . . 63.43 111.055 -177.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 164' ' ' GLN . . . . . 0.413 ' O ' ' HG3' ' B' ' 168' ' ' LYS . 6.2 tp60 -67.94 -51.45 47.57 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.418 -0.355 . . . . 74.41 111.12 -176.573 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 165' ' ' SER . . . . . 0.951 ' HA ' ' HE3' ' B' ' 168' ' ' LYS . 11.5 t -69.6 -34.15 73.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.852 0.358 . . . . 71.0 110.38 -178.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 166' ' ' LEU . . . . . 0.606 HD13 ' CD2' ' B' ' 160' ' ' PHE . 33.5 tp -68.02 -35.13 77.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.975 0.416 . . . . 75.12 110.515 177.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -62.41 -37.07 84.37 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.11 -0.495 . . . . 71.43 110.464 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 168' ' ' LYS . . . . . 0.951 ' HE3' ' HA ' ' B' ' 165' ' ' SER . 9.2 mtmp? -67.19 -42.87 83.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.866 -0.606 . . . . 73.51 110.295 175.406 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 169' ' ' PHE . . . . . 0.441 ' HA ' ' HG2' ' B' ' 172' ' ' GLN . 63.9 t80 -64.89 -44.28 90.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.5 -0.773 . . . . 75.34 110.755 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -59.1 -31.36 68.85 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.156 -0.475 . . . . 62.43 110.93 177.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 26.3 t -72.34 -41.84 66.04 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.822 -0.626 . . . . 75.51 111.003 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 172' ' ' GLN . . . . . 0.441 ' HG2' ' HA ' ' B' ' 169' ' ' PHE . 19.2 pt20 -77.34 -22.64 51.54 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.952 0.406 . . . . 70.34 110.781 -176.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 173' ' ' LYS . . . . . 0.875 ' HE2' ' HA ' ' B' ' 173' ' ' LYS . 9.1 mmpt? -75.75 142.68 42.32 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.813 -0.44 . . . . 72.52 109.813 173.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 19.9 m -80.25 -42.46 23.14 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.749 -0.463 . . . . 62.4 109.749 177.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 175' ' ' SER . . . . . 0.53 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 47.4 m -69.49 -50.44 45.25 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.413 -0.358 . . . . 73.42 110.863 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.713 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 68.0 mtp -63.11 -27.66 69.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.201 -0.454 . . . . 74.35 112.064 -174.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? -62.36 -28.66 69.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.008 0.432 . . . . 74.0 110.691 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -100.63 1.04 40.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.281 0.562 . . . . 75.21 110.616 -176.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 179' ' ' LEU . . . . . 0.69 HD12 ' HA ' ' B' ' 176' ' ' MET . 77.2 mt -95.32 -55.67 2.97 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.419 -0.81 . . . . 63.13 109.832 178.291 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 180' ' ' LEU . . . . . 0.664 HD11 HG13 ' A' ' 30' ' ' VAL . 3.2 mm? -78.98 -6.65 56.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.378 -0.828 . . . . 65.5 111.881 -176.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -55.36 -19.22 8.29 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.436 0.532 . . . . 64.22 112.436 -176.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -60.23 -36.82 78.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.967 0.413 . . . . 63.13 111.125 179.059 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 183' ' ' VAL . . . . . 0.629 HG21 ' HB3' ' A' ' 29' ' ' ASN . 13.2 m -123.06 -17.32 4.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.314 -0.403 . . . . 64.41 111.743 -179.231 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 184' ' ' LEU . . . . . . . . . . . . . 10.2 mp -99.55 109.1 54.02 Favored Pre-proline 0 C--N 1.327 -0.397 0 N-CA-C 109.723 -0.473 . . . . 60.4 109.723 177.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -63.02 104.83 0.41 Allowed 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 123.079 2.519 . . . . 75.41 112.581 -177.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 74.9 mm-40 -83.81 -143.32 0.07 Allowed 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.568 -0.901 . . . . 73.03 108.568 174.25 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 23.3 pttm -57.21 -32.52 66.59 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.029 -0.73 . . . . 74.44 109.029 170.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.345 -0.836 . . . . 52.51 109.269 172.296 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.689 0 N-CA-C 111.719 -0.552 . . . . 62.23 111.719 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.4 p -150.05 127.01 2.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.674 -0.491 . . . . 73.34 109.674 177.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -87.69 96.56 10.48 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.283 -0.417 . . . . 55.41 110.948 -174.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.2 mmt -88.99 101.24 13.89 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.143 -0.688 . . . . 74.13 109.143 174.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -98.94 140.4 33.16 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.941 -0.572 . . . . 74.21 111.043 -172.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -142.83 162.0 36.61 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.79 -0.641 . . . . 65.51 109.563 -176.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -85.49 -138.99 4.76 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.762 -0.733 . . . . 42.13 111.937 179.119 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.1 148.5 13.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.705 0.288 . . . . 75.55 110.332 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.3 t -89.87 119.11 36.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.073 -0.512 . . . . 64.55 109.981 177.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 11.2 mp -54.81 114.83 1.87 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.035 0.445 . . . . 65.11 110.923 178.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.557 ' HB ' ' HD3' ' B' ' 187' ' ' LYS . 63.5 m -140.92 134.07 29.45 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.667 -0.697 . . . . 74.33 110.187 -177.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.531 ' O ' HG22 ' A' ' 11' ' ' THR . 3.4 pp -74.79 151.87 39.05 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.619 -0.882 . . . . 51.42 108.619 170.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -51.32 126.88 18.14 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.318 0.488 . . . . 43.42 112.318 -173.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.34 -11.47 57.71 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.888 -0.597 . . . . 64.21 111.552 -177.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -88.32 12.49 13.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.375 0.607 . . . . 72.14 109.663 176.032 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.7 mt 62.63 35.62 14.14 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.348 -0.842 . . . . 74.04 110.649 179.117 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 26.5 m -95.71 33.7 1.61 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.772 -0.649 . . . . 74.11 111.593 -177.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.0 t -68.01 97.74 0.7 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.155 0.502 . . . . 71.42 110.086 176.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -86.67 -177.44 6.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.777 -0.647 . . . . 53.3 110.847 -177.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 18.4 m -126.52 120.2 29.06 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.434 -0.348 . . . . 53.43 110.682 -179.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 43.4 mt -75.39 102.18 5.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.33 0.586 . . . . 63.34 109.503 174.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -90.64 -89.39 0.16 Allowed 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.264 -0.88 . . . . 73.4 111.839 -168.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 12.8 tt -146.46 134.4 15.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.839 0.352 . . . . 62.43 111.171 -179.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.552 ' HB3' ' H ' ' B' ' 124' ' ' SER . 8.0 t -177.81 -174.78 0.47 Allowed 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.777 -0.647 . . . . 62.4 109.363 178.534 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.467 ' HB2' ' CZ2' ' B' ' 127' ' ' TRP . 0.6 OUTLIER -132.48 43.73 2.96 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.4 0.619 . . . . 75.4 110.452 -177.121 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 80.2 mm-40 -91.27 91.57 8.24 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.751 -0.659 . . . . 62.44 111.853 -173.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.408 ' HE3' ' C ' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -101.12 30.96 3.84 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.627 -0.715 . . . . 74.14 111.315 177.505 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.1 p -86.32 5.45 34.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.621 0.724 . . . . 75.42 110.31 -173.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.468 ' HB3' HG11 ' B' ' 183' ' ' VAL . 42.7 m-80 -110.13 0.13 18.16 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.007 -0.997 . . . . 75.04 110.929 -178.499 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.411 ' C ' ' H ' ' A' ' 32' ' ' ASN . 46.6 t -93.83 129.49 44.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.101 -0.499 . . . . 60.44 110.563 -176.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 12.8 p90 57.28 -7.83 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 125.497 1.519 . . . . 74.2 114.461 174.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.513 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 11.8 t30 -58.12 -45.09 87.89 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 122.317 0.247 . . . . 70.12 111.578 -175.359 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.472 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 44.4 mm -60.16 -41.16 85.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.033 0.444 . . . . 65.23 111.399 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.568 HD12 HD23 ' B' ' 149' ' ' LEU . 88.3 mt -68.37 -27.57 66.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.189 -0.46 . . . . 75.32 110.691 -178.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -74.07 -34.67 64.11 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.123 -0.49 . . . . 71.14 109.95 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.513 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 5.8 mm-40 -71.52 -27.65 63.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.127 0.489 . . . . 73.05 110.736 178.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -101.55 4.37 40.97 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.15 -0.477 . . . . 73.43 111.04 -178.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 60.18 43.99 13.35 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.603 -0.726 . . . . 75.13 112.361 174.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.546 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 11.8 m-85 -77.74 -12.81 60.01 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.122 0.487 . . . . 74.21 109.995 171.182 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 58.9 73.85 0.66 Allowed Pre-proline 0 C--O 1.236 0.345 0 CA-C-N 114.99 -1.005 . . . . 71.41 110.859 -174.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -81.44 148.62 16.43 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.513 2.142 . . . . 53.44 111.304 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -104.83 138.46 41.06 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.133 0.492 . . . . 72.34 110.856 -177.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -146.05 31.24 1.03 Allowed 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.502 -0.925 . . . . 71.45 108.502 -175.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 29.5 tp -61.63 96.93 0.07 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.727 -1.124 . . . . 74.33 110.864 -177.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 41.5 t -102.04 82.87 2.28 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.736 -0.665 . . . . 71.31 110.095 -178.206 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.421 ' HG2' ' HE3' ' A' ' 48' ' ' LYS . 22.6 tt0 -92.26 26.53 2.51 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.898 0.856 . . . . 75.23 109.293 176.686 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.546 HG13 ' HA ' ' B' ' 143' ' ' PHE . 61.6 t -74.41 115.78 16.05 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 CA-C-N 114.94 -1.027 . . . . 74.42 110.357 178.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.421 ' HE3' ' HG2' ' A' ' 46' ' ' GLU . 0.0 OUTLIER -139.14 128.67 24.44 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.762 -0.458 . . . . 71.33 109.762 175.425 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.714 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.5 mp -67.92 88.42 0.26 Allowed 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.507 -0.769 . . . . 74.35 110.384 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.698 ' H ' ' HB2' ' B' ' 142' ' ' LYS . . . -85.17 58.05 4.81 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.851 -0.426 . . . . 44.21 109.851 176.113 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.714 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 51.5 p90 -86.02 162.55 18.43 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.982 -0.554 . . . . 61.44 110.731 -177.214 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.402 ' HD3' HD13 ' A' ' 57' ' ' ILE . 14.1 tptm -98.12 118.91 35.79 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.324 -0.853 . . . . 64.3 110.109 -176.587 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 46.5 t -120.18 99.89 6.86 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.917 0.389 . . . . 74.33 110.691 178.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 66.84 6.37 4.56 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.413 -0.812 . . . . 73.43 112.968 171.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 133.26 -27.58 3.4 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.403 -0.903 . . . . 71.24 112.636 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -107.86 139.33 42.62 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.253 0.549 . . . . 61.43 110.868 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.402 HD13 ' HD3' ' A' ' 52' ' ' LYS . 45.9 mm -77.37 123.41 33.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.473 -0.785 . . . . 73.12 109.939 178.199 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.42 ' HE2' ' CE1' ' A' ' 69' ' ' PHE . 30.9 mmmt -107.81 90.65 3.36 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 121.084 -0.246 . . . . 74.54 110.722 -177.736 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.58 110.09 7.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.33 -0.395 . . . . 61.21 111.572 -178.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -120.92 123.41 42.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.345 -0.388 . . . . 75.1 110.447 174.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 7.0 t -100.71 -4.31 28.48 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.396 0.617 . . . . 71.2 109.357 179.173 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -142.84 159.4 42.3 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.533 -0.758 . . . . 73.11 110.007 177.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 46.6 tp -87.14 -20.58 26.83 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.272 -0.422 . . . . 72.34 110.452 -175.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -61.6 -51.33 68.97 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.901 -0.591 . . . . 74.32 110.484 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.7 t -66.27 -36.82 83.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.818 -0.628 . . . . 63.21 110.429 178.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.469 ' O ' HD23 ' A' ' 66' ' ' LEU . 6.2 tt -66.1 -37.77 86.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.724 -0.671 . . . . 73.34 110.428 -178.213 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.851 ' HG3' HD21 ' A' ' 84' ' ' LEU . 55.3 ttp180 -57.65 -38.71 75.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 73.03 110.967 -179.614 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -63.39 -38.36 90.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 75.44 110.979 177.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.42 ' CE1' ' HE2' ' A' ' 58' ' ' LYS . 54.0 t80 -68.41 -47.86 66.17 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.082 -0.508 . . . . 73.24 110.554 -178.734 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.442 ' HA ' ' HB2' ' A' ' 73' ' ' LYS . . . -62.56 -28.74 70.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.828 0.347 . . . . 54.1 111.349 177.483 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 34.6 t -67.43 -31.15 71.14 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.143 -0.48 . . . . 62.33 111.084 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -100.76 6.71 43.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.353 0.597 . . . . 73.0 109.98 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.442 ' HB2' ' HA ' ' A' ' 70' ' ' ALA . 21.3 mmmt -112.54 102.9 10.96 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.369 -0.832 . . . . 63.43 110.584 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.484 ' O ' ' HB3' ' A' ' 77' ' ' LYS . 14.8 p -54.51 -38.74 66.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.331 -0.395 . . . . 62.41 111.591 -178.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.536 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 47.3 t -66.37 -49.61 66.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.796 0.331 . . . . 74.0 110.919 178.595 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 80.9 mtp -71.76 -22.22 61.63 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.931 0.396 . . . . 73.43 110.728 -175.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.484 ' HB3' ' O ' ' A' ' 74' ' ' SER . 29.3 tttp -53.82 -34.64 59.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.661 -0.699 . . . . 75.02 110.707 172.376 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.521 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 32.8 mm-40 -101.7 3.82 40.05 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.75 -0.659 . . . . 74.32 110.419 -175.385 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.582 HD22 ' ND2' ' B' ' 137' ' ' ASN . 53.2 mt -101.06 -47.26 4.81 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.17 -0.923 . . . . 71.54 109.168 175.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.0 mt -91.86 2.25 56.64 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.716 -0.675 . . . . 45.43 111.024 -175.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.521 ' HD2' ' HA ' ' A' ' 78' ' ' GLU . 20.8 ptmt -54.41 -20.72 8.0 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.146 -0.479 . . . . 61.22 112.278 178.125 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -82.27 -37.62 25.6 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.05 0.453 . . . . 65.31 110.945 178.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 24.3 t -79.75 -40.2 20.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.066 -0.515 . . . . 71.54 110.308 -178.46 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.851 HD21 ' HG3' ' A' ' 67' ' ' ARG . 10.6 mp -89.89 138.75 27.62 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 115.843 -0.617 . . . . 62.4 110.5 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -67.42 110.48 2.05 Favored 'Trans proline' 0 C--O 1.232 0.216 0 C-N-CA 122.706 2.271 . . . . 75.33 111.379 178.349 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 17.0 mm100 -121.74 -176.36 3.3 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.206 0.527 . . . . 75.22 110.499 -176.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.778 ' HG3' ' HB ' ' B' ' 111' ' ' THR . 0.6 OUTLIER -143.47 39.62 1.42 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 122.133 0.968 . . . . 70.54 108.598 177.702 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 . . . . . 0 C--N 1.312 -1.038 0 CA-C-N 113.891 -1.504 . . . . 73.11 110.35 -176.983 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.423 0 N-CA-C 112.394 -0.282 . . . . 41.53 112.394 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 8.2 p -117.6 134.64 60.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 120.967 0.413 . . . . 75.21 110.715 -178.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 103' ' ' LEU . . . . . 0.448 ' O ' HD12 ' B' ' 103' ' ' LEU . 1.0 OUTLIER -127.56 144.72 51.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.006 0.431 . . . . 41.24 110.747 177.702 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 26.4 mmt -109.77 -30.03 8.04 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.964 -0.562 . . . . 74.03 109.968 -179.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 61.34 25.62 15.56 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.4 -0.818 . . . . 64.23 111.073 178.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -65.57 144.23 57.12 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.894 -1.048 . . . . 73.11 110.66 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -80.25 102.3 2.05 Favored Glycine 0 N--CA 1.44 -1.06 0 C-N-CA 121.228 -0.51 . . . . 51.41 112.531 -178.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -64.59 150.35 47.09 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.447 -0.376 . . . . 72.3 110.031 172.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 34.6 t -73.18 115.88 14.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.401 -0.363 . . . . 75.11 110.819 -175.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 110' ' ' LEU . . . . . 0.483 ' H ' HD12 ' B' ' 110' ' ' LEU . 6.5 mp -57.94 131.41 50.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.794 -0.639 . . . . 53.24 110.729 -179.352 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 111' ' ' THR . . . . . 0.778 ' HB ' ' HG3' ' A' ' 87' ' ' LYS . 34.4 m -153.13 134.66 14.4 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.241 -0.436 . . . . 71.02 110.446 -178.509 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 112' ' ' LEU . . . . . 0.427 ' O ' HG22 ' B' ' 111' ' ' THR . 3.4 pp -100.89 170.66 8.15 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.496 -0.927 . . . . 70.1 108.496 167.665 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 113' ' ' ALA . . . . . 0.51 ' CB ' ' H ' ' B' ' 117' ' ' SER . . . -52.87 128.84 28.29 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.753 0.311 . . . . 64.23 111.65 -177.637 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -94.44 -32.05 13.7 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.169 0.509 . . . . 74.4 110.486 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -91.18 -36.4 13.97 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.808 -0.633 . . . . 70.43 111.161 -177.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 82.0 mt -98.16 -49.5 4.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.022 0.439 . . . . 75.24 109.997 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.51 ' H ' ' CB ' ' B' ' 113' ' ' ALA . 9.6 m 52.41 75.41 0.23 Allowed 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 114.876 -1.056 . . . . 70.2 111.712 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 9.5 t -92.55 148.69 21.88 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.969 -0.56 . . . . 74.11 110.609 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -146.38 122.0 10.46 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.297 -0.411 . . . . 72.31 110.564 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 32.8 m -112.8 102.94 10.94 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.392 -0.367 . . . . 71.23 111.164 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 13.6 mt -158.91 143.0 15.43 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.693 -0.685 . . . . 71.22 110.438 177.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 122' ' ' ASP . . . . . 0.445 ' O ' ' HB2' ' A' ' 24' ' ' SER . 6.1 t70 -161.5 -153.59 0.3 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.514 -0.921 . . . . 74.44 108.514 -178.686 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 14.3 tt -107.48 130.32 59.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.707 -0.479 . . . . 71.51 109.707 173.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.552 ' H ' ' HB3' ' A' ' 24' ' ' SER . 10.7 t -178.45 -171.23 0.24 Allowed 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.538 -0.541 . . . . 74.32 109.538 -177.538 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 125' ' ' LYS . . . . . 0.57 ' HD3' ' N ' ' B' ' 125' ' ' LYS . 0.3 OUTLIER -136.84 84.3 2.06 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.676 -0.693 . . . . 75.41 110.011 -178.4 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 86.8 mm-40 -128.99 117.99 21.84 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.049 0.452 . . . . 73.23 111.833 -175.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 127' ' ' TRP . . . . . 0.467 ' CZ2' ' HB2' ' A' ' 25' ' ' LYS . 82.5 m95 -127.28 78.48 1.82 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.895 -0.78 . . . . 75.2 108.895 175.788 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 13.5 m -100.71 -30.37 11.77 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.269 -0.423 . . . . 63.35 111.439 -171.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 42.7 m-20 -98.92 32.2 2.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.358 -0.383 . . . . 74.24 111.961 -174.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.558 HG12 ' HD2' ' B' ' 131' ' ' PHE . 34.8 t -91.11 115.83 31.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 109.979 -0.378 . . . . 72.01 109.979 178.582 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 131' ' ' PHE . . . . . 0.612 ' HB3' HD21 ' A' ' 49' ' ' LEU . 26.0 p90 52.53 9.36 0.1 Allowed 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.921 1.288 . . . . 74.01 113.92 178.702 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.4 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 44.7 t30 -56.58 -55.12 37.88 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.85 0.357 . . . . 73.51 111.324 -177.553 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 133' ' ' ILE . . . . . 0.527 HG21 ' HB3' ' A' ' 79' ' ' LEU . 49.1 mm -58.11 -41.42 80.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.002 -0.544 . . . . 71.25 111.247 -178.252 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.409 HD12 HD23 ' A' ' 49' ' ' LEU . 84.5 mt -63.65 -36.97 85.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.02 -0.536 . . . . 74.25 110.906 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -72.42 -38.89 68.27 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.653 -0.249 . . . . 60.14 110.488 179.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 136' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 28.7 mm-40 -64.31 -43.14 95.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.241 -0.436 . . . . 42.41 111.282 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 137' ' ' ASN . . . . . 0.582 ' ND2' HD22 ' A' ' 79' ' ' LEU . 92.1 m-20 -92.21 7.61 41.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.161 -0.472 . . . . 73.44 111.227 -178.366 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 55.63 57.91 4.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.408 -0.815 . . . . 72.5 112.96 174.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -82.97 -10.1 58.96 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.595 -0.891 . . . . 70.43 108.595 165.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 59.6 71.8 0.87 Allowed Pre-proline 0 C--O 1.234 0.274 0 CA-C-N 114.204 -1.362 . . . . 75.42 110.828 -176.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.5 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 89.1 Cg_endo -79.95 144.94 17.34 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.508 2.139 . . . . 75.11 111.591 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 142' ' ' LYS . . . . . 0.698 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 13.9 mptt -95.32 152.74 18.12 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.036 0.446 . . . . 70.54 110.448 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 143' ' ' PHE . . . . . 0.546 ' HA ' HG13 ' A' ' 47' ' ' VAL . 31.1 t80 -152.12 36.75 0.54 Allowed 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.205 -1.035 . . . . 73.41 108.205 -177.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 50.5 tp -62.67 100.1 0.18 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.769 -1.105 . . . . 63.13 109.846 -179.184 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 43.8 t -120.68 136.1 54.94 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.78 -0.645 . . . . 72.45 111.032 -172.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 146' ' ' GLU . . . . . 0.475 ' HB2' ' HE3' ' B' ' 148' ' ' LYS . 9.1 pt-20 -134.15 38.7 3.14 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.529 0.681 . . . . 70.33 109.259 172.679 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 92.3 t -75.05 96.5 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.637 -0.71 . . . . 72.02 110.005 178.063 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 148' ' ' LYS . . . . . 0.475 ' HE3' ' HB2' ' B' ' 146' ' ' GLU . 0.0 OUTLIER -141.76 131.47 24.15 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.055 -0.975 . . . . 74.21 109.758 177.179 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.767 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.5 mp -74.14 86.67 1.89 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.597 -0.729 . . . . 74.01 110.359 -178.29 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.501 ' HB2' HG23 ' B' ' 159' ' ' THR . . . -85.19 62.34 7.44 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.014 -0.539 . . . . 75.12 109.649 174.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 151' ' ' PHE . . . . . 0.767 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 49.6 p90 -92.09 164.01 13.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.015 -0.539 . . . . 74.21 110.737 -175.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -92.08 117.38 29.79 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.704 -0.68 . . . . 75.02 110.794 -178.082 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 153' ' ' CYS . . . . . 0.617 ' HB3' ' CG ' ' B' ' 158' ' ' LYS . 50.8 t -131.56 116.96 18.1 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.541 -0.3 . . . . 54.42 110.889 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 67.71 11.53 8.41 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.674 -0.694 . . . . 71.53 112.408 175.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 110.06 -16.24 30.37 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.407 -0.901 . . . . 65.15 112.572 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 156' ' ' GLU . . . . . 0.479 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 9.6 pt-20 -116.42 143.98 44.88 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.841 0.353 . . . . 73.24 110.41 177.922 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 43.5 mm -70.59 118.69 15.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.209 -0.451 . . . . 75.31 110.045 177.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 158' ' ' LYS . . . . . 0.617 ' CG ' ' HB3' ' B' ' 153' ' ' CYS . 31.5 mmmt -104.08 88.31 2.98 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.945 -0.391 . . . . 70.33 109.945 -179.369 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 159' ' ' THR . . . . . 0.501 HG23 ' HB2' ' B' ' 150' ' ' ALA . 0.2 OUTLIER -75.63 110.19 9.83 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.892 -0.595 . . . . 70.43 111.461 -175.965 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -121.8 124.41 44.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.521 -0.308 . . . . 75.13 111.009 178.066 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 161' ' ' SER . . . . . 0.453 ' HB2' ' HB3' ' B' ' 148' ' ' LYS . 9.5 t -106.38 0.61 25.05 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.038 -0.727 . . . . 61.33 109.038 176.072 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -121.28 124.18 44.0 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.499 -0.773 . . . . 50.24 110.339 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 55.2 tp -68.56 -32.77 72.93 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.149 -0.686 . . . . 63.13 109.149 175.386 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -59.62 -50.32 74.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.333 -0.849 . . . . 71.43 110.922 176.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 32.3 t -67.54 -39.6 85.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.203 -0.453 . . . . 72.2 110.432 -178.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 166' ' ' LEU . . . . . 0.425 ' O ' HD23 ' B' ' 166' ' ' LEU . 4.1 tt -65.71 -36.46 83.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.07 -0.514 . . . . 35.54 110.294 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 167' ' ' ARG . . . . . 0.559 ' HG3' HD11 ' B' ' 184' ' ' LEU . 43.3 ttp180 -62.78 -34.88 78.17 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.249 0.547 . . . . 72.01 110.062 179.123 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -66.66 -38.56 87.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.818 -0.628 . . . . 45.3 110.458 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 169' ' ' PHE . . . . . 0.518 ' CZ ' ' HE3' ' B' ' 173' ' ' LYS . 69.8 t80 -67.05 -46.38 74.54 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.424 -0.807 . . . . 72.44 110.661 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.61 -26.67 68.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.504 -0.316 . . . . 53.32 111.428 179.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 8.6 t -64.98 -27.84 69.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.241 -0.436 . . . . 63.4 110.59 -178.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -106.08 15.98 25.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.248 0.547 . . . . 74.44 110.33 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 173' ' ' LYS . . . . . 0.518 ' HE3' ' CZ ' ' B' ' 169' ' ' PHE . 64.1 mmtt -117.3 115.63 25.64 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.612 -0.722 . . . . 74.44 110.427 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.2 p -57.7 -41.44 81.68 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.909 0.385 . . . . 72.33 111.869 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 175' ' ' SER . . . . . 0.526 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 45.7 t -82.04 -47.08 13.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.827 0.346 . . . . 72.11 110.325 -178.3 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.462 ' HB2' ' CB ' ' B' ' 173' ' ' LYS . 70.9 mtp -67.47 -25.85 66.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.454 -0.339 . . . . 64.41 111.866 -174.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 177' ' ' LYS . . . . . 0.49 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 26.0 ttpp -62.11 -35.09 77.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.842 0.353 . . . . 54.24 110.558 176.152 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 178' ' ' GLU . . . . . 0.602 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 18.8 mm-40 -89.71 -12.11 40.39 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-O 121.661 0.743 . . . . 74.22 109.88 -175.134 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 179' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' B' ' 175' ' ' SER . 74.7 mt -82.08 -47.82 12.13 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.767 -1.106 . . . . 63.33 109.173 175.714 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 7.5 mt -94.27 0.92 55.95 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.764 -0.653 . . . . 72.42 111.451 -173.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 181' ' ' LYS . . . . . 0.602 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 17.8 ptmt -58.6 -8.44 1.26 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 112.083 0.401 . . . . 74.3 112.083 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -68.29 -37.01 80.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.021 0.438 . . . . 74.1 110.411 175.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 183' ' ' VAL . . . . . 0.468 HG11 ' HB3' ' A' ' 29' ' ' ASN . 31.2 m -104.47 -15.29 8.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.15 -0.477 . . . . 62.41 111.198 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 184' ' ' LEU . . . . . 0.559 HD11 ' HG3' ' B' ' 167' ' ' ARG . 11.1 mp -84.81 136.85 38.53 Favored Pre-proline 0 C--N 1.325 -0.488 0 N-CA-C 109.676 -0.49 . . . . 54.35 109.676 175.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_exo -61.22 114.74 2.33 Favored 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 122.697 2.265 . . . . 75.22 111.926 -179.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -114.98 170.41 8.37 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 121.21 0.528 . . . . 74.11 110.353 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 187' ' ' LYS . . . . . 0.557 ' HD3' ' HB ' ' A' ' 11' ' ' THR . 11.7 mmmm -136.17 -51.15 0.71 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.292 -0.867 . . . . 74.43 110.468 -178.292 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.772 -0.632 . . . . 73.21 110.388 -178.49 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.787 0 N-CA-C 111.211 -0.756 . . . . 71.5 111.211 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.8 p -130.73 143.59 40.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.318 0.58 . . . . 65.44 111.727 -174.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 47.0 tp -128.34 138.44 52.38 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.145 -1.058 . . . . 74.13 108.145 171.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 22.5 ptm -73.46 85.05 1.51 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.184 0.516 . . . . 75.52 111.472 -175.637 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -173.13 -172.07 0.79 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.604 -0.726 . . . . 64.42 109.133 177.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -99.62 117.02 33.09 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.942 0.401 . . . . 74.22 110.815 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 129.65 127.72 2.96 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.847 -0.615 . . . . 61.42 112.037 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -100.68 132.53 46.03 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 110.229 -0.285 . . . . 73.1 110.229 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 5.2 p -121.15 116.49 49.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.435 0.636 . . . . 72.53 111.081 -178.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 95.0 mt -94.62 151.93 18.91 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.644 -0.707 . . . . 74.14 109.813 175.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.6 t -166.95 179.62 5.16 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.485 -0.325 . . . . 63.32 110.53 -177.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.574 HD13 ' N ' ' A' ' 13' ' ' ALA . 2.4 tm? -71.89 143.16 49.46 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.312 -0.625 . . . . 72.33 109.312 177.591 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.742 ' HA ' ' HA ' ' A' ' 17' ' ' SER . . . 71.11 32.86 2.17 Favored 'General case' 0 CA--C 1.511 -0.536 0 O-C-N 123.841 0.713 . . . . 73.43 111.483 178.467 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 15' ' ' ASP . . . -66.59 90.53 0.16 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.937 -0.574 . . . . 42.12 110.616 176.551 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.402 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 9.4 m-20 80.52 -44.11 0.24 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.512 -1.222 . . . . 73.23 112.286 171.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.9 mp -91.06 -28.9 17.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.703 -0.226 . . . . 71.15 111.191 -175.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.742 ' HA ' ' HA ' ' A' ' 13' ' ' ALA . 23.0 t 66.5 94.33 0.07 Allowed 'General case' 0 C--O 1.233 0.189 0 CA-C-O 122.066 0.936 . . . . 45.14 110.869 -176.123 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.5 m -91.01 77.73 6.05 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.867 -1.06 . . . . 72.35 110.066 178.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -153.55 171.94 17.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.793 -0.639 . . . . 75.34 109.867 -179.541 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.852 ' HB ' ' HB2' ' B' ' 103' ' ' LEU . 16.8 p -92.4 158.43 16.07 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.799 0.333 . . . . 44.44 111.036 178.713 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -161.37 -178.35 6.6 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.045 -0.525 . . . . 74.24 110.8 -176.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.417 ' OD1' HG22 ' A' ' 23' ' ' ILE . 4.9 t70 -142.83 -167.66 2.58 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 107.873 -1.158 . . . . 72.34 107.873 175.351 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.417 HG22 ' OD1' ' A' ' 22' ' ' ASP . 12.2 tt -80.52 120.84 32.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.218 0.532 . . . . 71.41 110.615 -179.095 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.588 ' H ' HD22 ' B' ' 144' ' ' LEU . 27.7 m -81.7 173.24 12.51 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.001 -0.545 . . . . 64.23 109.777 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.477 ' HD3' ' HA ' ' A' ' 25' ' ' LYS . 31.6 mmtm -128.2 99.63 5.53 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.751 0.786 . . . . 72.35 112.116 178.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.419 ' H ' ' CD ' ' A' ' 26' ' ' GLN . 0.0 OUTLIER -81.06 123.18 28.17 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 114.191 -1.368 . . . . 73.22 107.826 172.582 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 76.8 m95 -84.93 -170.06 2.95 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 121.592 0.71 . . . . 73.43 111.297 -173.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 47.5 m -72.51 -55.58 6.74 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.832 -1.076 . . . . 55.13 110.835 -175.182 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.555 HD22 HG21 ' B' ' 183' ' ' VAL . 47.1 t30 -109.92 80.35 1.3 Allowed 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 121.124 0.488 . . . . 75.03 110.983 -178.761 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.439 HG23 ' CD2' ' A' ' 31' ' ' PHE . 9.9 m -98.35 -26.87 3.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.855 -0.611 . . . . 32.41 109.566 171.069 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.583 ' HB2' ' HB3' ' A' ' 41' ' ' PRO . 11.6 p90 -158.11 18.19 0.24 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.246 -0.888 . . . . 52.33 109.536 173.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.526 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 9.4 t30 -64.87 -54.61 28.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.22 -0.9 . . . . 74.32 111.548 -170.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.486 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 47.7 mm -57.32 -41.67 78.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 CA-C-O 121.03 0.443 . . . . 72.13 111.377 -176.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.849 HD12 HD21 ' B' ' 149' ' ' LEU . 80.0 mt -66.59 -37.38 84.79 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.0 -0.545 . . . . 75.32 110.646 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 35' ' ' ARG . 20.5 ttt85 -64.47 -40.56 95.93 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.202 -0.454 . . . . 74.12 110.687 178.233 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 4.6 mm-40 -72.0 -27.59 62.84 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.991 -0.549 . . . . 74.42 111.671 -177.019 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -100.9 4.29 42.54 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.877 0.37 . . . . 70.11 111.034 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 22.2 t70 61.66 69.68 0.63 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.406 -0.815 . . . . 61.34 111.487 177.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.566 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 7.6 m-85 -107.22 -7.39 16.8 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.231 -0.895 . . . . 65.05 109.882 172.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 68.51 93.73 0.05 OUTLIER Pre-proline 0 C--O 1.232 0.173 0 CA-C-N 114.81 -1.086 . . . . 64.05 111.128 -177.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.583 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 67.5 Cg_endo -75.29 166.27 29.19 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.774 2.316 . . . . 75.42 111.444 175.412 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.743 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 13.9 tptt -114.61 176.57 4.99 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 119.596 -0.842 . . . . 75.4 112.63 -177.614 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 53.9 t80 165.47 107.28 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 114.478 -1.237 . . . . 75.43 107.871 -167.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.679 ' H ' HG11 ' B' ' 147' ' ' VAL . 74.4 mt -127.53 -13.23 5.45 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.761 0.282 . . . . 71.44 111.761 -172.223 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 22.3 m -95.41 109.94 22.05 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.121 -0.326 . . . . 42.44 110.121 -178.002 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 32.1 mp0 -72.99 95.46 2.0 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.055 0.455 . . . . 73.54 110.371 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.417 HG21 ' H ' ' B' ' 144' ' ' LEU . 11.1 t -65.32 157.41 5.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.482 -0.781 . . . . 75.15 109.063 175.772 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.428 ' O ' ' HB3' ' B' ' 142' ' ' LYS . 0.0 OUTLIER -84.12 133.14 34.64 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.02 -0.733 . . . . 75.52 109.02 -174.562 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.832 HD21 HD12 ' B' ' 134' ' ' LEU . 41.2 tp -75.25 87.96 2.51 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.282 0.563 . . . . 52.41 110.384 -175.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 1.003 ' HB2' HG23 ' A' ' 59' ' ' THR . . . -97.14 96.36 8.39 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.03 -0.986 . . . . 65.22 110.216 177.324 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.421 ' HB2' ' HB3' ' B' ' 139' ' ' PHE . 53.7 p90 -111.81 167.61 10.23 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.071 -0.513 . . . . 70.03 110.289 -179.644 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -97.03 122.91 40.54 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.304 -0.407 . . . . 61.22 111.031 -178.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 46.0 t -132.95 107.5 8.32 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.164 -0.471 . . . . 72.22 110.0 176.108 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 68.07 23.61 8.03 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.284 0.476 . . . . 74.45 112.284 174.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 104.25 -19.03 44.08 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.277 -0.963 . . . . 62.44 112.428 177.167 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.468 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 9.7 pt-20 -108.4 138.96 43.83 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.183 0.515 . . . . 74.25 110.723 179.13 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.0 mm -77.31 124.22 35.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.738 -0.665 . . . . 74.13 109.6 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.468 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 26.2 mmmt -103.78 90.57 3.68 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.816 -0.438 . . . . 63.23 109.816 -179.731 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' THR . . . . . 1.003 HG23 ' HB2' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -81.39 105.64 12.73 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.927 -0.579 . . . . 71.1 111.309 -177.784 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -110.48 133.11 53.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.304 -0.407 . . . . 72.1 110.805 178.098 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.3 p -79.63 -18.69 50.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.946 -0.57 . . . . 64.21 111.443 -178.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -152.95 172.71 16.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.167 -0.47 . . . . 53.34 110.588 -178.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -84.88 -12.59 53.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.111 -0.495 . . . . 75.53 111.612 -176.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -74.97 -42.66 57.16 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.975 -0.75 . . . . 71.44 108.975 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.584 ' HA ' ' HE2' ' A' ' 68' ' ' LYS . 15.0 m -65.99 -37.07 85.02 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.407 -0.815 . . . . 75.14 110.137 177.159 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.525 HD11 HD11 ' B' ' 134' ' ' LEU . 6.0 tt -68.19 -38.3 81.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.82 -0.627 . . . . 74.21 109.784 178.206 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.667 ' HG3' HD22 ' A' ' 84' ' ' LEU . 54.8 ttp180 -51.41 -38.76 55.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.076 -0.965 . . . . 75.24 111.02 -179.275 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.584 ' HE2' ' HA ' ' A' ' 65' ' ' SER . 49.8 mtmt -64.94 -51.36 62.27 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.72 -0.673 . . . . 72.1 110.785 178.346 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -64.52 -42.11 95.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.353 -0.839 . . . . 62.25 111.36 -175.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.19 -33.1 75.2 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.207 -0.451 . . . . 73.21 111.234 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.1 m -74.38 -22.73 59.05 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.673 0.273 . . . . 74.13 111.374 -178.355 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -98.83 5.98 47.12 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.283 0.563 . . . . 53.31 110.459 177.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.7 mmmt -108.0 109.41 20.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.421 -0.809 . . . . 71.32 109.334 172.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.0 p -51.18 -35.98 38.89 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.469 0.544 . . . . 75.35 112.469 -174.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 41.2 t -78.13 -56.35 4.54 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.674 0.274 . . . . 65.03 110.807 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 78.0 mtp -64.24 -21.38 66.56 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.871 0.367 . . . . 64.41 111.513 -174.377 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.406 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 88.5 tttt -59.6 -25.64 64.79 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.845 -0.616 . . . . 74.31 111.106 179.253 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.518 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 32.4 mt-10 -104.93 5.49 32.85 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.233 0.54 . . . . 74.02 110.629 -178.79 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.538 ' HB3' HG21 ' B' ' 133' ' ' ILE . 10.6 mp -91.55 -52.09 4.94 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.42 -0.809 . . . . 63.2 109.447 173.769 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -81.2 -10.48 59.61 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.511 -0.768 . . . . 61.34 111.256 -176.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.518 ' HD3' ' HA ' ' A' ' 78' ' ' GLU . 64.8 pttt -59.83 -18.46 44.09 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 111.975 0.361 . . . . 63.31 111.975 -176.088 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -66.2 -36.51 83.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.968 0.413 . . . . 70.33 110.636 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 29.2 m -110.12 4.34 8.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.239 0.543 . . . . 74.33 110.45 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.667 HD22 ' HG3' ' A' ' 67' ' ' ARG . 45.0 tp -138.36 104.37 7.84 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.599 -0.728 . . . . 74.1 110.661 -175.155 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.44 111.22 3.16 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.79 2.327 . . . . 60.45 111.443 178.013 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 80.1 mm-40 -66.93 103.46 1.15 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.103 -0.499 . . . . 70.24 111.567 -176.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? 65.49 19.38 11.54 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.2 -0.909 . . . . 71.11 112.498 175.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 . . . . . 0 C--N 1.317 -0.816 0 CA-C-N 116.647 -0.251 . . . . 75.51 110.559 178.721 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 N-CA-C 112.135 -0.386 . . . . 64.41 112.135 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 9.8 p -160.98 154.22 3.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 110.077 -0.342 . . . . 73.33 110.077 179.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 103' ' ' LEU . . . . . 0.852 ' HB2' ' HB ' ' A' ' 20' ' ' THR . 29.0 tp -73.54 170.57 14.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.039 0.447 . . . . 54.33 110.961 -179.042 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 104' ' ' MET . . . . . 0.483 ' N ' ' HG ' ' B' ' 103' ' ' LEU . 20.2 ptm -79.36 8.23 6.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.859 -0.61 . . . . 75.25 111.056 178.459 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -77.43 139.94 39.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.968 -0.56 . . . . 64.43 109.681 178.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -69.1 122.7 19.29 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.97 0.414 . . . . 62.53 110.574 -176.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 113.28 82.66 1.16 Allowed Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 111.087 -0.805 . . . . 60.22 111.087 -174.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -99.95 90.35 4.38 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.926 0.393 . . . . 73.32 111.587 -174.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 94.0 t -103.56 128.15 56.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 116.135 -0.484 . . . . 72.12 109.753 174.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 91.2 mt -84.06 138.89 32.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.308 0.575 . . . . 72.1 111.285 -177.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 11.0 t -100.75 174.61 5.97 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.236 -0.893 . . . . 72.44 109.654 178.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 112' ' ' LEU . . . . . 0.499 HD13 ' N ' ' B' ' 113' ' ' ALA . 3.4 tm? -66.16 138.74 57.92 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.75 -0.833 . . . . 74.4 108.75 173.365 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 113' ' ' ALA . . . . . 0.583 ' HB1' ' HA ' ' B' ' 117' ' ' SER . . . 64.11 39.69 7.51 Favored 'General case' 0 CA--C 1.512 -0.496 0 O-C-N 123.604 0.565 . . . . 62.23 110.804 178.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.51 92.32 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.646 -0.707 . . . . 52.35 111.476 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 30.8 t70 82.88 -34.96 0.08 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.227 -1.351 . . . . 72.53 112.829 168.271 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 7.4 mp -95.98 -40.11 9.43 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.883 -0.327 . . . . 65.14 110.321 -178.085 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.583 ' HA ' ' HB1' ' B' ' 113' ' ' ALA . 33.1 t 63.36 94.2 0.05 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.378 -0.828 . . . . 64.44 110.602 -178.376 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 15.6 m -57.07 94.62 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.351 -1.295 . . . . 70.31 111.599 178.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -176.45 -174.45 0.59 Allowed 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.842 -0.617 . . . . 73.2 109.813 -178.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 37.2 m -118.99 108.15 14.4 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 110.041 -0.355 . . . . 74.53 110.041 176.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -109.08 66.72 0.64 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.295 0.569 . . . . 73.33 112.195 -176.032 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -121.37 88.39 2.93 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.419 0.628 . . . . 72.11 109.664 173.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 123' ' ' ILE . . . . . 0.501 HG23 ' HE3' ' B' ' 125' ' ' LYS . 8.8 tt -133.3 128.87 56.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.377 -0.829 . . . . 72.22 109.427 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 15.6 m -87.11 84.31 7.31 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.403 0.621 . . . . 60.23 110.806 -172.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 125' ' ' LYS . . . . . 0.501 ' HE3' HG23 ' B' ' 123' ' ' ILE . 0.0 OUTLIER -134.08 24.46 3.89 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.262 -0.881 . . . . 74.33 110.025 177.721 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -85.63 -171.57 3.67 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.183 -0.917 . . . . 71.1 110.239 179.131 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -133.35 142.42 48.41 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 108.987 -0.746 . . . . 72.33 108.987 178.637 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 45.0 m -65.1 -29.55 70.42 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.261 0.553 . . . . 53.44 109.607 170.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -77.64 104.35 8.12 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.58 -0.737 . . . . 75.31 109.583 173.36 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.463 ' C ' ' H ' ' B' ' 132' ' ' ASN . 11.2 m -128.5 -149.8 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 115.447 -0.797 . . . . 74.21 110.404 -179.174 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 131' ' ' PHE . . . . . 0.438 ' H ' ' HB ' ' B' ' 130' ' ' VAL . 10.7 p90 -72.04 26.98 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.129 -0.487 . . . . 63.22 111.93 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.465 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 64.4 t30 -57.97 -53.73 54.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.028 0.442 . . . . 71.33 110.617 -176.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 133' ' ' ILE . . . . . 0.538 HG21 ' HB3' ' A' ' 79' ' ' LEU . 49.1 mm -60.55 -43.71 95.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.787 -0.642 . . . . 73.04 111.549 -177.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.832 HD12 HD21 ' A' ' 49' ' ' LEU . 80.8 mt -67.46 -24.3 65.6 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.263 -0.426 . . . . 75.05 111.266 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -73.63 -46.05 49.19 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.122 0.486 . . . . 61.3 110.062 177.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 136' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 26.7 mm-40 -65.45 -33.24 75.49 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.472 -0.785 . . . . 75.34 110.97 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -99.04 5.56 47.02 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.546 -0.297 . . . . 61.43 111.432 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 52.37 70.59 0.55 Allowed 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.55 0.944 . . . . 64.34 113.55 175.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 139' ' ' PHE . . . . . 0.447 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 28.1 m-85 -99.77 0.99 42.78 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.832 -0.622 . . . . 74.43 109.645 169.133 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 61.75 89.94 0.1 OUTLIER Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 114.842 -1.072 . . . . 74.13 111.472 -173.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.417 ' HA ' ' CD1' ' A' ' 49' ' ' LEU . 22.4 Cg_exo -65.94 143.54 73.2 Favored 'Trans proline' 0 N--CA 1.463 -0.318 0 C-N-CA 122.632 2.221 . . . . 74.02 110.695 172.002 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 142' ' ' LYS . . . . . 0.708 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 17.2 tptt -87.81 173.74 8.79 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 119.658 -0.817 . . . . 73.11 111.652 -176.098 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 143' ' ' PHE . . . . . 0.404 ' H ' ' HG3' ' B' ' 142' ' ' LYS . 42.7 t80 166.86 114.83 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.106 -1.072 . . . . 63.42 108.106 -166.312 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 144' ' ' LEU . . . . . 0.588 HD22 ' H ' ' A' ' 24' ' ' SER . 96.0 mt -136.61 -46.96 0.61 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.999 0.428 . . . . 63.43 111.324 -176.119 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 31.3 m -66.52 114.41 5.47 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.313 -0.858 . . . . 54.43 111.584 -175.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -79.09 95.2 5.49 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.299 -0.63 . . . . 71.03 109.299 175.198 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 147' ' ' VAL . . . . . 0.679 HG11 ' H ' ' A' ' 44' ' ' LEU . 5.1 t -69.24 169.93 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.919 -0.582 . . . . 72.52 109.962 -179.599 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 148' ' ' LYS . . . . . 0.59 ' HB3' ' HA ' ' B' ' 161' ' ' SER . 0.0 OUTLIER -85.52 129.38 34.83 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.553 -0.536 . . . . 74.22 109.553 -175.758 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.849 HD21 HD12 ' A' ' 34' ' ' LEU . 39.1 tp -76.03 98.18 4.24 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.243 -0.89 . . . . 73.43 110.743 -173.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.976 ' HB2' HG23 ' B' ' 159' ' ' THR . . . -102.25 102.45 12.85 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.112 -0.949 . . . . 62.21 110.213 177.021 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 151' ' ' PHE . . . . . 0.58 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 37.6 p90 -125.89 166.65 16.5 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.84 -0.618 . . . . 60.24 110.13 -178.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -87.04 115.52 24.48 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.183 0.516 . . . . 74.25 110.802 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 153' ' ' CYS . . . . . 0.493 ' HB3' ' CG ' ' B' ' 158' ' ' LYS . 45.7 t -134.13 122.86 23.48 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.845 -0.616 . . . . 75.33 110.183 177.239 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.1 t70 70.23 8.63 6.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.233 -0.894 . . . . 72.3 111.956 174.081 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 111.53 -9.11 28.32 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.267 -0.968 . . . . 22.24 112.959 176.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -124.24 160.99 26.73 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.673 -0.491 . . . . 75.23 109.673 175.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 47.2 mm -80.12 119.53 29.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.737 -0.468 . . . . 71.1 109.737 175.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 158' ' ' LYS . . . . . 0.493 ' CG ' ' HB3' ' B' ' 153' ' ' CYS . 30.7 mmmt -98.39 98.32 9.56 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.876 -0.416 . . . . 63.41 109.876 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 159' ' ' THR . . . . . 0.976 HG23 ' HB2' ' B' ' 150' ' ' ALA . 0.2 OUTLIER -84.06 102.78 12.76 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.268 -0.424 . . . . 71.53 110.997 179.83 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -99.6 114.59 27.72 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.348 -0.387 . . . . 71.41 110.85 178.071 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 161' ' ' SER . . . . . 0.59 ' HA ' ' HB3' ' B' ' 148' ' ' LYS . 5.3 p -76.69 -33.46 58.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.976 -0.557 . . . . 64.31 110.167 176.098 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -116.37 149.5 39.25 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.604 -0.726 . . . . 72.41 109.684 176.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -90.19 -9.21 48.96 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.13 0.49 . . . . 74.4 110.327 -178.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -63.93 -49.6 71.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.629 -0.714 . . . . 75.31 110.183 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 10.7 m -66.43 -36.1 81.96 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.88 -0.6 . . . . 72.01 110.753 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 3.9 tt -60.29 -43.36 96.34 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.069 0.461 . . . . 61.34 110.131 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 15.9 ttp180 -60.83 -23.38 65.05 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.373 -0.83 . . . . 64.42 110.899 -175.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -88.32 -43.24 11.68 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.184 0.516 . . . . 62.52 110.207 176.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 169' ' ' PHE . . . . . 0.43 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 59.1 t80 -62.81 -39.3 93.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.39 -0.823 . . . . 75.42 111.051 -178.032 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -67.1 -29.09 68.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.059 -0.519 . . . . 53.41 111.532 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 22.9 t -75.6 -32.61 60.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.758 0.314 . . . . 73.3 111.112 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -82.79 -16.09 49.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.907 0.385 . . . . 71.51 110.651 179.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 173' ' ' LYS . . . . . 0.409 ' HA ' ' HD2' ' B' ' 173' ' ' LYS . 25.7 mmmt -81.31 117.92 22.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.225 -0.443 . . . . 74.44 110.281 174.863 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.1 p -54.16 -44.84 71.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.129 -0.487 . . . . 73.32 111.89 -178.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 4.5 p -71.45 -50.73 28.82 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.957 -0.565 . . . . 74.44 111.658 -178.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 82.3 mtp -73.61 -16.77 61.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.321 -0.4 . . . . 51.4 112.077 -172.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 177' ' ' LYS . . . . . 0.441 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 47.4 tttp -62.8 -26.11 68.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.307 -0.406 . . . . 73.41 110.91 -178.197 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 178' ' ' GLU . . . . . 0.402 ' HA ' ' HD3' ' B' ' 181' ' ' LYS . 5.1 mm-40 -94.33 -8.19 39.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.434 0.635 . . . . 72.24 109.917 -176.295 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 179' ' ' LEU . . . . . 0.486 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 11.2 mp -87.64 -54.88 4.04 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.029 -0.987 . . . . 74.04 109.844 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -81.03 -14.25 58.06 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.207 -0.906 . . . . 73.04 112.19 -173.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 181' ' ' LYS . . . . . 0.446 ' HA ' ' O ' ' B' ' 184' ' ' LEU . 64.9 pttt -57.46 -19.2 22.63 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.347 0.499 . . . . 71.11 112.347 -176.646 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -58.51 -36.39 73.73 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.061 0.458 . . . . 65.11 110.783 177.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 183' ' ' VAL . . . . . 0.555 HG21 HD22 ' A' ' 29' ' ' ASN . 26.9 m -119.32 11.77 6.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.223 0.535 . . . . 74.05 110.367 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 184' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' B' ' 181' ' ' LYS . 55.6 tp -143.04 86.8 9.04 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.736 -0.666 . . . . 73.1 110.534 -175.171 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 185' ' ' PRO . . . . . 0.725 ' HB2' ' HB3' ' B' ' 188' ' ' GLU . 16.6 Cg_exo -69.08 150.41 72.31 Favored 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 122.903 2.402 . . . . 71.03 111.485 178.412 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 70.6 mm-40 -82.57 107.71 15.42 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.874 0.368 . . . . 72.0 111.443 -172.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? 53.73 40.72 31.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.259 -0.882 . . . . 75.35 112.047 178.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 188' ' ' GLU . . . . . 0.725 ' HB3' ' HB2' ' B' ' 185' ' ' PRO . 35.4 tt0 . . . . . 0 C--O 1.251 1.155 0 CA-C-N 114.66 -1.155 . . . . 72.14 109.039 177.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.689 0 N-CA-C 112.24 -0.344 . . . . 32.12 112.24 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 28.3 m -128.5 173.59 13.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.781 0.324 . . . . 65.32 110.349 178.617 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 93.4 mt -84.67 131.18 34.62 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.257 -0.429 . . . . 74.41 110.305 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.1 mmt -95.94 -7.75 35.72 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.301 0.572 . . . . 72.13 109.664 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -74.0 103.48 4.5 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.682 -0.69 . . . . 54.44 109.174 176.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -95.86 145.62 25.22 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.998 -0.547 . . . . 45.45 110.359 -175.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.62 -145.74 6.38 Favored Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.694 -0.765 . . . . 44.32 111.472 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -138.88 134.69 33.61 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 120.618 0.246 . . . . 75.24 110.445 178.151 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.2 p -116.93 134.27 61.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.359 -0.382 . . . . 63.22 110.335 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.8 mp -93.24 89.39 6.39 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.053 0.454 . . . . 64.22 109.972 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 60.9 m -73.01 113.64 10.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.785 -0.643 . . . . 71.01 111.033 -178.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.464 HD13 ' N ' ' A' ' 13' ' ' ALA . 1.4 tm? -99.93 134.51 42.74 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.243 -1.021 . . . . 65.02 108.243 177.046 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.855 ' HB3' ' HA ' ' A' ' 17' ' ' SER . . . -50.27 114.33 1.09 Allowed 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 112.449 0.537 . . . . 73.11 112.449 -178.356 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.451 ' O ' ' HB2' ' A' ' 15' ' ' ASP . . . -81.23 104.01 11.4 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.843 -0.617 . . . . 50.55 110.179 175.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 6.6 m-20 85.02 -14.28 0.61 Allowed 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 114.906 -1.043 . . . . 54.2 111.489 171.268 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.9 mp -119.13 37.24 4.19 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.851 -0.796 . . . . 72.25 108.851 176.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.855 ' HA ' ' HB3' ' A' ' 13' ' ' ALA . 19.5 m -48.35 98.77 0.02 OUTLIER 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.031 -0.986 . . . . 72.24 112.298 -172.518 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 17.9 m -70.84 78.79 0.62 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.603 -1.181 . . . . 64.45 111.289 177.308 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -167.17 103.13 0.53 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.64 -0.709 . . . . 54.01 109.975 175.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.6 m -132.74 147.67 52.32 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.017 -0.538 . . . . 74.33 109.976 -178.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 85.7 mt -81.39 -173.29 4.28 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.095 0.474 . . . . 54.51 111.367 -179.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.632 ' HA ' ' O ' ' B' ' 126' ' ' GLN . 8.6 p-10 -77.43 120.59 22.63 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.661 -0.7 . . . . 63.23 110.586 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.52 HG12 ' H ' ' A' ' 24' ' ' SER . 14.4 tt -162.49 172.04 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.993 -0.549 . . . . 75.34 109.865 -175.268 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.52 ' H ' HG12 ' A' ' 23' ' ' ILE . 1.9 m -56.82 144.54 32.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.207 0.527 . . . . 70.03 111.298 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.963 ' HD3' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -104.87 69.98 0.9 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.753 0.787 . . . . 64.34 110.88 -174.342 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.616 ' O ' ' HA ' ' B' ' 122' ' ' ASP . 1.8 mp0 -107.5 149.85 27.49 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.812 -0.631 . . . . 73.31 111.299 -178.084 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 51.4 m95 -139.69 125.62 19.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.666 -0.697 . . . . 63.34 109.412 174.107 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.603 ' H ' ' HB3' ' B' ' 122' ' ' ASP . 8.5 p -70.04 -32.76 71.06 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.266 0.555 . . . . 74.44 110.631 178.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -116.9 127.29 54.11 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.574 -0.739 . . . . 61.1 110.127 177.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.489 ' C ' ' H ' ' A' ' 32' ' ' ASN . 19.4 m -110.66 -156.31 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.846 -0.615 . . . . 72.4 109.771 176.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.406 ' HB3' HD11 ' B' ' 149' ' ' LEU . 22.1 p90 -73.03 31.18 0.07 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.991 0.424 . . . . 74.05 111.185 176.758 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.525 ' O ' ' HB3' ' A' ' 35' ' ' ARG . 48.6 t30 -60.17 -51.13 70.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.703 -0.68 . . . . 70.55 111.368 -174.517 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.502 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 48.5 mm -58.78 -47.54 88.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.167 -0.469 . . . . 72.11 111.469 -177.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.1 mt -60.3 -35.45 75.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.007 0.432 . . . . 63.33 110.746 177.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.525 ' HB3' ' O ' ' A' ' 32' ' ' ASN . 23.4 ttt-85 -62.38 -49.94 73.53 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.637 -0.711 . . . . 73.34 110.374 176.477 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 15.9 mm-40 -66.67 -31.95 72.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.672 -0.695 . . . . 65.34 111.898 -176.262 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -98.04 3.62 49.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.771 0.319 . . . . 73.22 111.159 -177.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 38.2 t70 57.73 62.06 2.22 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.592 0.711 . . . . 73.11 111.929 175.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.417 ' HB3' ' HB2' ' B' ' 151' ' ' PHE . 23.4 m-85 -89.3 -3.33 58.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.816 -0.629 . . . . 75.51 110.534 170.258 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 61.06 67.28 1.47 Allowed Pre-proline 0 CA--C 1.534 0.333 0 CA-C-N 115.624 -0.716 . . . . 75.02 110.029 -173.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -80.65 168.88 17.4 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.535 2.157 . . . . 65.42 111.583 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.508 ' HE2' ' HB3' ' B' ' 150' ' ' ALA . 10.7 mptt -90.97 168.84 11.37 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.431 -0.508 . . . . 74.24 110.866 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.4 ' HD2' ' O ' ' A' ' 44' ' ' LEU . 15.9 p90 -101.21 -166.91 1.36 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.817 -0.629 . . . . 75.12 111.883 -164.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.4 ' O ' ' HD2' ' A' ' 43' ' ' PHE . 2.5 mm? -80.83 141.75 34.37 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.419 -0.586 . . . . 71.13 109.419 177.617 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.601 ' SG ' HG23 ' A' ' 47' ' ' VAL . 6.6 t -82.77 141.34 32.43 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.113 0.482 . . . . 74.24 111.153 -170.729 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -86.13 47.07 1.4 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.724 -0.671 . . . . 75.52 110.404 177.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.601 HG23 ' SG ' ' A' ' 45' ' ' CYS . 45.8 t -78.09 106.5 8.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.109 0.48 . . . . 71.14 109.875 176.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.37 141.93 16.55 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.357 -0.838 . . . . 73.13 110.073 178.637 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.668 ' HB3' ' HD1' ' A' ' 51' ' ' PHE . 10.6 mp -76.09 88.51 3.01 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.719 -0.673 . . . . 71.42 109.868 178.29 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.08 59.71 4.59 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.156 0.503 . . . . 65.1 109.683 175.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.668 ' HD1' ' HB3' ' A' ' 49' ' ' LEU . 52.5 p90 -90.5 166.96 12.94 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.993 -0.548 . . . . 64.33 110.203 -175.364 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -100.41 123.31 44.47 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 120.981 0.419 . . . . 73.44 110.697 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.645 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 52.9 t -125.77 112.32 15.92 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.726 -0.67 . . . . 71.14 109.577 176.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 68.04 21.27 8.84 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.862 -0.608 . . . . 72.22 111.39 177.352 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 107.8 -32.75 6.82 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.75 -0.738 . . . . 63.42 112.433 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.4 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 10.6 pt-20 -98.37 143.87 28.37 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.073 0.463 . . . . 64.12 110.8 -176.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.2 mm -74.5 118.32 20.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.027 -0.533 . . . . 74.31 110.289 178.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.412 ' HG2' ' HB3' ' A' ' 53' ' ' CYS . 29.9 mmmt -106.17 107.72 18.87 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.198 -0.667 . . . . 71.4 109.198 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.535 ' HA ' ' O ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -98.51 112.92 24.8 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.061 -0.518 . . . . 74.33 111.919 -171.178 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -128.56 139.18 52.43 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.246 -0.433 . . . . 73.34 110.2 177.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 65.4 p -104.21 -16.69 15.13 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.121 0.486 . . . . 62.21 110.1 176.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -127.16 150.14 49.64 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.813 -0.63 . . . . 71.22 111.237 -176.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.0 mt -67.92 -23.39 65.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.712 -0.677 . . . . 75.43 110.477 177.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -60.63 -48.8 80.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.093 0.473 . . . . 74.54 110.55 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 9.9 m -68.11 -41.92 81.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.892 -0.594 . . . . 61.13 110.705 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.4 tp -65.28 -36.11 83.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.941 -0.572 . . . . 74.15 110.648 -178.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.745 ' HG2' HD11 ' A' ' 84' ' ' LEU . 62.8 mtt180 -53.77 -49.51 68.08 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.222 -0.445 . . . . 73.15 111.806 178.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 40.7 mtmt -73.06 -28.9 62.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.994 -0.548 . . . . 54.42 111.353 -173.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.504 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 81.5 t80 -79.21 -43.48 23.77 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.869 0.366 . . . . 72.53 110.658 178.747 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.18 -32.28 73.89 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.416 -0.356 . . . . 72.34 111.61 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.0 p -75.88 -15.5 60.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.555 -0.293 . . . . 70.13 111.624 -178.025 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 19.4 pt20 -102.1 -2.12 30.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.183 0.516 . . . . 75.32 110.106 176.342 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.645 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 30.2 mmmt -98.49 120.01 38.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.842 -0.617 . . . . 74.45 110.36 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.2 p -58.85 -40.52 84.53 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.349 -0.387 . . . . 50.01 111.299 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.0 m -77.43 -31.89 54.23 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.033 -0.53 . . . . 52.35 111.74 -177.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.452 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 80.0 mtp -94.42 -10.93 30.92 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.862 0.319 . . . . 72.45 111.862 -174.344 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -59.28 -37.31 77.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.048 0.451 . . . . 72.55 111.421 -176.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.461 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 61.9 mm-40 -96.69 5.07 51.4 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.3 0.571 . . . . 61.44 110.548 -175.396 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.554 ' HB3' HG21 ' B' ' 133' ' ' ILE . 53.6 mt -95.63 -52.29 4.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.172 -0.922 . . . . 74.43 109.687 177.133 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.416 ' HB3' HD13 ' A' ' 84' ' ' LEU . 4.2 mm? -85.7 -4.81 59.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.529 -0.76 . . . . 71.03 111.808 -176.482 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.461 ' HD2' ' HA ' ' A' ' 78' ' ' GLU . 18.4 ptmt -54.68 -18.09 4.17 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.854 0.359 . . . . 74.4 111.63 177.491 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -69.12 -44.28 72.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.393 -0.367 . . . . 64.45 111.386 179.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.603 HG23 HD12 ' A' ' 84' ' ' LEU . 16.1 m -100.46 5.28 10.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-O 120.878 0.37 . . . . 65.11 111.865 -176.02 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.745 HD11 ' HG2' ' A' ' 67' ' ' ARG . 8.2 mp -117.5 155.23 50.49 Favored Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 108.895 -0.78 . . . . 64.0 108.895 172.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -76.83 67.86 7.32 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.099 1.866 . . . . 55.51 111.207 176.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -114.23 88.83 2.94 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.766 -0.652 . . . . 71.42 111.479 -177.17 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -110.49 -47.33 3.29 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.602 -0.888 . . . . 60.22 108.602 172.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 . . . . . 0 C--N 1.325 -0.484 0 CA-C-N 115.158 -0.928 . . . . 51.42 110.406 177.493 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.409 0 N-CA-C 112.473 -0.251 . . . . 75.25 112.473 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 34.7 m -83.39 158.06 3.73 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 CA-C-O 120.626 0.251 . . . . 63.34 110.632 179.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 89.9 mt -114.18 135.69 53.77 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.251 -0.431 . . . . 74.01 110.461 -178.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 24.6 mmt -95.32 45.45 1.1 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.092 -0.503 . . . . 64.23 110.902 -177.121 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -109.82 119.8 40.48 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.097 -0.501 . . . . 60.0 110.474 176.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -138.1 110.22 7.31 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.655 -0.702 . . . . 73.55 109.577 177.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -134.85 -119.9 1.99 Allowed Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.571 -0.823 . . . . 44.54 112.162 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -146.3 88.86 1.82 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.702 0.287 . . . . 55.24 110.664 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 7.1 p -69.72 127.13 31.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.145 -0.479 . . . . 64.44 109.892 177.289 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 84.2 mt -76.21 125.95 30.09 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.142 -0.481 . . . . 44.44 111.393 -172.663 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 24.2 m -88.01 110.48 20.63 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.048 -0.524 . . . . 73.14 110.033 177.617 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 112' ' ' LEU . . . . . 0.403 ' HA ' HD22 ' B' ' 112' ' ' LEU . 0.6 OUTLIER -140.4 123.02 16.23 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.11 -0.7 . . . . 64.22 109.11 -178.357 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.59 147.37 49.38 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.234 -0.439 . . . . 41.22 111.922 -174.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.36 -60.74 2.08 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.946 -0.57 . . . . 41.31 110.941 177.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -107.9 -19.13 13.62 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.815 0.34 . . . . 72.12 111.516 -178.187 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -98.72 41.6 1.13 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.129 -0.693 . . . . 75.33 109.129 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 2.8 m -77.39 67.29 3.3 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.308 -0.86 . . . . 72.41 109.975 -172.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 18.5 m -37.6 110.72 0.13 Allowed 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 113.461 -1.7 . . . . 61.52 112.594 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -158.89 111.56 2.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.27 -0.877 . . . . 74.12 109.475 176.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 28.5 m -154.7 139.88 17.52 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.817 0.341 . . . . 73.44 110.91 -175.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 121' ' ' LEU . . . . . 0.404 ' HB3' ' H ' ' B' ' 122' ' ' ASP . 4.1 mm? -99.34 -158.42 0.67 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.974 -0.557 . . . . 74.32 110.854 177.514 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 122' ' ' ASP . . . . . 0.616 ' HA ' ' O ' ' A' ' 26' ' ' GLN . 9.8 p-10 -61.41 131.75 51.25 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.95 -0.568 . . . . 75.34 111.634 -175.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 123' ' ' ILE . . . . . 0.6 HG12 ' H ' ' B' ' 124' ' ' SER . 14.9 tt -172.78 176.19 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 115.852 -0.613 . . . . 61.24 109.863 -179.71 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.6 ' H ' HG12 ' B' ' 123' ' ' ILE . 14.7 m -67.49 169.0 9.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.388 0.613 . . . . 63.1 111.122 178.407 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 125' ' ' LYS . . . . . 0.754 ' HD3' ' H ' ' B' ' 125' ' ' LYS . 0.0 OUTLIER -125.97 80.27 1.9 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.826 0.822 . . . . 74.21 110.801 -174.053 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 126' ' ' GLN . . . . . 0.632 ' O ' ' HA ' ' A' ' 22' ' ' ASP . 1.9 mp0 -115.8 129.16 56.33 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.93 -0.577 . . . . 72.22 111.302 -178.573 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 78.9 m95 -140.78 120.98 13.84 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 108.754 -0.832 . . . . 75.22 108.754 173.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 19.3 m -68.61 -39.85 80.65 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.897 -0.592 . . . . 73.41 111.933 -173.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -114.84 111.7 21.63 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.888 -0.325 . . . . 71.13 111.518 -175.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.582 HG12 ' HD2' ' B' ' 131' ' ' PHE . 41.8 t -131.61 120.89 46.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.042 -0.527 . . . . 74.32 109.663 175.555 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 131' ' ' PHE . . . . . 0.582 ' HD2' HG12 ' B' ' 130' ' ' VAL . 20.0 p90 51.21 12.04 0.12 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.898 1.279 . . . . 72.14 113.881 177.832 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.499 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 52.0 t30 -55.12 -58.04 9.3 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.746 0.308 . . . . 65.3 111.632 -173.506 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 133' ' ' ILE . . . . . 0.554 HG21 ' HB3' ' A' ' 79' ' ' LEU . 49.5 mm -57.36 -42.54 80.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.183 0.516 . . . . 74.52 111.108 -178.128 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.556 HD12 HD23 ' A' ' 49' ' ' LEU . 86.2 mt -67.63 -26.52 66.28 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.052 -0.522 . . . . 52.1 111.35 -177.511 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 46.1 ttt180 -71.73 -46.44 58.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.998 0.428 . . . . 75.43 109.942 175.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 136' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 16.8 mm-40 -63.05 -27.08 69.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.51 -0.768 . . . . 75.45 111.358 -177.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -106.17 3.36 27.84 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.411 -0.359 . . . . 70.0 111.305 -177.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 32.9 t70 55.37 65.61 1.44 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.562 0.696 . . . . 55.04 111.887 177.646 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -94.03 6.3 48.97 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.827 -0.624 . . . . 71.21 111.025 172.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 58.44 66.26 2.67 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 116.004 -0.544 . . . . 65.41 110.485 -175.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.407 ' C ' ' HD2' ' B' ' 142' ' ' LYS . 85.7 Cg_endo -86.76 156.82 8.89 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.772 2.314 . . . . 74.21 112.691 -176.581 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 142' ' ' LYS . . . . . 0.407 ' HD2' ' C ' ' B' ' 141' ' ' PRO . 12.7 mptt -120.14 140.95 50.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.942 0.401 . . . . 62.32 110.95 -179.084 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 93.0 t80 -178.46 103.48 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.081 -0.963 . . . . 60.21 109.078 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 144' ' ' LEU . . . . . 0.479 ' HG ' ' HG2' ' B' ' 146' ' ' GLU . 50.4 tp -156.52 104.14 2.17 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.849 -0.426 . . . . 61.31 109.849 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 145' ' ' CYS . . . . . 0.468 ' HA ' ' SG ' ' A' ' 45' ' ' CYS . 26.5 t -80.41 87.16 5.66 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.322 0.582 . . . . 45.32 110.162 -179.614 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 146' ' ' GLU . . . . . 0.479 ' HG2' ' HG ' ' B' ' 144' ' ' LEU . 5.3 mm-40 -85.07 -4.57 59.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.421 -0.809 . . . . 75.4 110.454 177.215 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 22.9 t -87.63 119.03 34.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-O 121.921 0.867 . . . . 55.25 111.548 -178.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 148' ' ' LYS . . . . . 0.515 ' HD3' HG22 ' B' ' 159' ' ' THR . 0.1 OUTLIER -152.76 147.16 25.75 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 113.776 -1.556 . . . . 64.43 107.304 172.619 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.581 ' O ' ' HA ' ' B' ' 159' ' ' THR . 2.6 mm? -65.23 93.95 0.14 Allowed 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.49 -0.484 . . . . 75.12 110.719 -175.418 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.546 ' HA ' ' O ' ' B' ' 158' ' ' LYS . . . -103.27 75.92 1.39 Allowed 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.014 -0.994 . . . . 73.34 108.75 176.112 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 151' ' ' PHE . . . . . 0.55 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 46.2 p90 -110.64 164.5 12.67 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.274 -0.876 . . . . 74.44 110.575 -173.686 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -101.73 116.26 32.34 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.049 0.452 . . . . 73.34 111.011 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 153' ' ' CYS . . . . . 0.668 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 49.2 t -112.32 107.7 16.63 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.84 -0.618 . . . . 64.54 109.66 178.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 66.92 6.72 4.83 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 116.093 -0.503 . . . . 73.33 111.883 176.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 126.56 -29.98 4.35 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.724 -0.75 . . . . 51.25 112.442 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 156' ' ' GLU . . . . . 0.592 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 14.1 pt-20 -91.89 140.37 29.74 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 122.682 -0.304 . . . . 63.03 110.262 -178.194 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 44.9 mm -83.38 123.83 39.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.879 0.371 . . . . 63.44 110.103 177.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 158' ' ' LYS . . . . . 0.592 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 27.0 mmmt -106.35 148.06 28.5 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.149 -0.686 . . . . 61.31 109.149 179.511 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 159' ' ' THR . . . . . 0.581 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.0 OUTLIER -130.46 124.87 33.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.049 0.452 . . . . 71.53 111.584 178.449 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 160' ' ' PHE . . . . . 0.412 ' CD2' HD13 ' B' ' 166' ' ' LEU . 90.1 m-85 -132.68 126.84 33.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.587 -0.733 . . . . 74.34 110.405 176.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.7 -23.1 62.41 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.976 -0.557 . . . . 71.41 111.495 -179.09 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -150.97 177.25 10.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.851 0.358 . . . . 53.45 110.471 175.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 76.3 mt -86.65 -7.56 58.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.881 -0.6 . . . . 65.31 111.736 -175.047 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 164' ' ' GLN . . . . . 0.501 ' OE1' ' HD3' ' B' ' 167' ' ' ARG . 5.7 tp-100 -78.59 -40.11 35.53 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.991 -0.744 . . . . 75.32 108.991 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 22.5 t -67.79 -39.24 84.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.435 -0.802 . . . . 73.12 110.014 175.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 166' ' ' LEU . . . . . 0.412 HD13 ' CD2' ' B' ' 160' ' ' PHE . 53.0 tp -68.06 -29.87 68.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.875 -0.602 . . . . 75.14 110.476 177.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 167' ' ' ARG . . . . . 0.501 ' HD3' ' OE1' ' B' ' 164' ' ' GLN . 58.5 ttt180 -60.46 -28.05 68.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.992 -0.549 . . . . 74.13 110.908 178.565 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -79.89 -26.37 40.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.142 -0.481 . . . . 60.12 111.175 177.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -88.3 -42.37 12.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.159 -0.473 . . . . 61.44 110.834 -176.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.64 -23.06 67.14 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.092 -0.504 . . . . 74.21 111.535 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 3.1 p -81.14 -26.28 36.24 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.409 -0.36 . . . . 44.34 111.826 -178.348 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -92.73 -14.63 27.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.041 0.448 . . . . 61.21 110.526 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 173' ' ' LYS . . . . . 0.668 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 29.4 mmmt -85.56 117.34 24.4 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.01 -0.541 . . . . 55.21 109.822 175.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 11.2 m -59.67 -35.97 75.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.883 0.373 . . . . 63.21 111.449 -175.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 7.0 p -76.51 -47.83 21.48 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.269 -0.423 . . . . 31.11 111.102 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.486 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 82.3 mtp -72.31 -18.79 61.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.828 0.347 . . . . 65.44 111.293 -176.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 177' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' B' ' 173' ' ' LYS . 84.0 tttt -58.75 -41.59 86.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.904 -0.589 . . . . 71.21 111.28 -177.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 178' ' ' GLU . . . . . 0.615 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 9.2 mm-40 -89.23 -6.76 56.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.601 0.715 . . . . 70.12 109.647 -174.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 179' ' ' LEU . . . . . 0.502 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 64.3 mt -82.77 -43.1 17.15 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.051 -0.977 . . . . 72.11 109.971 177.129 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 180' ' ' LEU . . . . . 0.649 ' HB3' HD13 ' B' ' 184' ' ' LEU . 4.3 mm? -95.89 -9.78 30.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.872 -0.604 . . . . 55.14 112.102 -174.612 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 181' ' ' LYS . . . . . 0.615 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 17.5 ptmt -56.5 -20.93 22.61 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.841 0.682 . . . . 30.04 112.841 -175.61 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -68.66 -40.16 80.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.989 0.423 . . . . 75.53 111.252 179.295 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 26.3 m -103.07 -15.58 7.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.081 -0.508 . . . . 75.02 111.537 -176.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 184' ' ' LEU . . . . . 0.649 HD13 ' HB3' ' B' ' 180' ' ' LEU . 9.9 mp -93.26 154.93 41.43 Favored Pre-proline 0 C--N 1.325 -0.457 0 N-CA-C 109.654 -0.498 . . . . 61.13 109.654 175.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -68.86 72.66 1.02 Allowed 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.7 2.267 . . . . 75.32 112.286 178.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -127.75 99.63 5.63 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.419 -0.809 . . . . 72.1 109.38 175.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 187' ' ' LYS . . . . . 0.523 ' NZ ' ' HB2' ' B' ' 187' ' ' LYS . 7.8 mtmp? -90.05 -4.29 57.46 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.856 -0.611 . . . . 74.51 110.275 -177.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 188' ' ' GLU . . . . . 0.498 ' OE1' ' HB2' ' B' ' 187' ' ' LYS . 1.9 mp0 . . . . . 0 C--O 1.248 1.006 0 CA-C-N 115.529 -0.759 . . . . 65.02 109.983 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.819 0 N-CA-C 111.65 -0.58 . . . . 65.02 111.65 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 31.2 m -86.6 -26.2 6.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.303 0.573 . . . . 71.35 109.65 177.255 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 85.6 mt -103.12 158.06 16.56 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.604 -0.725 . . . . 74.24 109.561 174.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -73.86 -9.72 58.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.195 0.522 . . . . 74.22 110.764 -178.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -124.36 129.08 50.06 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.683 -0.69 . . . . 53.14 109.726 177.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.485 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 0.6 OUTLIER -96.85 9.74 40.97 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.147 -0.478 . . . . 72.33 111.257 -175.899 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -79.15 62.64 3.99 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.892 -0.67 . . . . 61.21 111.763 176.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -91.22 155.69 18.39 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.833 0.349 . . . . 51.14 110.908 -178.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.2 m -74.37 152.91 6.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.972 -0.558 . . . . 72.11 111.295 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.0 pp -101.27 157.89 16.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.934 -0.575 . . . . 74.31 110.505 177.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.8 t -79.17 161.78 26.21 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.186 -0.461 . . . . 72.12 110.602 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.419 HD13 ' N ' ' A' ' 13' ' ' ALA . 0.9 OUTLIER -145.9 125.76 13.54 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.754 -0.832 . . . . 71.15 108.754 179.136 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.965 ' HB3' ' HB3' ' A' ' 17' ' ' SER . . . -137.63 146.69 44.23 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.93 0.395 . . . . 73.52 110.887 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.65 -33.98 66.95 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.736 -0.665 . . . . 73.41 111.992 -175.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -82.1 53.13 2.15 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.261 0.467 . . . . 71.22 112.261 -175.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.1 mt 57.87 19.61 5.91 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 112.62 0.6 . . . . 74.42 112.62 173.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.965 ' HB3' ' HB3' ' A' ' 13' ' ' ALA . 38.4 t -84.0 -6.57 59.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.142 0.496 . . . . 71.32 110.503 -179.295 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.4 m -85.96 75.8 9.93 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.0 -0.545 . . . . 72.31 110.388 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -137.18 93.52 2.83 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.976 -0.557 . . . . 54.04 110.882 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.6 m -153.98 112.05 3.55 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.923 -0.58 . . . . 71.31 109.589 177.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.0 tt -140.33 124.07 17.24 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.025 -0.361 . . . . 71.33 110.025 -176.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -154.16 177.16 11.41 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.846 -0.798 . . . . 73.45 108.846 177.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.9 tt -75.63 159.9 5.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.91 -0.404 . . . . 62.52 109.91 -178.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.7 m -66.35 90.78 0.16 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.261 0.553 . . . . 75.41 110.247 176.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.789 ' HD3' ' H ' ' A' ' 25' ' ' LYS . 0.6 OUTLIER -82.16 24.32 0.66 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.598 -0.728 . . . . 74.23 111.432 -176.513 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -87.68 -178.16 6.02 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.959 -0.564 . . . . 43.14 110.504 -177.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 76.2 m95 -61.07 -22.81 64.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.998 -0.546 . . . . 74.43 112.386 -174.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.0 m 66.86 36.15 4.58 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 122.662 1.22 . . . . 73.33 107.954 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 -71.16 12.09 0.35 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 113.053 -1.885 . . . . 74.33 112.488 -171.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.417 HG21 HD12 ' B' ' 163' ' ' LEU . 27.7 m -78.59 -35.52 18.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.594 -0.276 . . . . 70.55 111.361 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.604 ' HB3' HD11 ' B' ' 149' ' ' LEU . 26.1 p90 -84.45 -12.13 54.9 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 120.723 -0.391 . . . . 70.15 110.806 -178.435 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.552 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 8.8 t30 -60.54 -46.1 91.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.063 -0.517 . . . . 70.31 110.156 178.45 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.518 HG21 ' HB3' ' B' ' 179' ' ' LEU . 45.2 mm -62.66 -35.98 73.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-O 121.22 0.534 . . . . 64.53 110.439 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 72.0 mt -64.36 -39.18 93.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.758 -0.655 . . . . 63.12 110.225 178.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 57.3 ttt85 -69.51 -40.95 76.66 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.099 -0.501 . . . . 73.25 110.858 178.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.552 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 5.5 mm-40 -64.48 -31.08 72.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.831 0.348 . . . . 72.11 111.406 -178.681 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -100.52 1.35 40.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.02 0.438 . . . . 43.44 110.824 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 58.79 58.15 3.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.128 -0.942 . . . . 63.13 112.259 177.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -84.18 -2.86 57.62 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.478 -0.783 . . . . 65.33 109.388 169.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 60.68 75.09 0.48 Allowed Pre-proline 0 C--O 1.234 0.252 0 CA-C-N 114.912 -1.04 . . . . 74.23 111.114 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -82.54 159.21 16.86 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.632 2.222 . . . . 74.44 111.214 176.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.748 ' HD3' ' HB3' ' B' ' 150' ' ' ALA . 3.6 mptp? -75.21 -168.38 0.77 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.418 0.525 . . . . 74.24 112.418 -177.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 16.7 p90 -99.15 86.06 3.36 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 113.409 0.892 . . . . 75.25 113.409 -161.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.3 mm? 63.79 121.83 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.742 -1.117 . . . . 62.51 113.115 168.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 12.6 p -78.8 -4.42 49.33 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.358 0.599 . . . . 70.41 110.476 176.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -102.47 88.43 3.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.706 -0.679 . . . . 75.04 109.302 178.134 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.494 HG22 ' CZ ' ' B' ' 143' ' ' PHE . 31.5 t -101.95 127.21 55.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.471 -0.786 . . . . 53.43 109.291 174.031 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.597 ' H ' ' HD2' ' A' ' 48' ' ' LYS . 1.7 mptp? -81.06 140.69 34.97 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.471 -0.937 . . . . 75.43 108.471 178.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.568 HD21 ' HB3' ' B' ' 131' ' ' PHE . 21.0 tp -92.92 23.27 4.3 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 109.52 -0.548 . . . . 73.12 109.52 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.673 ' HB3' ' HD3' ' B' ' 142' ' ' LYS . . . -34.3 103.7 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 O-C-N 124.553 1.158 . . . . 64.15 112.895 -173.035 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.743 ' HB3' ' HA ' ' B' ' 141' ' ' PRO . 46.8 p90 -132.09 172.04 12.87 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.086 -0.961 . . . . 61.23 109.969 -178.168 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -101.46 115.11 29.77 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.277 0.56 . . . . 72.24 110.871 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.523 ' O ' ' HG2' ' A' ' 56' ' ' GLU . 41.9 t -112.31 99.84 8.33 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.432 -0.804 . . . . 61.05 110.454 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.6 t70 64.61 15.34 9.63 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.449 0.642 . . . . 73.42 110.817 176.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.17 -35.41 3.11 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.788 -0.72 . . . . 65.32 112.801 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.771 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 13.4 pt-20 -88.72 133.31 34.26 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.712 0.292 . . . . 75.12 110.902 -176.719 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.401 ' HA ' ' O ' ' A' ' 51' ' ' PHE . 47.9 mm -80.91 120.37 32.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 109.24 -0.652 . . . . 74.53 109.24 176.495 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.771 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 28.9 mmmt -111.2 112.27 23.93 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.932 0.396 . . . . 75.2 111.509 -173.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.468 HG22 ' HB2' ' A' ' 50' ' ' ALA . 1.0 OUTLIER -88.88 104.09 16.61 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.964 -0.562 . . . . 63.3 110.488 172.818 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.503 ' CD2' HD13 ' A' ' 66' ' ' LEU . 21.4 m-85 -120.32 142.74 48.84 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.054 -0.521 . . . . 75.23 110.953 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 32.9 p -137.05 -14.26 1.57 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.149 -0.932 . . . . 60.25 109.667 173.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.46 ' HB2' ' OG ' ' A' ' 65' ' ' SER . 9.3 m-20 -98.97 157.71 16.14 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.651 -0.704 . . . . 71.42 109.265 177.323 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.5 mp -92.72 -39.5 11.22 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.919 -0.4 . . . . 73.03 109.919 177.15 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -55.03 -43.83 74.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.895 -0.593 . . . . 74.3 111.408 178.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.46 ' OG ' ' HB2' ' A' ' 62' ' ' ASP . 16.9 p -65.42 -52.01 56.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.849 0.357 . . . . 63.11 110.891 -179.218 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.503 HD13 ' CD2' ' A' ' 60' ' ' PHE . 63.1 tp -63.47 -34.14 77.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.04 -0.527 . . . . 60.34 110.705 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.456 ' HG3' HD21 ' A' ' 84' ' ' LEU . 20.3 ttt180 -60.81 -40.16 91.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.786 -0.643 . . . . 74.44 110.297 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.405 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 46.1 mtmt -71.97 -45.11 62.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.99 -0.55 . . . . 74.22 110.737 174.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -58.89 -49.76 76.57 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.795 -0.639 . . . . 75.45 110.949 -175.057 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.404 ' CB ' HD12 ' A' ' 80' ' ' LEU . . . -57.57 -38.18 74.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.876 0.37 . . . . 63.52 111.501 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 42.9 m -70.77 -30.52 67.03 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.27 -0.423 . . . . 72.45 111.462 -177.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 13.1 pt20 -97.12 12.14 33.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.209 0.528 . . . . 74.22 110.662 178.214 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.445 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 26.2 mmmt -119.07 114.84 23.12 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.83 -0.623 . . . . 72.33 110.086 175.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.5 m -58.59 -33.42 69.96 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.247 0.546 . . . . 73.43 110.545 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 12.1 m -78.54 -23.64 46.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.884 -0.598 . . . . 73.33 111.974 -176.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.447 ' HG3' ' SG ' ' A' ' 53' ' ' CYS . 46.6 mtp -104.94 -18.28 14.24 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.792 0.664 . . . . 61.1 112.792 -176.249 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.559 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 81.8 tttt -72.92 -17.37 61.5 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.264 0.554 . . . . 73.33 110.208 -176.385 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.572 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 56.5 mm-40 -102.66 4.11 37.86 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.512 -0.767 . . . . 65.33 109.665 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.597 ' HB3' HG21 ' B' ' 133' ' ' ILE . 71.8 mt -100.61 -44.48 5.83 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.15 -0.932 . . . . 72.02 109.657 175.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.404 HD12 ' CB ' ' A' ' 70' ' ' ALA . 7.9 mt -97.09 0.02 47.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.862 -0.608 . . . . 74.01 110.691 -175.375 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.572 ' HD3' ' HA ' ' A' ' 78' ' ' GLU . 64.4 pttt -56.61 -22.69 35.69 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.195 -0.457 . . . . 74.12 111.781 178.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -75.73 -56.58 4.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.914 0.387 . . . . 73.45 110.879 178.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 29.8 m -80.64 -20.47 11.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.076 -0.511 . . . . 73.03 112.184 -172.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.456 HD21 ' HG3' ' A' ' 67' ' ' ARG . 10.7 mp -101.23 132.97 21.25 Favored Pre-proline 0 C--N 1.326 -0.449 0 N-CA-C 109.222 -0.658 . . . . 62.24 109.222 172.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 84' ' ' LEU . 32.2 Cg_exo -58.19 98.97 0.09 OUTLIER 'Trans proline' 0 C--O 1.236 0.378 0 C-N-CA 122.738 2.292 . . . . 61.0 112.515 -178.465 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -144.04 146.76 33.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.796 -0.638 . . . . 65.34 110.118 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -102.3 -23.48 13.98 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.339 -0.615 . . . . 74.1 109.339 173.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 115.336 -0.847 . . . . 75.13 110.564 -179.96 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.407 0 N-CA-C 112.182 -0.367 . . . . 61.42 112.182 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 22.5 m -105.21 -30.01 2.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 120.898 0.38 . . . . 51.12 111.121 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 93.9 mt -85.76 142.75 28.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.363 -0.38 . . . . 64.23 110.784 -178.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -78.46 -41.82 31.63 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.059 -0.719 . . . . 63.33 109.059 177.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -116.55 130.97 57.05 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.074 -0.966 . . . . 73.43 108.733 176.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -86.77 36.48 0.71 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.021 0.439 . . . . 74.31 111.499 -172.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -71.99 70.54 0.98 Allowed Glycine 0 CA--C 1.518 0.243 0 CA-C-N 116.056 -0.52 . . . . 73.52 112.492 177.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -130.45 -164.3 1.41 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.673 -0.491 . . . . 71.52 109.673 178.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 9.0 p -124.93 138.74 53.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 120.806 0.336 . . . . 72.03 110.558 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 6.8 mp -95.66 167.35 11.34 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.337 -0.392 . . . . 63.41 110.298 -179.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 9.1 t -72.91 161.94 30.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.23 -0.441 . . . . 61.34 110.4 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 57.7 tp -136.8 130.47 31.92 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.012 0.434 . . . . 61.33 110.588 -178.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 113' ' ' ALA . . . . . 0.52 ' HB3' ' HB2' ' B' ' 117' ' ' SER . . . -152.13 168.54 24.96 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.971 -0.558 . . . . 72.24 110.205 178.443 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -98.78 -49.36 4.6 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.185 -0.461 . . . . 62.35 111.546 -176.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -63.3 -64.33 0.94 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.604 -0.725 . . . . 44.05 111.239 -171.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -159.93 90.26 0.91 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.631 -0.713 . . . . 64.44 112.016 -173.558 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.52 ' HB2' ' HB3' ' B' ' 113' ' ' ALA . 64.1 m -154.82 -40.76 0.09 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.705 -0.679 . . . . 53.33 109.804 176.137 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 8.5 m -58.76 111.4 1.26 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.727 -0.669 . . . . 74.44 110.005 174.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -98.95 166.47 11.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.114 -0.494 . . . . 43.54 111.266 -176.129 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 9.8 m -73.86 131.1 41.15 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.631 -0.713 . . . . 75.13 110.176 177.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -76.96 174.45 10.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.842 0.353 . . . . 71.3 110.882 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 122' ' ' ASP . . . . . 0.489 ' OD1' HG22 ' B' ' 123' ' ' ILE . 4.5 t70 -155.85 -160.72 1.05 Allowed 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.772 -0.825 . . . . 73.41 108.772 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 123' ' ' ILE . . . . . 0.489 HG22 ' OD1' ' B' ' 122' ' ' ASP . 11.0 tt -68.03 132.06 32.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.334 0.588 . . . . 63.11 111.563 -177.208 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 34.2 p -76.25 132.69 40.03 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.923 -0.58 . . . . 70.33 110.385 176.023 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 125' ' ' LYS . . . . . 0.763 ' HD3' ' H ' ' B' ' 125' ' ' LYS . 0.0 OUTLIER -108.64 77.19 1.07 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.813 0.816 . . . . 73.15 111.456 -174.195 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -97.73 151.62 19.96 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.749 -0.66 . . . . 70.11 110.031 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 31.3 m95 -86.97 42.24 1.01 Allowed 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.633 0.605 . . . . 74.32 112.633 -169.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 49.4 m 74.62 15.2 3.34 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.813 0.816 . . . . 74.25 110.045 169.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 22.4 p-10 -65.09 -29.9 70.8 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.111 -1.404 . . . . 74.55 111.809 -176.205 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 48.6 t -64.71 -55.38 21.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.429 -0.35 . . . . 41.22 111.645 -178.019 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 131' ' ' PHE . . . . . 0.568 ' HB3' HD21 ' A' ' 49' ' ' LEU . 33.5 p90 -91.95 4.07 53.8 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.909 -0.316 . . . . 74.14 111.841 -175.508 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -63.77 -37.42 87.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.277 0.56 . . . . 71.21 109.979 175.367 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 133' ' ' ILE . . . . . 0.597 HG21 ' HB3' ' A' ' 79' ' ' LEU . 22.7 mm -64.33 -34.06 66.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.266 -0.879 . . . . 74.41 110.751 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 77.1 mt -66.92 -34.9 78.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.789 -0.641 . . . . 73.42 111.228 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -71.85 -41.27 68.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.909 0.385 . . . . 62.43 110.343 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -59.92 -46.77 88.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.954 -0.566 . . . . 73.32 111.172 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -92.53 3.18 56.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.139 -0.482 . . . . 74.41 111.349 -176.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 53.42 71.14 0.52 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.906 0.706 . . . . 63.13 112.906 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -89.65 -6.21 56.38 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.798 -0.637 . . . . 74.42 110.331 171.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 58.68 74.96 0.56 Allowed Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 115.486 -0.779 . . . . 24.52 110.81 178.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.743 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 5.0 Cg_exo -74.77 -179.57 5.04 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.36 2.707 . . . . 73.43 111.801 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 142' ' ' LYS . . . . . 0.673 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 11.5 tptp -89.62 -152.58 0.25 Allowed 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 119.899 -0.72 . . . . 64.11 110.812 -178.716 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 143' ' ' PHE . . . . . 0.494 ' CZ ' HG22 ' A' ' 47' ' ' VAL . 9.6 p90 -79.62 176.78 9.4 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 120.973 0.416 . . . . 74.22 111.356 -170.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 144' ' ' LEU . . . . . 0.686 HD22 ' H ' ' B' ' 144' ' ' LEU . 1.5 mm? -62.51 128.42 35.94 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.46 -0.791 . . . . 63.03 111.518 -172.209 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 16.3 t -96.27 14.49 24.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.601 0.715 . . . . 73.05 109.227 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 -79.85 39.58 0.43 Allowed 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.495 -0.775 . . . . 73.42 110.508 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 89.5 t -78.65 122.18 33.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.868 -0.605 . . . . 71.31 111.098 -176.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 148' ' ' LYS . . . . . 0.47 ' H ' ' HD2' ' B' ' 148' ' ' LYS . 0.0 OUTLIER -125.02 152.31 44.43 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 107.921 -1.14 . . . . 71.14 107.921 173.537 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.738 ' HB3' ' HD1' ' B' ' 151' ' ' PHE . 3.7 mm? -51.32 -51.45 54.29 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.212 0.32 . . . . 74.03 111.742 -175.783 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.748 ' HB3' ' HD3' ' A' ' 42' ' ' LYS . . . 47.32 36.67 4.99 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 123.976 0.797 . . . . 72.53 111.673 176.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 151' ' ' PHE . . . . . 0.738 ' HD1' ' HB3' ' B' ' 149' ' ' LEU . 28.5 p90 -87.66 167.68 13.67 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.867 -0.606 . . . . 73.1 109.992 -177.174 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -96.87 121.34 38.63 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.174 -0.466 . . . . 73.21 110.294 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 153' ' ' CYS . . . . . 0.45 ' HB2' ' CE2' ' B' ' 151' ' ' PHE . 48.7 t -122.06 113.2 19.2 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.795 -0.639 . . . . 74.52 109.635 176.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.1 t70 68.63 16.46 9.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.613 -0.721 . . . . 63.32 111.127 174.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 116.71 -32.25 5.59 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.568 -0.825 . . . . 42.31 112.827 178.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 156' ' ' GLU . . . . . 0.487 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 13.4 pt-20 -97.87 157.68 15.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.831 0.348 . . . . 75.35 110.67 -177.763 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.9 mm -92.23 123.55 44.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.388 -0.369 . . . . 73.13 110.389 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 158' ' ' LYS . . . . . 0.487 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 26.5 mmmt -106.59 103.82 13.36 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.987 0.422 . . . . 74.13 110.89 -177.663 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.17 96.25 10.48 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.084 0.468 . . . . 63.32 111.687 -179.592 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -110.34 123.82 50.54 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.962 -0.563 . . . . 73.41 110.046 174.488 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 16.2 m -93.8 -26.4 16.97 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.216 -0.661 . . . . 72.04 109.216 174.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 162' ' ' ASP . . . . . 0.438 ' HA ' HG21 ' B' ' 123' ' ' ILE . 5.0 p-10 -102.77 153.64 19.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.282 -0.872 . . . . 74.31 109.48 177.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 163' ' ' LEU . . . . . 0.417 HD12 HG21 ' A' ' 30' ' ' VAL . 2.9 mm? -87.73 -20.09 26.7 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.744 0.307 . . . . 64.45 110.809 -176.345 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -64.11 -47.6 79.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.322 -0.399 . . . . 73.32 110.805 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 15.7 m -65.9 -35.46 80.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.549 -0.296 . . . . 53.43 110.97 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 65.3 tp -66.44 -43.4 85.72 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.02 0.438 . . . . 74.31 110.136 177.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 167' ' ' ARG . . . . . 0.49 ' HG3' ' CD2' ' B' ' 184' ' ' LEU . 68.4 ttt180 -62.12 -41.5 98.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.868 -0.606 . . . . 64.24 110.471 178.38 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -66.48 -41.65 88.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.996 -0.547 . . . . 61.42 110.887 177.167 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 169' ' ' PHE . . . . . 0.412 ' O ' ' HG2' ' B' ' 172' ' ' GLN . 69.6 t80 -62.69 -46.3 88.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 74.05 110.666 -179.192 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 170' ' ' ALA . . . . . 0.42 ' CB ' HD12 ' B' ' 180' ' ' LEU . . . -61.48 -30.42 70.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.29 -0.413 . . . . 74.4 111.518 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 20.4 m -82.75 -12.3 57.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.775 0.322 . . . . 72.01 111.652 -175.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 172' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 14.0 pt20 -106.77 -1.99 22.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.436 0.636 . . . . 75.44 109.454 175.217 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -110.25 103.4 12.07 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.073 -0.967 . . . . 55.3 109.525 177.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 19.9 m -56.87 -32.11 65.5 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.9 0.381 . . . . 72.34 110.984 -177.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 6.2 m -66.11 -40.98 91.13 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.047 -0.524 . . . . 42.24 111.045 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 76.5 mtp -88.28 -21.15 24.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.392 -0.367 . . . . 44.3 111.077 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 177' ' ' LYS . . . . . 0.502 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 85.6 tttt -65.68 -23.09 66.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.308 0.575 . . . . 72.1 110.269 -179.261 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -95.59 -8.62 34.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.509 -0.769 . . . . 71.2 109.881 -178.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 179' ' ' LEU . . . . . 0.518 ' HB3' HG21 ' A' ' 33' ' ' ILE . 89.8 mt -94.04 -52.0 4.6 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 114.853 -1.067 . . . . 71.25 109.482 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 180' ' ' LEU . . . . . 0.42 HD12 ' CB ' ' B' ' 170' ' ' ALA . 6.0 mt -87.75 -12.45 45.16 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.791 -0.641 . . . . 63.11 112.368 -171.508 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 181' ' ' LYS . . . . . 0.502 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 64.2 pttt -62.15 -12.01 17.48 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.44 -0.504 . . . . 63.31 111.786 -178.784 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -70.03 -40.44 75.17 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.101 0.477 . . . . 74.01 110.445 175.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 25.9 m -104.65 -13.23 9.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.939 -0.573 . . . . 64.32 111.094 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 184' ' ' LEU . . . . . 0.49 ' CD2' ' HG3' ' B' ' 167' ' ' ARG . 9.1 mp -99.96 119.33 59.8 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 115.92 -0.582 . . . . 71.23 109.774 175.137 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -62.53 102.23 0.28 Allowed 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.779 2.319 . . . . 60.03 112.332 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -142.0 130.68 22.74 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.783 -0.644 . . . . 74.43 109.843 178.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 10.1 mtmp? -97.81 18.81 14.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.383 0.611 . . . . 73.14 110.357 178.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 . . . . . 0 C--O 1.25 1.127 0 CA-C-N 115.058 -0.974 . . . . 74.45 109.813 173.677 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.75 0 N-CA-C 112.3 -0.32 . . . . 64.11 112.3 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.496 HG13 HD22 ' A' ' 3' ' ' LEU . 14.8 p -119.48 -22.05 4.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.912 0.387 . . . . 55.43 110.765 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.496 HD22 HG13 ' A' ' 2' ' ' VAL . 2.7 mm? -83.23 162.38 21.22 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.229 -0.286 . . . . 52.34 110.229 177.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 95.1 mmm -96.2 67.81 2.6 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.997 0.427 . . . . 72.54 110.917 -176.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -169.51 152.96 4.93 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.608 -0.723 . . . . 74.02 109.826 178.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -127.13 170.33 12.49 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.801 0.334 . . . . 64.55 111.633 -176.37 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 136.07 106.37 0.82 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.061 -0.59 . . . . 73.02 111.742 -177.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -86.98 88.47 7.71 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.153 0.501 . . . . 73.11 111.567 -176.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 58.6 t -99.73 143.14 14.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.694 -0.685 . . . . 74.34 109.568 177.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -55.93 131.51 47.34 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.106 0.479 . . . . 74.41 110.507 178.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 50.9 m -119.64 143.99 47.4 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.939 -0.573 . . . . 72.43 110.823 -174.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.634 HD11 ' HB3' ' A' ' 18' ' ' SER . 57.0 tp -112.59 135.65 53.06 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.314 -0.403 . . . . 54.45 110.491 178.448 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.469 ' HB3' ' HB2' ' A' ' 17' ' ' SER . . . -97.45 161.18 13.91 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.18 -0.464 . . . . 74.02 111.216 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.45 97.42 8.38 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.932 -0.576 . . . . 51.43 110.329 176.416 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 71.32 -27.33 0.17 Allowed 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.076 1.35 . . . . 72.34 113.417 167.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 85.8 mt -80.33 4.67 17.1 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.208 0.447 . . . . 70.13 112.208 -179.082 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.469 ' HB2' ' HB3' ' A' ' 13' ' ' ALA . 50.9 m -145.78 -29.44 0.42 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.779 0.323 . . . . 34.02 111.609 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.634 ' HB3' HD11 ' A' ' 12' ' ' LEU . 3.6 p -78.2 -26.86 47.71 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.917 0.389 . . . . 60.21 110.74 178.476 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -134.06 176.17 8.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.937 -0.574 . . . . 62.12 109.828 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 34.4 m -149.69 134.51 17.79 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 110.131 -0.322 . . . . 73.24 110.131 178.511 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -68.95 156.45 38.55 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.287 -0.415 . . . . 64.11 110.564 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -59.21 118.45 5.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 44.1 110.83 -178.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 6.2 tp -76.17 122.33 30.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.989 -0.55 . . . . 52.0 111.126 -178.292 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.2 t -133.87 167.74 20.03 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.696 -0.684 . . . . 63.42 109.33 177.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.439 ' HA ' ' HD2' ' A' ' 25' ' ' LYS . 29.8 mmmt -114.94 -15.92 11.74 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.828 0.346 . . . . 73.14 110.786 -179.267 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.624 ' HG3' HG23 ' B' ' 183' ' ' VAL . 30.5 mm-40 -109.96 104.51 13.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.957 -0.565 . . . . 75.2 109.708 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 23.1 m95 -90.9 -68.73 0.77 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.141 -0.481 . . . . 63.53 110.631 -174.036 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.5 m -127.94 28.46 5.56 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.897 -0.592 . . . . 71.31 110.757 -177.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -73.79 -5.23 39.59 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.593 0.711 . . . . 72.33 110.26 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.583 HG22 HD13 ' B' ' 163' ' ' LEU . 10.9 t -69.05 154.57 8.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.564 -0.744 . . . . 72.35 109.527 176.01 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.46 ' HB3' HD22 ' B' ' 149' ' ' LEU . 18.4 p90 58.77 -13.45 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 125.158 1.383 . . . . 74.23 114.653 176.02 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.437 ' H ' ' C ' ' A' ' 30' ' ' VAL . 9.7 t30 -57.33 -46.42 83.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.035 0.445 . . . . 54.04 111.023 -178.777 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.527 HG22 HD21 ' A' ' 37' ' ' ASN . 48.8 mm -64.56 -43.53 96.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.937 -0.574 . . . . 75.44 110.887 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.762 HD12 HD21 ' B' ' 149' ' ' LEU . 85.5 mt -65.25 -17.94 64.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 74.43 111.617 -178.078 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -79.93 -34.38 38.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.113 0.482 . . . . 74.31 110.115 175.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -71.88 -46.17 58.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.753 -0.658 . . . . 64.12 111.293 -176.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.527 HD21 HG22 ' A' ' 33' ' ' ILE . 11.9 p30 -91.15 -8.0 49.93 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.866 -0.606 . . . . 74.05 110.753 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.1 t0 55.39 73.33 0.43 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.174 -0.921 . . . . 70.25 112.077 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -86.02 12.91 8.46 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.129 -0.942 . . . . 75.41 110.241 170.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.566 ' O ' ' HA ' ' B' ' 151' ' ' PHE . 1.1 tm-20 66.54 73.28 0.39 Allowed Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 115.62 -0.718 . . . . 72.42 110.215 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -76.88 161.31 33.34 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 123.352 2.702 . . . . 71.51 111.959 -178.404 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.553 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 10.8 tptt -121.61 144.37 48.79 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 120.195 -0.602 . . . . 72.31 112.438 -176.045 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -164.71 96.72 0.75 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.432 -1.258 . . . . 64.41 109.284 -175.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.902 ' H ' HG11 ' B' ' 147' ' ' VAL . 6.1 mp -101.3 -5.34 25.58 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.973 0.416 . . . . 73.34 110.184 179.507 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.653 ' H ' HG21 ' B' ' 147' ' ' VAL . 11.3 t 70.26 25.33 4.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.893 -1.049 . . . . 73.02 110.658 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -80.36 76.98 7.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.008 -0.542 . . . . 74.14 109.813 176.647 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.742 HG12 ' H ' ' A' ' 48' ' ' LYS . 2.3 t -91.21 -155.46 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 109.208 -0.664 . . . . 62.21 109.208 -178.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.742 ' H ' HG12 ' A' ' 47' ' ' VAL . 0.2 OUTLIER -111.23 129.06 56.08 Favored 'General case' 0 CA--C 1.506 -0.738 0 C-N-CA 120.156 -0.617 . . . . 74.43 109.505 -175.78 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.999 HD21 HD12 ' B' ' 134' ' ' LEU . 47.2 tp -79.54 80.4 5.92 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 109.383 -0.599 . . . . 74.44 109.383 175.381 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.761 ' H ' ' HB2' ' B' ' 142' ' ' LYS . . . -88.4 77.06 8.2 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.514 -0.766 . . . . 63.14 110.146 178.498 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.575 ' HD1' ' HG ' ' A' ' 49' ' ' LEU . 43.7 p90 -93.77 168.76 10.79 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.638 -0.71 . . . . 73.34 110.919 -174.23 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.47 ' HE3' ' CD1' ' A' ' 57' ' ' ILE . 4.5 tppp? -96.78 114.08 25.68 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.999 -0.546 . . . . 63.42 110.368 -178.609 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.482 ' SG ' ' HE1' ' A' ' 69' ' ' PHE . 48.7 t -121.57 112.57 18.64 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.141 -0.481 . . . . 52.13 110.66 179.375 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.5 t70 68.88 0.98 2.94 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.298 -0.865 . . . . 74.54 112.456 171.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 127.98 -13.62 6.37 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.182 -1.009 . . . . 43.31 112.91 178.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.605 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 11.9 pt-20 -118.09 144.78 45.35 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.072 0.463 . . . . 75.22 110.272 177.417 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.47 ' CD1' ' HE3' ' A' ' 52' ' ' LYS . 41.0 mm -75.16 126.07 35.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.866 -0.607 . . . . 72.52 109.767 177.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.605 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 30.9 mmmt -114.17 117.51 31.4 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.187 -0.301 . . . . 75.24 110.187 -178.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.56 105.54 16.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.111 0.481 . . . . 70.14 111.458 178.565 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.444 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 25.5 m-85 -123.29 151.42 42.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.034 -0.53 . . . . 74.3 111.424 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.4 t -158.89 19.06 0.2 Allowed 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.075 -1.083 . . . . 54.43 108.075 173.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -129.88 117.05 19.55 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 114.809 -1.087 . . . . 75.31 109.373 -173.162 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.482 HD11 HD13 ' A' ' 84' ' ' LEU . 51.6 tp -65.38 -37.57 87.39 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.633 0.254 . . . . 74.23 110.535 179.192 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 44.5 tt0 -59.47 -50.39 74.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.09 0.471 . . . . 72.34 111.019 177.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.4 m -66.51 -42.09 87.85 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.101 -0.5 . . . . 71.13 110.881 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 36.4 tp -65.48 -33.17 75.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.271 -0.422 . . . . 63.01 110.714 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.576 ' HA ' HD21 ' A' ' 84' ' ' LEU . 54.3 ttp180 -57.95 -40.38 80.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.328 -0.396 . . . . 74.12 110.659 177.023 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -69.88 -40.61 75.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.081 -0.509 . . . . 74.3 111.228 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.575 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 33.9 t80 -74.66 -45.19 46.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 71.43 111.068 -176.68 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.48 -28.36 67.79 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.753 0.311 . . . . 74.34 111.028 -177.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 31.6 t -63.92 -29.32 70.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.137 -0.483 . . . . 32.31 111.18 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.575 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 13.5 pt20 -95.9 0.95 52.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.167 0.508 . . . . 60.34 110.199 -179.581 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.48 ' HD3' ' HA ' ' A' ' 73' ' ' LYS . 43.3 mmtt -102.74 111.38 23.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.944 -0.571 . . . . 71.34 111.067 -178.738 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.8 m -53.99 -35.53 61.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.019 -0.537 . . . . 61.23 111.228 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.2 p -81.8 -56.88 3.7 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.236 0.541 . . . . 74.1 111.28 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.517 ' HA ' HD12 ' A' ' 79' ' ' LEU . 74.9 mtp -66.23 -24.0 66.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.674 -0.694 . . . . 73.12 112.312 -173.238 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.415 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 45.4 tttm -61.9 -33.99 75.22 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.858 0.361 . . . . 65.13 110.989 179.635 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -87.76 -14.06 40.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.572 0.701 . . . . 63.34 109.517 -174.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.517 HD12 ' HA ' ' A' ' 76' ' ' MET . 84.8 mt -82.26 -48.19 11.52 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.746 -1.116 . . . . 71.44 109.302 175.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.445 ' O ' ' HB3' ' A' ' 84' ' ' LEU . 4.3 mm? -79.31 -24.3 42.92 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.145 -0.934 . . . . 60.43 112.077 -177.016 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.482 ' HA ' ' HG3' ' A' ' 86' ' ' GLN . 64.2 pttt -57.85 -16.84 13.06 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.486 0.55 . . . . 51.43 112.486 -174.602 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -81.1 -45.43 16.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.856 0.36 . . . . 70.23 111.178 -177.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 11.5 m -106.99 -2.19 9.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.225 0.536 . . . . 64.42 111.169 -174.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.758 HD12 ' HD2' ' A' ' 85' ' ' PRO . 40.6 tp -127.43 132.14 24.18 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 115.716 -0.675 . . . . 70.41 109.82 -176.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.758 ' HD2' HD12 ' A' ' 84' ' ' LEU . 76.6 Cg_exo -51.47 113.88 1.33 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 123.189 2.593 . . . . 63.21 113.079 179.209 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.482 ' HG3' ' HA ' ' A' ' 81' ' ' LYS . 83.6 mm-40 -127.92 -148.34 0.38 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.263 -0.881 . . . . 75.04 109.406 176.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.51 ' H ' ' HD2' ' A' ' 87' ' ' LYS . 3.2 mptp? -70.44 -29.52 66.12 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.245 -0.65 . . . . 62.45 109.245 173.136 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 16.0 mp0 . . . . . 0 C--O 1.235 0.305 0 CA-C-N 115.395 -0.82 . . . . 50.1 110.907 176.646 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.362 0 N-CA-C 111.802 -0.519 . . . . 42.25 111.802 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 26.8 m -74.84 -23.32 17.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.57 0.7 . . . . 64.25 109.949 176.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 103' ' ' LEU . . . . . 0.594 HD13 ' N ' ' B' ' 104' ' ' MET . 1.6 tm? -132.59 150.61 52.13 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.652 -1.24 . . . . 72.41 107.652 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 104' ' ' MET . . . . . 0.594 ' N ' HD13 ' B' ' 103' ' ' LEU . 90.1 mmm -77.94 79.91 4.4 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.313 0.578 . . . . 71.55 110.364 -178.608 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -170.67 -167.43 0.58 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.682 -1.229 . . . . 72.41 107.682 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -93.04 157.58 16.23 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.795 0.331 . . . . 75.33 110.374 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -86.61 -129.62 2.63 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.743 -0.741 . . . . 54.45 112.191 -179.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -146.21 146.94 30.98 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 110.324 -0.25 . . . . 63.13 110.324 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 40.7 t -74.91 -48.63 32.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.251 0.548 . . . . 75.43 110.267 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -155.33 145.31 21.59 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.331 -0.849 . . . . 72.45 109.837 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 86.9 m -148.49 128.73 13.77 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.578 0.228 . . . . 64.1 110.834 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 31.8 tp -67.34 122.0 16.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.054 -0.521 . . . . 62.23 110.23 175.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -74.05 107.04 6.01 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.972 -0.558 . . . . 74.04 111.484 -177.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -80.3 -3.67 50.32 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.616 -0.72 . . . . 71.35 110.8 -179.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -92.31 11.02 27.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.913 -0.585 . . . . 60.11 109.96 176.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 98.8 mt 69.09 87.16 0.12 Allowed 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.179 -0.919 . . . . 75.4 111.356 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 8.8 t -123.28 -39.49 2.46 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.539 -0.755 . . . . 75.32 109.058 175.127 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -32.86 64.47 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.449 -0.796 . . . . 74.22 110.859 177.289 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -121.34 132.54 54.84 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.257 -0.429 . . . . 63.11 110.833 -179.574 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 2.6 m -108.91 160.43 16.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.807 -0.633 . . . . 72.45 109.664 178.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -65.99 157.5 30.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.914 0.387 . . . . 72.3 110.915 177.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -66.46 126.57 29.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.924 -0.58 . . . . 75.5 111.093 -177.049 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 123' ' ' ILE . . . . . 0.513 HG13 ' H ' ' B' ' 125' ' ' LYS . 7.7 tp -93.03 135.81 26.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.856 -0.611 . . . . 60.21 110.636 -178.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 6.5 m -114.78 2.42 14.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.014 0.435 . . . . 71.23 110.231 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 125' ' ' LYS . . . . . 0.513 ' H ' HG13 ' B' ' 123' ' ' ILE . 31.6 mmmt 70.41 -36.18 0.35 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.081 -0.963 . . . . 72.34 112.498 -179.29 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 21.2 mm-40 -86.95 143.12 27.52 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.66 -0.496 . . . . 74.02 109.66 179.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 75.0 m95 -112.92 -166.99 1.13 Allowed 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.03 0.443 . . . . 65.13 110.295 -176.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 18.0 m -84.17 35.56 0.54 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.586 -0.734 . . . . 73.01 111.556 -174.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -86.89 7.22 28.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.643 0.735 . . . . 64.01 110.232 -178.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.427 HG12 ' N ' ' B' ' 131' ' ' PHE . 5.2 t -73.56 166.8 2.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.414 -0.812 . . . . 54.34 109.252 177.001 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 131' ' ' PHE . . . . . 0.656 ' HD1' HD22 ' A' ' 49' ' ' LEU . 57.2 m-85 73.41 -37.71 0.39 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.502 0.721 . . . . 71.25 112.13 177.503 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -55.11 -36.75 66.03 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.352 0.501 . . . . 72.13 112.352 -176.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 133' ' ' ILE . . . . . 0.467 HG21 ' HB3' ' A' ' 79' ' ' LEU . 40.6 mm -58.0 -50.7 77.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.922 0.391 . . . . 55.44 110.797 177.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.999 HD12 HD21 ' A' ' 49' ' ' LEU . 40.3 mt -69.35 -9.07 51.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.037 -0.528 . . . . 72.52 111.558 -178.682 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -82.34 -30.1 30.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.848 0.356 . . . . 71.12 110.109 176.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -73.62 -53.87 9.47 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.269 0.556 . . . . 60.24 110.324 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 137' ' ' ASN . . . . . 0.543 ' OD1' ' HA ' ' B' ' 134' ' ' LEU . 16.1 p30 -80.48 -14.04 58.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.233 -0.894 . . . . 74.33 111.606 -177.025 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 11.5 t70 55.85 70.91 0.59 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.754 0.787 . . . . 62.25 110.403 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 139' ' ' PHE . . . . . 0.494 ' O ' ' HB2' ' B' ' 140' ' ' GLU . 1.8 m-85 -86.15 26.63 1.0 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.181 -0.918 . . . . 73.32 110.462 178.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 140' ' ' GLU . . . . . 0.528 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 12.4 mm-40 70.36 61.34 0.5 Allowed Pre-proline 0 N--CA 1.464 0.258 0 O-C-N 123.951 0.782 . . . . 72.04 110.529 -177.235 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.434 ' HD3' ' N ' ' B' ' 140' ' ' GLU . 6.5 Cg_exo -72.8 139.77 31.07 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.722 2.281 . . . . 52.15 112.073 -175.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 142' ' ' LYS . . . . . 0.761 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 13.6 mptt -111.86 135.96 51.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.952 0.406 . . . . 75.21 111.328 -178.796 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -162.75 90.32 0.7 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.932 -1.031 . . . . 74.23 108.508 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 144' ' ' LEU . . . . . 0.623 ' H ' HG11 ' A' ' 47' ' ' VAL . 3.0 mm? -86.6 -92.13 0.1 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 110.011 -0.366 . . . . 72.41 110.011 179.51 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 13.1 t -173.84 22.16 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.438 0.637 . . . . 74.52 109.953 177.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 146' ' ' GLU . . . . . 0.507 ' HB2' HG13 ' A' ' 47' ' ' VAL . 29.4 mt-10 -85.28 100.43 11.79 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.826 -0.624 . . . . 62.11 110.156 -178.179 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 147' ' ' VAL . . . . . 0.902 HG11 ' H ' ' A' ' 44' ' ' LEU . 1.7 t -125.48 -149.31 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.831 -0.622 . . . . 65.44 109.392 -177.083 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 148' ' ' LYS . . . . . 0.601 ' H ' HG12 ' B' ' 147' ' ' VAL . 1.3 mptt -113.5 122.91 48.71 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 108.662 -0.866 . . . . 62.12 108.662 177.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.762 HD21 HD12 ' A' ' 34' ' ' LEU . 65.9 tp -80.26 84.86 5.85 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.636 0.731 . . . . 72.52 109.147 174.224 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.553 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -94.76 115.72 27.86 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 114.811 -1.086 . . . . 43.34 109.082 176.666 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 151' ' ' PHE . . . . . 0.566 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 44.8 p90 -130.78 164.78 24.39 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.084 -0.507 . . . . 73.42 110.716 -179.087 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -87.52 123.2 32.17 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.131 -0.486 . . . . 73.42 110.012 179.031 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 153' ' ' CYS . . . . . 0.591 ' SG ' ' HE3' ' B' ' 173' ' ' LYS . 38.1 t -133.69 104.58 6.4 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.342 -0.39 . . . . 73.41 110.546 178.552 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 15.0 t70 70.21 14.02 7.65 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.259 -0.882 . . . . 73.25 111.948 172.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 124.54 -29.72 4.9 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.424 -0.893 . . . . 71.54 112.953 176.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 156' ' ' GLU . . . . . 0.446 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 15.4 pt-20 -106.68 150.85 25.83 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 122.553 -0.38 . . . . 74.53 110.644 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 44.6 mm -84.77 127.34 39.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.555 -0.535 . . . . 74.12 109.555 177.19 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 158' ' ' LYS . . . . . 0.533 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 29.2 mmmt -107.52 112.05 24.63 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.498 -0.319 . . . . 75.02 110.557 -177.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 159' ' ' THR . . . . . 0.526 HG22 ' HB2' ' B' ' 150' ' ' ALA . 0.8 OUTLIER -86.35 103.54 15.02 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.921 0.391 . . . . 74.32 110.988 176.777 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 160' ' ' PHE . . . . . 0.446 ' HD2' HD13 ' B' ' 166' ' ' LEU . 20.4 m-30 -120.66 116.56 25.54 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.173 -0.467 . . . . 73.33 111.197 178.254 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 8.0 t -109.64 10.53 24.91 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.354 -0.98 . . . . 74.1 108.354 171.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -122.09 121.62 37.35 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 114.863 -1.062 . . . . 71.24 110.104 -177.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 163' ' ' LEU . . . . . 0.583 HD13 HG22 ' A' ' 30' ' ' VAL . 63.0 tp -65.96 -35.48 80.71 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.925 -0.398 . . . . 63.54 109.925 177.108 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -62.29 -42.29 99.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.941 -0.572 . . . . 74.22 110.813 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 43.6 m -67.15 -43.5 82.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.215 -0.448 . . . . 75.11 110.645 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 166' ' ' LEU . . . . . 0.446 HD13 ' HD2' ' B' ' 160' ' ' PHE . 64.5 tp -65.35 -38.0 88.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.253 -0.431 . . . . 73.33 110.532 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 167' ' ' ARG . . . . . 0.423 ' HG3' ' HG ' ' B' ' 184' ' ' LEU . 36.6 ttp180 -58.37 -41.08 83.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.341 -0.391 . . . . 51.43 110.55 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 168' ' ' LYS . . . . . 0.402 ' HB2' ' HE3' ' B' ' 168' ' ' LYS . 40.0 mtmt -65.19 -51.97 57.76 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.01 -0.541 . . . . 74.13 110.886 177.078 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 169' ' ' PHE . . . . . 0.408 ' CE1' ' HE2' ' B' ' 173' ' ' LYS . 22.4 t80 -65.97 -44.8 83.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.296 -0.865 . . . . 71.22 111.266 -171.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.57 -30.52 71.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.374 -0.375 . . . . 62.33 111.511 -179.273 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 25.6 t -77.67 -20.47 53.67 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.495 -0.321 . . . . 52.23 111.111 -177.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -100.07 1.68 42.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.247 0.546 . . . . 62.44 110.618 178.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 173' ' ' LYS . . . . . 0.591 ' HE3' ' SG ' ' B' ' 153' ' ' CYS . 60.8 mmtt -102.18 118.11 36.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.57 -0.741 . . . . 71.4 109.58 173.131 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 4.2 p -59.01 -43.12 91.5 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.14 0.495 . . . . 40.22 111.007 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 4.5 m -69.6 -32.87 71.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.815 -0.63 . . . . 60.44 111.687 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.511 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 77.1 mtp -96.82 -10.85 25.76 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.698 0.258 . . . . 63.42 111.698 -172.597 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -56.58 -40.85 75.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.25 -0.432 . . . . 74.33 111.723 -177.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 178' ' ' GLU . . . . . 0.603 ' HA ' ' HD3' ' B' ' 181' ' ' LYS . 31.9 mt-10 -94.51 -0.31 54.74 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.262 0.553 . . . . 71.52 110.622 -173.456 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 179' ' ' LEU . . . . . 0.497 HD22 HD22 ' A' ' 37' ' ' ASN . 83.8 mt -83.21 -51.01 7.85 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.465 -0.789 . . . . 74.24 109.496 176.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 180' ' ' LEU . . . . . 0.625 ' HB3' HD13 ' B' ' 184' ' ' LEU . 3.7 mm? -92.01 1.54 57.13 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.775 -0.648 . . . . 72.12 111.481 -175.451 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 181' ' ' LYS . . . . . 0.603 ' HD3' ' HA ' ' B' ' 178' ' ' GLU . 63.8 pttt -65.19 -2.35 2.88 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.714 0.635 . . . . 73.21 112.714 -176.152 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -79.48 -31.0 42.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.357 0.599 . . . . 63.21 109.939 174.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 183' ' ' VAL . . . . . 0.624 HG23 ' HG3' ' A' ' 26' ' ' GLN . 5.3 p -107.23 -21.25 5.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.46 -0.791 . . . . 61.43 110.006 177.31 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 184' ' ' LEU . . . . . 0.625 HD13 ' HB3' ' B' ' 180' ' ' LEU . 10.1 mp -88.62 113.21 54.65 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 115.998 -0.547 . . . . 63.42 109.927 174.65 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -63.17 114.64 2.56 Favored 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 122.735 2.29 . . . . 72.34 112.461 -177.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -89.76 -168.93 2.28 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.918 -0.583 . . . . 64.03 110.314 177.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 187' ' ' LYS . . . . . 0.426 ' HD2' ' N ' ' B' ' 187' ' ' LYS . 2.6 mptp? -84.86 -25.11 28.24 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.825 -0.625 . . . . 73.01 110.173 -179.033 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 . . . . . 0 C--O 1.248 1.026 0 CA-C-N 115.562 -0.744 . . . . 64.33 109.903 177.834 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.874 ' HA2' ' SG ' ' A' ' 45' ' ' CYS . . . . . . . . 0 N--CA 1.48 1.597 0 N-CA-C 111.829 -0.509 . . . . 73.03 111.829 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 18.9 m -54.04 -36.73 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 CA-C-O 121.232 0.539 . . . . 61.42 110.725 178.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.568 HD12 ' HA ' ' A' ' 28' ' ' SER . 93.9 mt -136.43 137.46 40.48 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.492 -0.929 . . . . 75.25 108.492 173.06 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 68.7 mtm -118.01 21.8 12.6 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.973 0.416 . . . . 73.15 110.553 -175.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -55.96 119.94 6.63 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.347 -0.842 . . . . 65.25 111.413 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.412 ' H ' ' HG2' ' A' ' 6' ' ' GLU . 5.5 pt-20 -89.0 84.98 6.61 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.439 -0.801 . . . . 73.31 110.161 178.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -84.84 -141.74 5.5 Favored Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 115.56 -0.745 . . . . 22.13 112.496 -178.066 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -140.98 -171.0 3.16 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 120.852 0.358 . . . . 62.01 110.754 -177.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.414 ' HB ' ' H ' ' A' ' 10' ' ' LEU . 19.4 m -94.13 -150.91 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.743 -0.662 . . . . 74.51 110.054 177.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.414 ' H ' ' HB ' ' A' ' 9' ' ' VAL . 6.4 mp -70.69 87.82 0.69 Allowed 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.759 -0.46 . . . . 73.42 109.759 176.006 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 53.2 m -94.26 107.74 19.66 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.292 0.568 . . . . 54.34 111.241 -177.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.504 HD21 ' HA ' ' A' ' 16' ' ' LEU . 1.7 tt -94.77 125.6 39.53 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.24 -1.022 . . . . 73.41 108.24 174.66 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.71 ' HB3' ' O ' ' A' ' 16' ' ' LEU . . . -74.98 -165.22 0.36 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.398 -0.364 . . . . 63.5 111.702 -176.003 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.83 -77.39 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.837 0.68 . . . . 71.21 112.837 -173.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -83.03 -54.28 5.18 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.519 -0.919 . . . . 70.51 108.519 177.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.71 ' O ' ' HB3' ' A' ' 13' ' ' ALA . 4.7 mp -145.59 176.91 9.26 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 106.641 -1.614 . . . . 54.1 106.641 172.252 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.431 ' HA ' ' HB3' ' A' ' 13' ' ' ALA . 48.9 m -76.91 45.48 0.43 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.933 0.873 . . . . 64.34 110.125 177.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.439 ' H ' ' C ' ' A' ' 16' ' ' LEU . 29.6 t -120.22 118.62 30.96 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.356 -1.293 . . . . 62.24 109.216 -178.687 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -152.94 175.9 12.44 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.629 -0.26 . . . . 53.24 110.666 -177.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.8 m -66.63 139.41 57.87 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.472 -0.566 . . . . 72.12 109.472 175.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 21' ' ' LEU . 3.9 mm? -47.51 130.37 13.8 Favored 'General case' 0 N--CA 1.464 0.264 0 O-C-N 123.58 0.55 . . . . 75.31 112.018 -175.579 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -97.39 -167.6 1.56 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.385 -0.825 . . . . 74.22 110.914 -174.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 12.8 tt -97.73 -22.15 5.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 112.318 0.488 . . . . 74.55 112.318 -171.357 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.0 m -106.05 128.89 54.16 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.179 0.514 . . . . 71.3 112.069 -172.129 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.438 ' HD3' ' HA ' ' A' ' 25' ' ' LYS . 21.9 mmtm -117.86 98.77 6.52 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.567 0.698 . . . . 62.35 110.4 173.419 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.06 113.44 19.25 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 114.674 -1.148 . . . . 70.35 109.366 179.754 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 25.8 t-105 -115.08 35.07 4.5 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.688 0.756 . . . . 73.22 109.624 -179.049 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.568 ' HA ' HD12 ' A' ' 3' ' ' LEU . 3.4 m -77.44 31.5 0.15 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.378 -0.828 . . . . 73.14 111.209 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.407 ' ND2' HG21 ' B' ' 183' ' ' VAL . 8.7 t30 -79.8 85.96 5.41 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.105 0.478 . . . . 71.33 110.846 -176.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 58.3 t -125.97 -62.52 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.718 -0.674 . . . . 65.0 109.639 175.04 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.573 ' HB3' HD11 ' B' ' 149' ' ' LEU . 13.0 p90 -103.43 5.99 37.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.623 -0.717 . . . . 75.12 111.475 -177.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.616 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 22.4 t-20 -59.3 -61.13 2.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.323 -0.399 . . . . 70.25 111.217 -174.739 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.551 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 1.7 mp -53.45 -41.59 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.44 -0.345 . . . . 65.11 111.508 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.1 mt -60.06 -40.49 89.66 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.13 -0.487 . . . . 73.32 111.27 178.196 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -67.83 -43.39 79.68 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 116.605 -0.27 . . . . 74.21 110.799 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.616 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 4.8 mm-40 -63.5 -38.93 93.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 62.42 111.005 -177.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -92.23 1.17 57.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 64.21 111.032 -178.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 56.77 53.45 8.28 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.608 -0.724 . . . . 72.1 112.371 177.321 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -81.37 -11.34 59.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.856 -0.611 . . . . 63.44 109.629 171.419 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 60.25 81.85 0.24 Allowed Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 114.506 -1.225 . . . . 72.35 111.734 176.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.576 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 20.9 Cg_exo -66.27 164.28 28.72 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.719 2.279 . . . . 74.3 110.969 175.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 1.129 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -78.58 -67.39 0.75 Allowed 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 119.595 -0.842 . . . . 64.0 110.476 -176.347 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.421 ' C ' ' H ' ' A' ' 45' ' ' CYS . 89.0 m-85 -128.82 143.38 50.89 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 108.966 -0.753 . . . . 73.12 108.966 175.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.431 HD22 ' H ' ' A' ' 44' ' ' LEU . 2.2 mm? -78.58 38.48 0.31 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.053 0.454 . . . . 72.24 109.834 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.874 ' SG ' ' HA2' ' A' ' 1' ' ' GLY . 5.0 t 61.66 25.29 15.22 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.824 0.821 . . . . 74.3 109.655 -173.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.6 147.98 22.51 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.836 -1.075 . . . . 74.25 109.235 176.02 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 29.6 m -137.0 151.35 27.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-O 121.196 0.522 . . . . 71.22 111.003 -178.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.415 ' H ' ' HD2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -140.94 136.28 32.07 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.406 -0.816 . . . . 75.54 109.396 175.423 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.689 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 11.0 mp -72.61 92.35 1.51 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.339 -0.391 . . . . 74.24 110.293 178.291 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.631 ' HA ' ' O ' ' A' ' 58' ' ' LYS . . . -87.56 70.25 9.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.966 -0.561 . . . . 53.52 109.834 175.501 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.689 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 45.3 p90 -100.92 169.29 9.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.622 -0.717 . . . . 72.24 110.527 -177.413 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -105.65 121.72 44.57 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.477 -0.328 . . . . 73.15 111.391 -176.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.559 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 48.5 t -110.18 103.62 12.34 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.109 -0.496 . . . . 63.34 109.891 175.136 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 65.01 12.81 8.21 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.676 0.621 . . . . 73.24 112.676 174.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.45 -28.94 4.9 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.402 -0.904 . . . . 63.13 112.482 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.424 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 12.0 pt-20 -95.54 131.92 41.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.015 0.436 . . . . 74.21 110.721 -179.719 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 50.0 mm -75.26 129.64 36.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.103 -0.499 . . . . 71.24 110.375 177.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.631 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 28.0 mmmt -113.05 155.36 25.0 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.078 -0.712 . . . . 61.22 109.078 178.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.4 p -128.45 108.82 10.86 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.001 0.429 . . . . 74.54 110.889 175.533 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.468 ' CD2' HD13 ' A' ' 66' ' ' LEU . 87.2 m-85 -121.17 123.69 42.9 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.94 -0.573 . . . . 64.1 111.27 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.7 p -116.82 -17.27 10.51 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.396 -0.82 . . . . 74.31 109.527 174.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -106.97 127.3 53.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.472 -0.786 . . . . 70.34 110.526 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.5 tt -65.35 -44.06 88.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.996 -0.547 . . . . 72.42 110.328 -176.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.548 ' O ' ' HG3' ' A' ' 68' ' ' LYS . 47.9 tp60 -58.55 -41.48 85.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.095 -0.502 . . . . 75.1 110.84 -177.748 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.7 m -62.91 -45.76 90.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.12 -0.491 . . . . 74.31 111.011 178.503 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.468 HD13 ' CD2' ' A' ' 60' ' ' PHE . 55.2 tp -70.35 -31.8 69.24 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 75.43 110.888 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.432 ' HG2' ' HG ' ' A' ' 84' ' ' LEU . 3.4 tmm_? -62.79 -29.22 70.54 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.173 -0.467 . . . . 72.31 110.378 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.548 ' HG3' ' O ' ' A' ' 64' ' ' GLN . 91.5 mttt -70.02 -46.16 65.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.352 0.596 . . . . 61.14 110.599 176.6 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -67.28 -48.8 66.6 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.186 -0.915 . . . . 73.53 110.956 -176.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.1 -26.69 67.58 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.17 -0.468 . . . . 72.22 111.636 -177.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 35.9 t -75.97 -23.53 55.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.559 -0.291 . . . . 63.15 111.472 -178.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -102.82 2.01 34.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.328 0.585 . . . . 74.34 110.299 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.559 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 28.2 mmmt -103.5 101.12 11.0 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.216 -0.902 . . . . 73.34 109.751 175.604 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.4 p -55.83 -33.32 64.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.04 0.448 . . . . 71.13 111.07 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.455 ' O ' HD13 ' A' ' 79' ' ' LEU . 3.0 m -62.34 -45.64 92.3 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.727 -0.669 . . . . 72.53 110.937 177.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 82.0 mtp -90.95 -13.51 33.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.159 -0.473 . . . . 74.12 111.482 -174.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.638 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 33.6 ttpt -75.24 -9.05 58.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.778 0.323 . . . . 62.05 110.709 -176.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -99.06 -5.06 31.0 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.904 0.859 . . . . 73.54 109.492 174.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.714 ' HB3' HG21 ' B' ' 133' ' ' ILE . 10.7 mp -97.62 -55.92 2.67 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.442 -1.254 . . . . 74.34 109.42 176.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.811 ' HB3' HD13 ' A' ' 84' ' ' LEU . 3.8 mm? -81.19 -7.79 59.63 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 114.806 -1.088 . . . . 74.42 112.111 -176.254 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.638 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 64.8 pttt -55.05 -20.22 9.03 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.812 0.339 . . . . 75.4 111.729 178.012 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -69.24 -33.69 73.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.348 -0.387 . . . . 74.22 111.219 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.531 HG12 ' CZ2' ' B' ' 127' ' ' TRP . 27.0 m -115.9 -8.3 12.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.018 0.377 . . . . 54.14 112.018 -175.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.811 HD13 ' HB3' ' A' ' 80' ' ' LEU . 8.3 mp -96.75 138.14 21.39 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.464 -0.334 . . . . 61.24 110.823 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 84' ' ' LEU . 18.9 Cg_exo -66.38 107.44 1.2 Allowed 'Trans proline' 0 C--O 1.235 0.36 0 C-N-CA 122.71 2.273 . . . . 71.5 111.289 174.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -122.26 176.91 5.6 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.23 0.538 . . . . 70.35 110.78 -176.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -116.84 -45.84 2.76 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.218 -0.901 . . . . 73.24 109.835 175.151 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 . . . . . 0 C--O 1.235 0.312 0 CA-C-N 115.896 -0.593 . . . . 63.43 110.288 -178.994 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 N-CA-C 111.987 -0.445 . . . . 73.25 111.987 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 29.6 m -111.97 154.34 13.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.722 0.296 . . . . 45.51 110.621 179.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.38 129.54 39.1 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.51 -0.552 . . . . 73.5 109.51 179.349 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 10.3 mtm -84.17 85.46 7.35 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.652 -0.703 . . . . 72.43 110.789 -174.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -115.96 143.87 44.85 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.299 -0.41 . . . . 74.12 110.758 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -119.86 138.32 53.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.178 -0.465 . . . . 73.34 110.224 177.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -137.03 -118.37 1.72 Allowed Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.696 -0.764 . . . . 61.41 112.528 -178.605 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -117.3 143.79 45.56 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.874 0.368 . . . . 64.32 110.973 -178.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.408 ' HB ' ' H ' ' B' ' 110' ' ' LEU . 16.7 m -85.33 -158.87 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.599 -0.728 . . . . 71.21 110.816 178.579 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 110' ' ' LEU . . . . . 0.62 ' H ' HD12 ' B' ' 110' ' ' LEU . 5.7 mp -55.16 103.79 0.1 Allowed 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 110.14 -0.319 . . . . 61.43 110.14 177.187 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 26.4 m -119.65 129.71 54.71 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.419 -0.355 . . . . 70.03 111.21 -175.264 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 112' ' ' LEU . . . . . 0.439 HD23 ' N ' ' B' ' 113' ' ' ALA . 3.6 tt -91.07 132.7 35.86 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.941 -0.763 . . . . 55.15 108.941 175.538 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 113' ' ' ALA . . . . . 0.666 ' HB3' ' O ' ' B' ' 116' ' ' LEU . . . -73.67 -68.06 0.54 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.379 -0.373 . . . . 64.1 111.72 -175.571 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -144.62 -69.0 0.3 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.974 0.416 . . . . 74.43 110.674 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -105.03 -38.61 6.53 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 107.965 -1.124 . . . . 62.22 107.965 173.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.666 ' O ' ' HB3' ' B' ' 113' ' ' ALA . 5.4 mp -128.65 -170.47 2.27 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 107.035 -1.469 . . . . 75.02 107.035 169.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.447 ' HA ' ' CB ' ' B' ' 113' ' ' ALA . 44.6 m -96.29 53.78 1.36 Allowed 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.003 0.906 . . . . 65.41 109.322 173.593 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 16.5 t -82.11 96.82 7.91 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 114.587 -1.188 . . . . 74.12 110.167 -178.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -122.1 140.15 52.87 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.309 -0.405 . . . . 64.05 110.639 -179.143 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 1.4 m -66.57 -70.48 0.24 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.423 0.63 . . . . 51.24 110.706 -179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 121' ' ' LEU . . . . . 0.404 ' HA ' HD13 ' B' ' 121' ' ' LEU . 3.3 mm? -128.46 134.33 48.71 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 114.935 -1.03 . . . . 74.34 109.725 176.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -88.38 146.77 25.08 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 110.012 -0.366 . . . . 64.31 110.012 177.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 13.6 tt -79.06 -19.82 12.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.299 -0.41 . . . . 70.13 111.544 -175.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 14.4 m -87.36 100.52 12.78 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.984 0.421 . . . . 53.41 111.212 -175.241 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 125' ' ' LYS . . . . . 0.73 ' HD3' ' H ' ' B' ' 125' ' ' LYS . 0.3 OUTLIER -94.34 9.81 36.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.515 0.674 . . . . 51.32 109.594 172.394 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -79.32 130.7 35.71 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.291 -1.003 . . . . 60.02 108.291 173.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 127' ' ' TRP . . . . . 0.531 ' CZ2' HG12 ' A' ' 83' ' ' VAL . 29.0 t-105 -103.84 -93.16 0.34 Allowed 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.432 -0.507 . . . . 74.2 110.717 -173.589 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 128' ' ' SER . . . . . 0.412 ' H ' ' HB3' ' B' ' 127' ' ' TRP . 41.8 m 52.25 24.12 2.69 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.01 0.433 . . . . 72.22 111.9 -179.203 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -80.81 83.26 6.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.245 -0.434 . . . . 74.14 110.913 -174.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 57.4 t -128.31 -64.12 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.945 -0.57 . . . . 53.3 110.859 -179.488 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 29.7 p90 -63.44 -20.7 65.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.588 -0.733 . . . . 73.44 111.569 -177.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.439 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 30.0 t30 -58.13 -54.55 45.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.855 -0.612 . . . . 70.4 111.079 -179.288 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 133' ' ' ILE . . . . . 0.714 HG21 ' HB3' ' A' ' 79' ' ' LEU . 4.1 mp -62.0 -40.57 87.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.138 0.494 . . . . 73.41 110.651 -177.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 89.9 mt -64.27 -31.38 72.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.928 -0.578 . . . . 64.34 111.142 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 54.2 ttt-85 -70.52 -45.02 66.36 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.113 0.482 . . . . 72.01 110.359 177.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 136' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 14.6 mm-40 -66.25 -33.08 74.94 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.587 -0.733 . . . . 73.12 111.58 -176.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -100.22 7.99 44.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.707 0.289 . . . . 74.43 111.22 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 56.16 68.16 0.9 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.718 -0.673 . . . . 73.14 112.639 175.169 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 139' ' ' PHE . . . . . 0.432 ' O ' ' HB2' ' A' ' 51' ' ' PHE . 11.4 m-85 -97.96 1.86 48.4 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.996 -0.547 . . . . 75.15 110.377 173.262 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 66.81 71.57 0.44 Allowed Pre-proline 0 CA--C 1.534 0.362 0 O-C-N 123.886 0.741 . . . . 74.5 110.696 -178.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -74.18 160.3 42.7 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.648 2.232 . . . . 61.12 111.689 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 142' ' ' LYS . . . . . 0.442 ' HB3' ' H ' ' B' ' 143' ' ' PHE . 11.4 mptt -108.36 -156.23 0.58 Allowed 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.151 0.426 . . . . 71.31 112.151 -176.109 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 143' ' ' PHE . . . . . 0.442 ' H ' ' HB3' ' B' ' 142' ' ' LYS . 17.7 m-85 -50.4 123.23 8.23 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.308 -0.86 . . . . 74.22 112.343 -171.698 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -83.88 57.22 4.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.954 -0.566 . . . . 72.25 109.636 174.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 8.2 t 68.71 8.76 6.94 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.133 -0.94 . . . . 74.42 110.738 -176.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -103.21 108.64 19.92 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.736 -0.665 . . . . 65.34 109.442 177.162 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 147' ' ' VAL . . . . . 0.451 ' CG1' ' HA ' ' A' ' 45' ' ' CYS . 5.9 p -148.25 162.46 6.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 C-N-CA 120.909 -0.316 . . . . 74.12 110.566 -174.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -95.09 150.57 20.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.206 0.527 . . . . 54.44 110.648 -177.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.573 HD11 ' HB3' ' A' ' 31' ' ' PHE . 23.5 tp -98.2 15.11 25.43 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.402 -0.817 . . . . 74.44 109.02 172.663 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.706 ' HB2' HG22 ' B' ' 159' ' ' THR . . . -34.61 104.11 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 O-C-N 124.317 1.011 . . . . 65.14 113.242 -173.29 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 151' ' ' PHE . . . . . 0.576 ' HB3' ' HA ' ' A' ' 41' ' ' PRO . 50.5 p90 -119.04 174.23 6.43 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 114.921 -1.036 . . . . 73.55 109.543 -177.576 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -100.56 123.45 44.79 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.146 0.498 . . . . 70.41 111.578 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 153' ' ' CYS . . . . . 0.553 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 49.8 t -124.8 116.59 22.53 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.399 -0.819 . . . . 74.5 109.229 174.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 63.29 17.58 10.36 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.462 -0.335 . . . . 72.04 111.469 178.542 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 110.44 -29.59 8.96 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.641 -0.79 . . . . 73.2 112.714 178.217 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 156' ' ' GLU . . . . . 0.637 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 12.7 pt-20 -93.79 146.66 23.71 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.051 0.453 . . . . 64.15 110.677 -177.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.7 mm -85.06 120.17 35.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.227 -0.442 . . . . 61.41 110.162 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 158' ' ' LYS . . . . . 0.637 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 28.4 mmmt -102.54 120.03 39.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.458 -0.337 . . . . 74.31 110.267 -178.262 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 159' ' ' THR . . . . . 0.706 HG22 ' HB2' ' B' ' 150' ' ' ALA . 2.5 p -95.69 110.52 22.64 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.118 -0.492 . . . . 61.42 112.164 -176.631 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 160' ' ' PHE . . . . . 0.588 ' CD2' HD13 ' B' ' 166' ' ' LEU . 61.5 m-85 -132.65 151.94 51.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.709 -0.678 . . . . 73.04 110.192 176.577 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 13.2 p -134.03 14.11 3.92 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.049 -0.523 . . . . 71.4 110.006 176.154 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -146.96 144.59 29.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.757 -0.656 . . . . 74.02 110.598 -176.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 163' ' ' LEU . . . . . 0.447 ' O ' HD13 ' B' ' 163' ' ' LEU . 2.6 tm? -78.19 -34.28 49.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.456 . . . . 75.52 110.679 -175.304 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -67.17 -46.77 73.0 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.688 0.28 . . . . 74.03 110.496 -178.411 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 41.8 m -61.42 -39.12 89.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.359 -0.382 . . . . 62.52 110.86 177.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 166' ' ' LEU . . . . . 0.588 HD13 ' CD2' ' B' ' 160' ' ' PHE . 62.5 tp -71.47 -31.83 67.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.423 -0.353 . . . . 71.34 110.858 179.678 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 21.5 ttm180 -57.5 -39.35 76.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.356 -0.384 . . . . 74.31 110.543 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -60.11 -51.95 67.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.942 -0.572 . . . . 75.22 110.591 177.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 169' ' ' PHE . . . . . 0.434 ' CZ ' ' HE2' ' B' ' 158' ' ' LYS . 73.9 t80 -66.16 -43.6 86.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.261 -0.881 . . . . 74.32 111.074 -176.039 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -59.9 -40.89 90.3 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.121 -0.491 . . . . 63.15 111.977 -177.395 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 12.8 t -78.54 -21.32 48.95 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.759 0.281 . . . . 73.03 111.759 -174.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -93.96 -13.53 26.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.193 0.521 . . . . 72.11 110.617 179.137 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 173' ' ' LYS . . . . . 0.553 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 27.7 mmmt -88.59 117.16 27.35 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.042 -0.526 . . . . 75.11 110.28 176.54 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 1.5 m -51.42 -46.26 62.89 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 123.449 0.468 . . . . 62.02 110.96 -179.095 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 5.4 m -67.26 -43.87 80.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.897 -0.592 . . . . 63.52 111.556 -179.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.429 ' HA ' HD12 ' B' ' 179' ' ' LEU . 73.5 mtp -80.09 -22.39 42.27 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.779 0.323 . . . . 73.52 111.712 -174.52 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 177' ' ' LYS . . . . . 0.455 ' HE2' ' HB3' ' B' ' 177' ' ' LYS . 33.8 ttpt -58.37 -38.94 78.28 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.02 -0.536 . . . . 75.45 110.851 -177.573 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -86.1 -3.23 58.91 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.644 0.735 . . . . 63.45 110.063 -174.089 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 179' ' ' LEU . . . . . 0.551 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 78.1 mt -94.48 -42.13 9.01 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 114.89 -1.05 . . . . 74.24 109.667 179.372 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 180' ' ' LEU . . . . . 0.631 ' HB3' HD13 ' B' ' 184' ' ' LEU . 4.0 mm? -96.38 -9.84 29.04 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.608 -0.724 . . . . 54.22 111.929 -176.29 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 181' ' ' LYS . . . . . 0.44 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 65.5 pttt -55.52 -17.61 5.7 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.838 0.681 . . . . 51.1 112.838 -177.606 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -70.9 -38.53 73.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.859 0.361 . . . . 43.23 110.687 179.494 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 183' ' ' VAL . . . . . 0.407 HG21 ' ND2' ' A' ' 29' ' ' ASN . 31.5 m -107.67 -10.35 10.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.259 -0.428 . . . . 54.43 111.365 -176.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 184' ' ' LEU . . . . . 0.631 HD13 ' HB3' ' B' ' 180' ' ' LEU . 9.3 mp -99.6 147.21 33.06 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.272 -0.422 . . . . 64.24 110.316 177.498 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -69.2 96.24 0.54 Allowed 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 122.576 2.184 . . . . 52.42 112.413 178.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 -116.85 133.63 55.77 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.889 -0.782 . . . . 73.42 108.889 178.001 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -104.52 -52.25 2.93 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.101 -0.499 . . . . 73.24 111.238 -173.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 . . . . . 0 C--O 1.245 0.841 0 CA-C-O 118.217 -0.897 . . . . 71.31 110.287 -178.612 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.657 0 N-CA-C 111.593 -0.603 . . . . 53.02 111.593 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.7 p -126.44 -22.8 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 121.354 0.597 . . . . 70.01 109.824 177.315 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 88.0 mt -102.74 -174.83 2.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.602 -0.726 . . . . 74.03 109.926 177.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 19.3 ptp -130.19 80.63 1.96 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.575 0.702 . . . . 74.03 110.419 176.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -94.68 132.07 39.8 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.602 -0.726 . . . . 65.04 109.983 176.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -123.63 136.3 54.42 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.931 -0.577 . . . . 72.23 109.72 179.33 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -92.12 -152.85 29.24 Favored Glycine 0 N--CA 1.44 -1.039 0 C-N-CA 120.536 -0.84 . . . . 71.44 111.907 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -161.65 169.41 21.63 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 110.262 -0.273 . . . . 75.32 110.262 -177.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 61.7 t -76.61 115.43 18.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.165 -0.47 . . . . 74.22 109.829 175.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.708 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.7 OUTLIER -90.4 106.96 18.85 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.115 0.484 . . . . 70.22 110.567 -178.573 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 31.8 m -144.4 112.57 6.4 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.139 -0.482 . . . . 74.54 110.231 178.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 31.5 tp -78.37 127.98 32.98 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.287 -0.415 . . . . 75.34 110.817 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.751 ' CB ' ' HA ' ' A' ' 17' ' ' SER . . . 58.23 55.25 5.21 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 115.19 -0.914 . . . . 71.01 112.452 174.034 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.41 ' O ' ' HB3' ' A' ' 15' ' ' ASP . . . -80.98 90.68 5.97 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 115.65 -0.705 . . . . 75.4 109.855 173.107 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.41 ' HB3' ' O ' ' A' ' 14' ' ' ALA . 25.1 t70 78.31 -47.09 0.44 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.876 -1.057 . . . . 64.45 111.664 174.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.6 mt -76.89 -32.89 57.75 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.867 0.365 . . . . 75.33 111.008 -178.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.751 ' HA ' ' CB ' ' A' ' 13' ' ' ALA . 17.4 m 56.61 36.04 27.02 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.602 -0.727 . . . . 63.22 111.356 -177.784 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.3 t 60.33 101.7 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.739 -1.118 . . . . 53.41 111.136 -174.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.51 -13.19 49.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.251 0.548 . . . . 33.41 110.017 177.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 23.8 m -78.35 144.67 35.79 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.494 -0.776 . . . . 74.14 110.029 176.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 21' ' ' LEU . 4.1 mm? -69.22 116.53 9.76 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.995 0.426 . . . . 74.43 110.856 -178.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -70.18 134.06 47.72 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.679 -0.691 . . . . 63.25 110.721 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 13.9 tt -82.14 135.06 25.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.139 -0.482 . . . . 72.42 110.719 -178.269 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.2 m -60.97 126.32 26.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.951 -0.568 . . . . 70.13 110.914 179.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.571 ' H ' ' HD2' ' A' ' 25' ' ' LYS . 2.2 mptp? -87.41 1.88 52.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.071 0.462 . . . . 32.32 110.114 -178.641 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -63.79 132.98 52.59 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.364 -0.835 . . . . 74.42 110.253 -176.423 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -86.18 84.98 7.35 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.731 -0.668 . . . . 71.11 111.538 -172.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.6 m 53.8 69.41 0.71 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.612 -0.722 . . . . 64.1 111.235 176.179 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -97.05 17.07 17.84 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.772 -0.649 . . . . 72.41 110.119 -176.226 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 17.0 m -59.17 130.97 23.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.624 -0.716 . . . . 75.23 110.947 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.47 ' HB2' ' HB3' ' A' ' 41' ' ' PRO . 22.6 p90 51.42 12.01 0.14 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.77 1.228 . . . . 62.22 113.918 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.486 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 9.4 t30 -66.35 -53.09 40.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.878 0.37 . . . . 71.11 110.307 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.564 HG21 ' HB3' ' B' ' 179' ' ' LEU . 45.8 mm -58.07 -43.7 85.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.87 -0.604 . . . . 63.15 110.616 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.657 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 64.7 mt -60.3 -42.06 94.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.695 -0.684 . . . . 73.35 111.252 179.358 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -64.61 -42.43 95.54 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.408 -0.36 . . . . 75.4 110.185 -179.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 38.8 mm-40 -65.75 -32.81 74.56 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.257 -0.429 . . . . 72.54 111.32 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -99.67 7.16 45.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.947 0.403 . . . . 54.35 111.064 -178.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 56.65 54.63 7.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.433 -0.803 . . . . 75.4 112.278 177.003 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.657 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 7.9 m-85 -84.45 -7.94 59.12 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.13 -0.693 . . . . 73.2 109.13 168.271 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 64.15 88.14 0.12 Allowed Pre-proline 0 N--CA 1.455 -0.18 0 CA-C-N 114.633 -1.167 . . . . 72.12 111.685 179.558 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.47 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 51.1 Cg_endo -70.28 148.36 61.51 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.56 2.174 . . . . 75.42 111.362 175.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.633 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 3.6 tptp -85.85 -177.25 6.3 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 119.848 -0.741 . . . . 74.41 110.846 -179.306 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.677 ' HA ' HG11 ' B' ' 147' ' ' VAL . 12.7 t80 177.83 -33.23 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.847 -0.615 . . . . 52.45 110.059 -167.42 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.24 106.76 0.19 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.356 -0.838 . . . . 53.44 109.403 178.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.411 ' HB2' ' HB ' ' B' ' 147' ' ' VAL . 1.7 t -163.84 175.28 10.59 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.754 -0.832 . . . . 75.12 108.754 -173.247 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.504 ' CD ' ' H ' ' A' ' 46' ' ' GLU . 0.1 OUTLIER -86.57 53.73 2.91 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.657 0.741 . . . . 72.11 109.861 176.608 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.514 HG22 ' HB3' ' B' ' 145' ' ' CYS . 57.3 t -61.11 139.45 20.38 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 CA-C-N 115.217 -0.901 . . . . 75.45 109.466 176.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.586 ' O ' ' HB3' ' B' ' 142' ' ' LYS . 3.8 mptt -72.65 164.16 26.94 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 109.099 -0.704 . . . . 73.34 109.099 178.304 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.786 HD21 HD12 ' B' ' 134' ' ' LEU . 46.2 tp -111.26 78.87 1.15 Allowed 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 109.225 -0.657 . . . . 74.2 109.225 169.501 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.867 ' H ' ' HB2' ' B' ' 142' ' ' LYS . . . -90.95 83.33 5.64 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.196 -0.911 . . . . 74.21 109.506 176.051 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.538 ' HD1' ' HG ' ' A' ' 49' ' ' LEU . 31.2 p90 -103.53 170.94 7.64 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.427 -0.806 . . . . 65.53 109.732 -178.033 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -98.24 127.51 44.22 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 120.324 -0.55 . . . . 71.33 110.177 177.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.5 ' SG ' ' HE2' ' A' ' 69' ' ' PHE . 29.8 t -133.5 108.81 8.86 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.895 -0.593 . . . . 72.04 109.567 175.762 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 70.82 27.06 3.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.321 -0.854 . . . . 52.32 110.627 176.82 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 103.68 -36.48 4.32 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.482 -0.866 . . . . 71.34 112.771 177.234 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.469 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 10.7 pt-20 -91.77 148.95 21.86 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.211 0.529 . . . . 75.23 110.673 -178.616 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 50.7 mm -86.16 127.27 40.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.481 -0.781 . . . . 65.03 109.652 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.68 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 29.2 mmmt -112.58 128.26 56.31 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.421 -0.354 . . . . 55.32 110.331 -176.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.33 109.37 21.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.007 0.432 . . . . 70.24 111.189 179.15 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.68 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 35.5 m-85 -118.82 148.4 42.9 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.129 -0.487 . . . . 73.53 110.472 178.567 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 11.7 p -138.17 6.58 2.6 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.184 -0.462 . . . . 43.23 110.939 176.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -142.43 144.01 32.88 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.879 -0.415 . . . . 73.41 109.879 179.041 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.472 ' O ' HD13 ' A' ' 63' ' ' LEU . 1.4 tm? -72.11 -32.33 66.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.25 -0.432 . . . . 72.22 110.244 -179.355 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.43 ' NE2' HH21 ' A' ' 67' ' ' ARG . 7.0 tp60 -64.8 -44.98 88.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.97 0.414 . . . . 50.31 110.355 -178.066 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.4 m -64.69 -38.32 90.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.789 -0.641 . . . . 62.02 110.181 178.103 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.484 ' HA ' ' CE2' ' A' ' 60' ' ' PHE . 47.3 tp -70.83 -36.17 72.78 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.764 -0.653 . . . . 73.43 111.178 -177.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.43 HH21 ' NE2' ' A' ' 64' ' ' GLN . 56.8 ttp85 -54.48 -45.62 73.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.09 0.471 . . . . 72.42 111.2 178.843 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 39.0 mtmt -66.23 -38.6 88.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.983 -0.553 . . . . 72.24 111.076 -176.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.5 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 55.8 t80 -74.44 -39.32 62.64 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.239 0.542 . . . . 73.23 110.443 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.69 -23.89 66.18 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.013 -0.539 . . . . 73.4 111.449 179.139 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.1 t -74.94 -38.84 61.66 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.522 -0.308 . . . . 73.13 111.128 -179.156 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 20.6 pt20 -74.8 -28.2 60.62 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.006 0.431 . . . . 55.13 110.237 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.435 ' HE3' ' HB3' ' A' ' 73' ' ' LYS . 25.8 mmmt -79.23 109.9 13.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.942 -0.572 . . . . 73.11 110.68 176.192 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.5 p -61.53 -29.75 70.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.376 -0.374 . . . . 71.21 111.737 -176.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.7 p -76.4 -45.57 31.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.951 0.405 . . . . 63.22 110.973 178.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 81.2 mtp -71.42 -26.32 62.7 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.34 -0.391 . . . . 51.44 110.634 -178.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.536 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 26.1 ttpp -56.44 -29.3 61.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.906 -0.588 . . . . 74.54 111.081 177.704 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -96.36 -4.69 41.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.292 0.568 . . . . 73.14 110.641 -176.077 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.596 ' HB3' ' CG2' ' B' ' 133' ' ' ILE . 84.3 mt -91.97 -46.95 7.55 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.314 -0.857 . . . . 64.22 109.421 177.546 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.78 -11.6 53.12 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.318 -0.856 . . . . 53.24 111.693 -177.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.536 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 62.6 pttt -60.17 -18.59 49.04 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.372 0.508 . . . . 72.41 112.372 -177.509 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.53 -44.53 86.58 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.128 0.489 . . . . 61.45 110.399 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.442 HG11 ' OD1' ' B' ' 129' ' ' ASN . 23.1 m -98.46 -11.1 8.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.83 -0.623 . . . . 71.54 111.107 -177.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.9 mt -110.0 94.26 17.22 Favored Pre-proline 0 C--N 1.325 -0.497 0 N-CA-C 109.334 -0.617 . . . . 72.43 109.334 174.134 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -69.01 104.2 1.16 Allowed 'Trans proline' 0 C--O 1.235 0.334 0 C-N-CA 122.804 2.336 . . . . 72.15 112.168 -178.186 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -90.39 86.44 6.46 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.342 0.592 . . . . 73.42 111.676 -175.054 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 52.8 mttp -104.9 -56.92 2.1 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.492 -0.776 . . . . 50.32 109.325 169.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 . . . . . 0 C--N 1.324 -0.529 0 CA-C-N 115.701 -0.682 . . . . 75.41 110.461 179.112 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 N-CA-C 111.969 -0.453 . . . . 75.24 111.969 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 27.9 m -90.8 2.41 7.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.035 0.445 . . . . 63.35 111.007 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 85.0 mt -95.36 108.63 20.83 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.901 -0.59 . . . . 63.34 109.613 177.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 19.0 ptp -82.13 79.96 8.49 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.614 0.721 . . . . 64.15 111.841 -174.23 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -176.91 124.12 0.15 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.069 -0.969 . . . . 75.02 109.814 176.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -90.79 123.07 34.06 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.175 -0.466 . . . . 71.21 110.145 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -81.74 95.85 1.74 Allowed Glycine 0 N--CA 1.442 -0.958 0 CA-C-N 115.836 -0.62 . . . . 61.32 112.178 -176.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -82.91 158.59 22.58 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 110.041 -0.355 . . . . 60.51 110.041 176.292 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 30.6 m -81.3 147.09 6.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-O 120.825 0.345 . . . . 73.32 110.639 179.033 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 110' ' ' LEU . . . . . 0.742 ' H ' HD23 ' B' ' 110' ' ' LEU . 2.5 pt? -94.54 131.59 40.11 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.179 0.514 . . . . 73.15 110.713 -177.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 24.6 m -103.46 112.41 25.3 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.024 -0.534 . . . . 74.44 109.814 176.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 40.7 tp -67.21 115.08 6.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.166 -0.47 . . . . 72.21 110.327 176.331 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . 56.35 -152.39 0.38 Allowed 'General case' 0 C--N 1.331 -0.234 0 O-C-N 123.89 0.744 . . . . 70.25 110.959 -179.077 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -175.23 -62.2 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.635 -0.876 . . . . 72.45 108.635 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -153.99 29.53 0.46 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.141 -0.936 . . . . 75.13 108.768 173.452 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 99.7 mt -137.94 -8.99 1.58 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.205 -0.907 . . . . 72.24 111.392 -177.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 42.4 m 56.87 25.56 10.59 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.106 0.563 . . . . 61.51 112.301 -176.115 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 49.1 m 65.87 139.59 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.526 0.679 . . . . 44.21 112.509 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -95.23 10.92 34.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.958 -0.564 . . . . 53.04 110.367 178.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 15.0 m -96.73 135.58 38.46 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.795 -0.639 . . . . 64.22 110.668 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -86.86 136.13 33.08 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.918 0.39 . . . . 65.01 110.635 178.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.82 146.1 54.79 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.788 -0.642 . . . . 71.02 111.35 -178.033 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 13.1 tt -91.08 133.06 33.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 109.931 -0.396 . . . . 63.14 109.931 176.242 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 13.2 m -66.89 115.7 6.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.417 -0.356 . . . . 70.33 111.528 -174.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 125' ' ' LYS . . . . . 0.495 ' H ' ' HD2' ' B' ' 125' ' ' LYS . 1.5 mptp? -83.82 -2.27 56.04 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.362 0.601 . . . . 62.22 109.841 177.145 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 28.2 mp0 -92.68 97.38 10.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.437 -0.801 . . . . 73.14 110.168 -178.146 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 34.2 m95 -72.94 -45.88 55.63 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.663 -0.699 . . . . 75.22 110.449 -177.391 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 68.0 m -82.94 43.52 0.86 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.9 -0.591 . . . . 71.2 111.426 -176.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 129' ' ' ASN . . . . . 0.442 ' OD1' HG11 ' A' ' 83' ' ' VAL . 13.7 t30 -102.88 -26.87 12.96 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.636 0.255 . . . . 70.04 110.602 176.345 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.417 HG12 ' CD2' ' B' ' 131' ' ' PHE . 32.8 t -57.47 117.05 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 73.13 110.692 -177.294 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 131' ' ' PHE . . . . . 0.51 ' HB3' HD22 ' A' ' 49' ' ' LEU . 22.1 p90 52.67 10.63 0.15 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.955 1.302 . . . . 54.52 113.426 -178.209 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.472 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 8.9 t30 -69.98 -44.31 69.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.522 0.201 . . . . 72.24 110.844 -177.296 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 133' ' ' ILE . . . . . 0.596 ' CG2' ' HB3' ' A' ' 79' ' ' LEU . 50.3 mm -58.24 -43.54 86.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.395 0.617 . . . . 64.31 110.414 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.786 HD12 HD21 ' A' ' 49' ' ' LEU . 61.1 mt -67.4 -29.98 69.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.616 -0.72 . . . . 53.24 110.711 178.194 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -71.82 -41.56 68.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.988 -0.551 . . . . 74.51 110.1 178.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 136' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 11.1 mm-40 -66.7 -37.17 84.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.922 -0.581 . . . . 74.24 111.461 179.454 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -96.42 -0.64 48.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.468 -0.333 . . . . 74.13 111.36 -176.332 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 38.4 t70 58.34 69.24 0.75 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.648 0.737 . . . . 65.42 112.043 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 139' ' ' PHE . . . . . 0.564 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 3.2 m-85 -97.54 7.34 46.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.529 -0.759 . . . . 70.25 109.501 170.745 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 140' ' ' GLU . . . . . 0.413 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 33.7 tt0 62.14 79.15 0.28 Allowed Pre-proline 0 C--N 1.332 -0.177 0 CA-C-N 114.61 -1.177 . . . . 74.55 111.046 -176.563 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.51 156.34 66.53 Favored 'Trans proline' 0 N--CA 1.464 -0.242 0 C-N-CA 122.388 2.059 . . . . 74.05 110.33 173.74 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 142' ' ' LYS . . . . . 0.867 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 23.3 tptt -83.2 174.32 10.87 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 119.296 -0.962 . . . . 73.32 110.548 -178.075 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 143' ' ' PHE . . . . . 0.471 ' HA ' HG11 ' A' ' 47' ' ' VAL . 58.2 t80 -168.36 -33.79 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.688 -0.687 . . . . 74.2 110.279 -170.399 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 56.7 tp -62.97 95.31 0.08 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.206 -0.906 . . . . 75.44 111.087 179.469 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 145' ' ' CYS . . . . . 0.514 ' HB3' HG22 ' A' ' 47' ' ' VAL . 49.1 t -154.79 159.13 40.4 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.734 -0.667 . . . . 53.31 109.29 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -90.15 81.45 6.15 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.433 0.635 . . . . 75.04 110.791 -177.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 147' ' ' VAL . . . . . 0.677 HG11 ' HA ' ' A' ' 43' ' ' PHE . 3.0 p -96.92 152.02 4.02 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.366 -0.834 . . . . 72.13 108.983 173.672 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 148' ' ' LYS . . . . . 0.508 ' H ' ' HD2' ' B' ' 148' ' ' LYS . 0.0 OUTLIER -81.86 132.29 35.27 Favored 'General case' 0 CA--C 1.509 -0.618 0 C-N-CA 120.006 -0.678 . . . . 63.41 109.341 -176.031 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.65 ' HG ' ' HD1' ' B' ' 151' ' ' PHE . 56.5 tp -75.11 83.52 2.32 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.263 0.554 . . . . 70.23 109.678 177.314 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.633 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -91.5 76.9 5.8 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.289 -0.869 . . . . 60.11 109.863 177.475 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 151' ' ' PHE . . . . . 0.65 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 42.3 p90 -94.01 167.87 11.32 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.52 -0.764 . . . . 73.31 110.323 -176.122 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -99.58 113.89 26.59 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 121.248 0.547 . . . . 61.24 110.66 179.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 153' ' ' CYS . . . . . 0.59 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 44.1 t -110.22 102.47 11.14 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.507 -0.769 . . . . 74.31 110.098 179.377 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 15.0 t70 68.91 17.93 8.59 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 115.545 -0.752 . . . . 73.01 111.234 175.133 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 122.26 -34.73 3.72 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.204 -0.998 . . . . 63.41 112.882 177.258 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -94.61 150.16 20.51 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.624 0.249 . . . . 64.11 110.611 -178.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.9 mm -84.23 131.39 34.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 109.899 -0.408 . . . . 74.05 109.899 175.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 158' ' ' LYS . . . . . 0.606 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 31.8 mmmt -120.98 129.81 53.57 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.032 -0.358 . . . . 74.35 110.032 178.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.83 107.14 17.88 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.102 0.477 . . . . 63.3 111.85 -176.444 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 160' ' ' PHE . . . . . 0.606 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 42.6 m-85 -120.47 135.54 55.03 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.18 -0.463 . . . . 75.32 110.78 178.477 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 31.4 p -120.7 10.12 10.92 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.103 0.478 . . . . 53.14 110.461 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -144.2 138.76 28.29 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.829 -0.623 . . . . 73.42 110.543 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 163' ' ' LEU . . . . . 0.409 HD22 ' HA ' ' B' ' 163' ' ' LEU . 1.8 tm? -74.77 -39.31 61.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.864 -0.607 . . . . 63.51 110.275 -176.82 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -60.8 -45.67 93.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.086 0.469 . . . . 61.32 110.64 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 165' ' ' SER . . . . . 0.578 ' HA ' ' HE2' ' B' ' 168' ' ' LYS . 23.8 m -60.71 -38.21 84.29 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.815 -0.629 . . . . 73.23 110.63 176.282 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 53.3 tp -70.55 -32.08 69.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.093 -0.503 . . . . 70.11 111.091 -178.151 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -59.45 -38.27 80.29 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.666 0.27 . . . . 71.33 110.504 177.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 168' ' ' LYS . . . . . 0.578 ' HE2' ' HA ' ' B' ' 165' ' ' SER . 56.9 mtmt -61.6 -46.58 89.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.274 0.559 . . . . 63.14 110.588 177.498 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 169' ' ' PHE . . . . . 0.518 ' O ' ' HG2' ' B' ' 172' ' ' GLN . 66.9 t80 -66.67 -43.41 84.57 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.406 -0.816 . . . . 72.53 110.327 -179.465 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -60.8 -36.13 78.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.002 -0.545 . . . . 74.43 111.2 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 45.3 m -74.62 -22.25 59.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.487 -0.324 . . . . 65.44 111.849 -176.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 172' ' ' GLN . . . . . 0.518 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 13.7 pt20 -95.54 -7.73 37.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.091 0.472 . . . . 70.55 110.454 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 173' ' ' LYS . . . . . 0.59 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 30.1 mmmt -96.86 119.56 35.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.858 -0.61 . . . . 72.54 110.138 179.18 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 24.1 m -56.51 -37.59 70.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.99 0.424 . . . . 64.24 110.805 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 11.2 p -76.02 -49.83 16.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.678 -0.692 . . . . 73.52 111.521 -178.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.519 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 81.1 mtp -74.57 -22.3 59.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.092 -0.504 . . . . 74.34 111.996 -173.363 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -62.63 -25.91 68.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.136 0.493 . . . . 63.41 111.014 -178.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -103.27 8.31 38.33 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.612 0.72 . . . . 74.45 110.544 -177.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 179' ' ' LEU . . . . . 0.564 ' HB3' HG21 ' A' ' 33' ' ' ILE . 97.3 mt -103.31 -49.36 3.74 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.049 -0.978 . . . . 74.44 110.28 176.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 180' ' ' LEU . . . . . 0.528 ' HB3' HD12 ' B' ' 184' ' ' LEU . 4.0 mm? -85.05 -17.91 35.97 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.671 -0.695 . . . . 72.14 112.312 -174.1 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 59.2 pttt -64.26 -20.55 66.13 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.69 0.281 . . . . 73.34 111.665 -174.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -67.92 -47.99 67.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.977 0.418 . . . . 74.12 110.548 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 183' ' ' VAL . . . . . 0.439 HG23 ' HG ' ' B' ' 184' ' ' LEU . 31.4 m -91.82 -21.58 6.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.955 -0.566 . . . . 71.34 111.279 -177.377 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 184' ' ' LEU . . . . . 0.528 HD12 ' HB3' ' B' ' 180' ' ' LEU . 87.7 mt -110.08 101.91 49.1 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 109.147 -0.686 . . . . 62.42 109.147 176.779 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.06 109.17 0.34 Allowed 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 123.226 2.617 . . . . 42.05 112.84 -174.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -120.16 96.27 5.09 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.855 -0.611 . . . . 63.3 110.33 176.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -106.15 -58.26 1.94 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.153 -0.684 . . . . 62.1 109.153 175.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 . . . . . 0 C--O 1.245 0.83 0 CA-C-N 115.386 -0.825 . . . . 53.15 109.604 178.869 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.544 0 N-CA-C 112.363 -0.295 . . . . 64.45 112.363 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.512 HG22 HD22 ' A' ' 3' ' ' LEU . 7.3 p -73.12 -38.54 55.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.69 -0.485 . . . . 61.14 109.69 176.798 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.512 HD22 HG22 ' A' ' 2' ' ' VAL . 2.9 mm? -128.0 103.63 7.34 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.598 -0.89 . . . . 73.24 108.598 171.405 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 80.5 mtp -80.97 -64.4 1.2 Allowed 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.198 -0.456 . . . . 72.31 110.837 -173.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -125.3 161.47 26.88 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.183 -0.462 . . . . 72.23 110.275 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -164.76 102.01 0.79 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.433 -0.58 . . . . 41.34 109.433 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -148.04 99.75 0.2 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.66 -0.781 . . . . 62.3 112.747 -177.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -86.78 118.0 25.9 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.727 0.298 . . . . 31.43 110.706 178.139 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.9 t -90.92 127.1 43.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 120.79 0.328 . . . . 73.14 110.769 -178.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -88.27 143.64 26.91 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.508 -0.553 . . . . 63.53 109.508 176.163 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 60.9 m -152.53 126.46 9.04 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.804 0.335 . . . . 64.35 111.483 -178.162 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.424 HD23 ' H ' ' A' ' 13' ' ' ALA . 0.5 OUTLIER -150.23 148.15 28.55 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.408 -0.59 . . . . 73.42 109.408 176.328 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.435 ' HB3' ' CB ' ' A' ' 17' ' ' SER . . . -94.63 116.67 29.04 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.822 0.344 . . . . 73.05 110.354 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.486 ' O ' ' HB2' ' A' ' 18' ' ' SER . . . -69.18 -57.38 5.45 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.945 -0.571 . . . . 62.33 111.966 -176.015 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -99.72 -22.1 15.52 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.905 -0.318 . . . . 74.12 111.419 -173.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 75.7 mt -96.85 15.78 21.14 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.036 0.384 . . . . 70.33 112.036 -176.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.435 ' CB ' ' HB3' ' A' ' 13' ' ' ALA . 15.1 t -160.23 -52.65 0.05 Allowed 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 121.097 -0.241 . . . . 70.44 110.974 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.881 ' HB3' ' HE3' ' B' ' 177' ' ' LYS . 30.0 m -74.42 113.14 11.31 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.038 0.447 . . . . 63.52 112.145 -176.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -155.9 -151.2 0.33 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.738 -0.664 . . . . 53.22 109.395 175.112 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.1 m -152.37 96.75 2.2 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.631 -0.507 . . . . 54.22 109.631 172.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 66.8 mt -105.3 -37.63 6.79 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.116 -0.493 . . . . 75.35 111.921 -176.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -104.14 175.3 5.53 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.659 -0.701 . . . . 71.51 110.418 -174.089 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 5.6 tp -106.58 118.02 53.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.477 0.656 . . . . 73.31 111.384 -176.114 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.473 ' HB3' ' HA ' ' B' ' 184' ' ' LEU . 5.4 m -65.25 138.98 58.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.555 -0.748 . . . . 70.42 110.452 177.5 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.511 ' N ' ' HD2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -118.83 13.47 13.18 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.438 0.533 . . . . 75.34 112.438 -174.522 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.586 ' HB2' ' O ' ' B' ' 183' ' ' VAL . 2.8 mp0 -99.49 146.12 26.72 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.818 -0.438 . . . . 72.52 109.818 176.721 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 12.6 t-105 -115.93 12.17 15.67 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.212 0.449 . . . . 63.44 112.212 -170.147 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.4 p -81.78 32.68 0.37 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.348 0.594 . . . . 73.43 111.46 -177.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -90.57 1.26 56.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.964 -0.562 . . . . 73.42 110.132 -174.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.0 m -71.15 83.54 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 112.355 0.502 . . . . 70.22 112.355 -177.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.604 ' HB3' HD13 ' B' ' 149' ' ' LEU . 36.0 p90 48.89 12.28 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 125.223 1.409 . . . . 75.33 114.549 175.265 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -67.28 -57.17 7.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.839 0.352 . . . . 75.01 111.618 -175.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.498 HG21 ' HB3' ' B' ' 179' ' ' LEU . 48.7 mm -62.38 -37.81 79.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.367 0.603 . . . . 73.03 111.136 -177.245 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.4 mt -59.2 -33.15 70.62 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.332 -0.849 . . . . 64.51 111.551 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 51.4 ttt180 -68.56 -46.87 68.33 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.07 0.462 . . . . 71.22 110.406 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -69.04 -27.68 65.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.396 -0.82 . . . . 75.44 111.645 -173.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -106.61 6.83 30.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.548 -0.296 . . . . 71.34 111.19 -177.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.2 t70 58.55 69.89 0.69 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 115.494 -0.776 . . . . 75.53 111.919 175.062 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -98.76 3.13 47.48 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.697 -0.683 . . . . 74.42 111.037 172.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 58.02 71.37 1.06 Allowed Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 115.943 -0.571 . . . . 73.41 110.783 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -87.31 166.7 7.92 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.616 2.211 . . . . 61.52 112.505 -178.571 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.779 ' HB2' ' HA ' ' B' ' 149' ' ' LEU . 0.2 OUTLIER -105.93 -167.12 1.27 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.333 -0.394 . . . . 73.21 110.413 177.319 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 32.6 p90 -132.61 179.11 6.34 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.251 0.463 . . . . 74.11 112.251 -170.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.632 ' HA ' HG11 ' B' ' 147' ' ' VAL . 3.3 mm? -97.92 142.21 29.94 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.218 -1.03 . . . . 73.22 108.218 169.489 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 11.6 t -130.95 -151.68 0.48 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.772 0.32 . . . . 74.21 110.735 -170.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -135.86 144.44 45.62 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 109.101 -0.703 . . . . 73.54 109.101 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.769 HG11 HD13 ' B' ' 144' ' ' LEU . 1.9 t -91.88 129.26 42.81 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-O 121.516 0.674 . . . . 73.53 110.106 172.189 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.448 ' HD2' ' O ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -128.66 129.21 45.52 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.995 -1.002 . . . . 53.14 109.59 178.226 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.79 ' HA ' ' HB2' ' B' ' 142' ' ' LYS . 0.2 OUTLIER -75.71 90.96 2.87 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 120.492 -0.483 . . . . 75.41 109.815 178.21 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.16 90.58 1.58 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.506 -0.77 . . . . 62.21 109.348 173.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.437 ' HA ' ' O ' ' B' ' 140' ' ' GLU . 53.9 p90 -107.16 166.84 10.33 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.525 -0.761 . . . . 63.23 110.514 -177.438 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.82 ' HE2' ' HA2' ' A' ' 55' ' ' GLY . 82.3 tttt -105.93 113.0 26.28 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.628 -0.715 . . . . 72.03 109.928 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.619 ' SG ' ' HE3' ' A' ' 73' ' ' LYS . 53.6 t -100.13 93.54 5.77 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.9 -0.591 . . . . 62.32 110.032 -179.248 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.9 t70 70.91 -9.09 0.87 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.664 0.745 . . . . 74.52 111.609 176.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.82 ' HA2' ' HE2' ' A' ' 52' ' ' LYS . . . 150.39 -27.25 1.09 Allowed Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.677 -0.692 . . . . 64.01 112.276 -178.497 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 53' ' ' CYS . 11.7 pt-20 -91.88 130.06 37.72 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.743 0.306 . . . . 75.53 110.695 -179.055 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.6 mm -80.9 122.38 36.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.682 -0.488 . . . . 74.21 109.682 177.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.598 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 30.6 mmmt -120.62 131.08 54.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.449 -0.342 . . . . 73.02 110.444 -177.744 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.1 p -101.09 113.73 27.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.068 0.461 . . . . 73.5 111.311 177.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.598 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 22.6 m-85 -120.85 139.48 53.11 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.892 -0.595 . . . . 71.34 110.825 178.504 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.4 t -120.85 -24.24 5.71 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.833 -0.803 . . . . 60.44 108.833 176.013 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -101.38 137.3 39.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.261 -0.881 . . . . 51.21 109.658 179.249 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.7 mt -83.25 -31.55 26.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.958 0.408 . . . . 64.14 110.701 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -69.39 -36.84 77.18 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.467 -0.333 . . . . 74.33 110.312 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.1 m -70.61 -32.71 70.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.032 0.444 . . . . 65.4 110.331 176.248 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.482 ' HA ' ' CE2' ' A' ' 60' ' ' PHE . 3.5 tm? -67.82 -42.16 81.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.719 -0.673 . . . . 62.41 109.721 177.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -33.6 70.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.466 -0.788 . . . . 74.53 110.128 -179.658 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -65.43 -47.84 74.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.651 -0.704 . . . . 70.44 111.057 176.255 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -63.35 -40.28 96.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.666 -0.697 . . . . 65.12 110.886 -175.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.8 -22.88 66.0 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.486 -0.325 . . . . 63.53 111.155 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.1 m -76.05 -20.73 57.5 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.302 -0.408 . . . . 73.54 111.673 -178.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -100.01 3.19 44.07 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.197 0.522 . . . . 75.41 110.724 178.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.619 ' HE3' ' SG ' ' A' ' 53' ' ' CYS . 70.6 mmtt -108.5 109.68 21.0 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.665 -0.698 . . . . 64.54 110.184 178.358 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.9 m -58.35 -32.41 68.51 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.823 0.344 . . . . 75.11 111.131 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.446 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 8.1 m -76.36 -37.96 56.52 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.304 -0.407 . . . . 71.41 111.251 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.578 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 77.4 mtp -86.35 -22.33 26.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.881 0.372 . . . . 71.04 111.566 -175.557 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -62.25 -30.0 70.8 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.994 -0.548 . . . . 62.44 111.981 -175.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -103.92 3.47 33.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.552 0.691 . . . . 72.33 110.319 -178.696 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 75' ' ' SER . 63.9 mt -86.52 -51.35 6.23 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.352 -0.84 . . . . 73.23 108.761 170.567 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.85 -7.66 56.98 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.88 -1.055 . . . . 73.0 111.393 -177.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.464 ' HE3' ' HB2' ' A' ' 81' ' ' LYS . 19.0 ptmt -57.85 -19.12 26.7 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.115 0.413 . . . . 71.33 112.115 -177.668 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -74.12 -43.77 56.31 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.998 -0.281 . . . . 62.01 110.773 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.438 ' O ' ' HB2' ' B' ' 126' ' ' GLN . 32.7 m -91.41 -20.16 6.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.084 0.469 . . . . 63.45 110.909 -179.441 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 40.9 mt -101.39 101.6 17.83 Favored Pre-proline 0 C--N 1.326 -0.453 0 N-CA-C 108.991 -0.744 . . . . 75.23 108.991 175.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -61.34 112.42 1.41 Allowed 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 123.086 2.524 . . . . 64.31 113.711 -171.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 -99.33 121.58 41.29 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 108.608 -0.886 . . . . 64.24 108.608 174.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.727 ' HD2' ' HB2' ' B' ' 122' ' ' ASP . 24.8 mtpt -61.78 -55.89 25.25 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.374 -0.83 . . . . 75.24 111.891 -171.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 . . . . . 0 C--N 1.324 -0.521 0 CA-C-N 116.65 -0.25 . . . . 75.43 110.501 -178.875 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 N-CA-C 111.973 -0.451 . . . . 43.14 111.973 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 8.2 p -135.76 137.81 48.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.897 0.38 . . . . 62.54 110.8 -179.402 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -80.21 101.37 8.81 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.354 -0.61 . . . . 74.01 109.354 176.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 87.6 mtp -87.92 -54.77 4.07 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.545 -0.752 . . . . 62.3 111.47 -174.423 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -94.19 173.41 7.66 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.399 0.619 . . . . 75.43 111.758 -173.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -136.65 128.38 28.96 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 107.811 -1.181 . . . . 75.13 107.811 177.601 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -143.17 86.45 0.18 Allowed Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.11 -1.043 . . . . 71.4 113.018 -174.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -105.32 94.7 5.36 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.74 -0.467 . . . . 54.54 109.74 173.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 46.9 t -110.84 111.51 36.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.988 -0.551 . . . . 74.33 110.316 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -91.59 104.27 16.77 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.242 -0.436 . . . . 64.3 110.225 -178.382 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 87.9 m -99.93 113.5 26.11 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.289 0.566 . . . . 74.31 111.115 -179.436 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 1.4 tt -141.02 140.43 34.3 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.639 -1.245 . . . . 74.42 107.639 175.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 113' ' ' ALA . . . . . 0.768 ' HB1' ' HB2' ' B' ' 116' ' ' LEU . . . -62.29 108.67 1.13 Allowed 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 121.079 -0.249 . . . . 34.22 110.449 177.596 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.97 97.04 0.15 Allowed 'General case' 0 C--N 1.323 -0.547 0 O-C-N 123.45 0.469 . . . . 31.34 111.017 -177.306 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 31.8 t70 84.48 -21.91 0.23 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.355 -1.293 . . . . 75.24 110.887 170.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.768 ' HB2' ' HB1' ' B' ' 113' ' ' ALA . 51.1 mt -69.08 -52.95 23.13 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.596 -0.729 . . . . 73.32 110.125 177.184 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.58 ' HB3' ' HB3' ' B' ' 113' ' ' ALA . 47.1 t -103.12 -28.15 12.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.989 -0.551 . . . . 71.24 110.738 -179.582 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 41.7 p -78.32 77.37 4.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.243 0.544 . . . . 72.42 110.603 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -143.93 -179.05 6.24 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.669 -0.696 . . . . 31.32 109.939 179.34 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 49.6 m -108.78 112.28 24.47 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.167 -0.679 . . . . 64.4 109.167 174.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 76.3 mt -103.59 -61.3 1.44 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.363 0.601 . . . . 75.11 112.598 -170.036 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 122' ' ' ASP . . . . . 0.727 ' HB2' ' HD2' ' A' ' 87' ' ' LYS . 1.8 t70 -105.6 -162.8 0.89 Allowed 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.132 -0.94 . . . . 74.4 111.152 -170.731 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 123' ' ' ILE . . . . . 0.574 HG13 ' H ' ' B' ' 124' ' ' SER . 11.2 tp -92.91 173.09 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.019 -0.537 . . . . 72.21 110.164 -179.032 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.574 ' H ' HG13 ' B' ' 123' ' ' ILE . 24.2 m -121.88 139.23 53.9 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.427 -0.583 . . . . 74.32 109.427 179.206 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -132.81 2.7 3.73 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.723 0.638 . . . . 74.42 112.723 -175.491 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 126' ' ' GLN . . . . . 0.438 ' HB2' ' O ' ' A' ' 83' ' ' VAL . 2.8 mp0 -87.91 133.07 34.0 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 110.05 -0.352 . . . . 71.31 110.05 177.753 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 127' ' ' TRP . . . . . 0.419 ' C ' ' H ' ' B' ' 129' ' ' ASN . 42.5 t-105 -92.34 -2.49 56.35 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.939 -0.573 . . . . 65.25 110.41 -174.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 32.3 t -75.75 19.29 0.21 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.774 -0.648 . . . . 62.21 111.309 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 129' ' ' ASN . . . . . 0.419 ' H ' ' C ' ' B' ' 127' ' ' TRP . 27.8 t-20 -81.03 -18.64 46.09 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.23 -0.441 . . . . 72.35 110.975 -178.699 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.412 ' O ' HG13 ' B' ' 130' ' ' VAL . 7.5 p -59.69 89.9 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-O 121.65 0.738 . . . . 65.52 112.876 -173.179 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 131' ' ' PHE . . . . . 0.672 ' HB3' HD13 ' A' ' 49' ' ' LEU . 24.6 p90 44.38 21.17 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.494 1.517 . . . . 63.45 114.086 179.367 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -68.31 -61.55 1.79 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.95 0.405 . . . . 71.21 110.854 -178.014 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 133' ' ' ILE . . . . . . . . . . . . . 49.0 mm -60.06 -38.44 76.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.902 -0.59 . . . . 74.32 111.044 -177.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 70.0 mt -56.46 -37.41 70.26 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.545 -0.752 . . . . 73.52 111.158 177.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -69.45 -42.72 74.56 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.3 -0.409 . . . . 62.44 110.906 -178.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -69.93 -29.45 66.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.916 -0.584 . . . . 61.24 111.533 -175.497 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -98.47 -0.14 44.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.035 0.445 . . . . 60.43 110.677 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 26.4 t70 61.84 64.01 1.06 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.05 -0.977 . . . . 74.53 111.515 177.28 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -91.36 2.97 56.01 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.283 -0.871 . . . . 75.54 110.372 171.487 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 140' ' ' GLU . . . . . 0.437 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 14.7 tp10 61.71 63.41 2.23 Favored Pre-proline 0 CA--C 1.538 0.49 0 CA-C-N 115.948 -0.569 . . . . 75.15 111.397 178.617 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.4 163.47 34.41 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.262 1.975 . . . . 71.23 111.204 177.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 142' ' ' LYS . . . . . 0.823 ' HA ' ' HE3' ' B' ' 142' ' ' LYS . 0.0 OUTLIER -99.22 -159.57 0.75 Allowed 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.81 -0.356 . . . . 75.24 111.372 -176.896 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 143' ' ' PHE . . . . . 0.446 ' CD1' ' HB2' ' B' ' 145' ' ' CYS . 5.2 p90 -138.39 160.99 38.1 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 113.081 0.771 . . . . 60.01 113.081 -165.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 144' ' ' LEU . . . . . 0.769 HD13 HG11 ' A' ' 47' ' ' VAL . 3.3 mm? -82.83 81.89 8.37 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.149 -0.932 . . . . 55.5 109.28 175.193 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 145' ' ' CYS . . . . . 0.458 ' H ' HG21 ' A' ' 47' ' ' VAL . 9.1 t -80.69 -160.92 0.34 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.04 -0.527 . . . . 60.42 110.695 -177.49 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -143.02 148.58 36.99 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 107.626 -1.25 . . . . 74.31 107.626 -175.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 147' ' ' VAL . . . . . 0.632 HG11 ' HA ' ' A' ' 44' ' ' LEU . 9.0 p -120.29 150.14 23.01 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.221 0 C-N-CA 120.039 -0.664 . . . . 65.23 109.476 175.745 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 148' ' ' LYS . . . . . 0.581 ' H ' ' HD3' ' B' ' 148' ' ' LYS . 0.0 OUTLIER -138.0 144.84 41.28 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.108 -0.496 . . . . 74.42 110.22 -170.435 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.779 ' HA ' ' HB2' ' A' ' 42' ' ' LYS . 0.5 OUTLIER -78.29 86.2 4.4 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 109.285 -0.635 . . . . 72.52 109.285 174.525 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -78.56 91.28 4.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.242 -0.89 . . . . 55.24 109.295 175.002 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 151' ' ' PHE . . . . . 0.445 ' CE2' ' HB2' ' B' ' 153' ' ' CYS . 52.6 p90 -108.57 164.7 12.12 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.08 -0.509 . . . . 72.11 110.736 -175.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 152' ' ' LYS . . . . . 0.738 ' HE2' ' HA2' ' B' ' 155' ' ' GLY . 78.0 tttt -92.9 104.92 17.12 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.762 -0.654 . . . . 71.13 110.015 179.232 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 153' ' ' CYS . . . . . 0.796 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 36.8 t -93.45 92.26 7.54 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.352 -0.84 . . . . 71.22 110.607 -174.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 16.8 t70 66.44 6.89 4.62 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.762 -0.654 . . . . 74.53 111.294 174.391 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 155' ' ' GLY . . . . . 0.738 ' HA2' ' HE2' ' B' ' 152' ' ' LYS . . . 138.53 -32.65 2.29 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.966 -0.635 . . . . 73.53 112.348 -179.623 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 156' ' ' GLU . . . . . 0.492 ' OE1' ' HD3' ' B' ' 158' ' ' LYS . 16.0 pt-20 -98.06 135.18 40.11 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.502 0.191 . . . . 71.03 110.665 -177.637 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 46.7 mm -77.48 120.14 27.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.54 -0.541 . . . . 64.14 109.54 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 158' ' ' LYS . . . . . 0.524 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 32.3 mmmt -117.17 123.58 47.04 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.81 0.338 . . . . 63.0 110.621 -177.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 159' ' ' THR . . . . . 0.495 HG22 ' CG ' ' B' ' 148' ' ' LYS . 0.3 OUTLIER -93.94 107.67 19.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.095 -0.502 . . . . 73.5 111.005 178.567 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 160' ' ' PHE . . . . . 0.524 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 57.3 m-85 -115.13 123.79 49.85 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.329 0.585 . . . . 74.42 111.482 179.126 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 23.3 t -120.79 10.75 11.01 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 107.665 -1.235 . . . . 71.23 107.665 171.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -129.7 110.39 11.74 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.36 -1.291 . . . . 63.24 109.476 -177.322 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -69.52 -32.96 72.11 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.486 -0.324 . . . . 71.12 111.087 -176.608 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -68.44 -45.8 71.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.847 0.356 . . . . 73.42 110.458 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 49.8 m -64.27 -30.78 71.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.215 -0.448 . . . . 55.42 110.485 176.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 166' ' ' LEU . . . . . 0.441 ' HA ' ' CE2' ' B' ' 160' ' ' PHE . 61.5 tp -68.1 -39.98 82.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.489 . . . . 64.12 110.69 177.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -59.55 -38.68 81.72 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.251 -0.431 . . . . 75.25 110.648 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -58.66 -54.84 42.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.294 0.569 . . . . 75.44 110.575 176.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 169' ' ' PHE . . . . . 0.605 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 57.0 t80 -66.56 -44.86 81.17 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.944 -1.025 . . . . 74.44 111.584 -172.273 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.4 -29.49 70.53 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 111.948 0.351 . . . . 73.2 111.948 -178.274 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 3.7 t -80.65 -23.55 39.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.754 0.312 . . . . 63.22 110.96 -175.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -95.27 -15.81 22.91 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.82 0.343 . . . . 71.03 111.102 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 173' ' ' LYS . . . . . 0.796 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 25.6 mmmt -78.41 116.25 18.68 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.522 -0.547 . . . . 73.24 109.522 173.617 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 22.0 t -59.51 -33.87 71.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.356 -0.384 . . . . 54.31 111.412 -174.382 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 175' ' ' SER . . . . . 0.43 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 5.1 p -78.97 -40.98 30.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.768 0.318 . . . . 71.42 111.291 179.643 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.556 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 70.3 mtp -75.21 -27.29 59.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.566 -0.288 . . . . 71.54 111.667 -177.608 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 177' ' ' LYS . . . . . 0.881 ' HE3' ' HB3' ' A' ' 18' ' ' SER . 45.8 tttm -52.79 -40.26 63.05 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.284 -0.416 . . . . 74.12 111.625 -178.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -92.33 -2.99 56.04 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.561 0.695 . . . . 64.23 110.051 -173.632 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 179' ' ' LEU . . . . . 0.498 ' HB3' HG21 ' A' ' 33' ' ' ILE . 60.1 mt -88.7 -47.72 8.04 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.014 -0.994 . . . . 41.44 108.92 173.637 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 180' ' ' LEU . . . . . 0.465 HD13 HG13 ' A' ' 33' ' ' ILE . 4.1 mm? -86.62 -7.94 57.9 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.881 -1.054 . . . . 72.34 111.689 -176.096 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 181' ' ' LYS . . . . . 0.42 ' HE3' ' HB2' ' B' ' 181' ' ' LYS . 18.1 ptmt -53.21 -23.16 7.95 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.499 0.555 . . . . 72.32 112.499 -178.866 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -72.41 -40.85 66.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.239 0.543 . . . . 64.31 110.174 177.491 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 183' ' ' VAL . . . . . 0.586 ' O ' ' HB2' ' A' ' 26' ' ' GLN . 47.5 t -82.14 -35.71 13.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.77 0.795 . . . . 72.14 109.934 178.72 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 184' ' ' LEU . . . . . 0.473 ' HA ' ' HB3' ' A' ' 24' ' ' SER . 30.8 mt -110.54 89.3 8.72 Favored Pre-proline 0 C--N 1.316 -0.85 0 CA-C-N 115.104 -0.953 . . . . 72.43 109.47 -178.667 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 185' ' ' PRO . . . . . 0.582 ' HD3' ' O ' ' B' ' 183' ' ' VAL . 21.7 Cg_exo -65.74 91.77 0.24 Allowed 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 122.51 2.14 . . . . 74.42 111.372 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 186' ' ' GLN . . . . . 0.616 HE22 ' HG3' ' B' ' 177' ' ' LYS . 61.1 mt-30 -81.86 87.47 6.38 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.356 -0.838 . . . . 73.52 110.167 -179.62 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -50.52 -47.3 57.46 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 114.793 -1.094 . . . . 71.11 110.124 178.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 117.875 -1.059 . . . . 74.33 108.953 171.254 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.711 0 N-CA-C 112.383 -0.287 . . . . 55.12 112.383 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 47.5 t -102.5 -45.84 10.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 109.395 -0.594 . . . . 52.22 109.395 176.411 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 pp -157.12 171.47 20.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.096 -0.956 . . . . 74.31 109.294 177.18 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 88.9 mmm 58.48 36.91 25.6 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.325 0.583 . . . . 73.12 109.725 -175.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -103.17 133.15 48.74 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.475 -0.784 . . . . 71.41 111.854 -170.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -145.71 105.09 3.94 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.222 -0.899 . . . . 55.3 108.893 172.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -120.89 104.17 0.95 Allowed Glycine 0 N--CA 1.442 -0.903 0 C-N-CA 120.628 -0.796 . . . . 61.53 112.174 -176.318 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -86.15 94.74 9.36 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.128 0.49 . . . . 73.14 110.232 178.039 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 21.8 t -87.38 78.23 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.323 0.582 . . . . 72.51 110.202 -177.085 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.5 mp -128.84 157.83 40.41 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.313 -0.858 . . . . 65.34 108.923 176.058 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.6 t -145.14 152.98 40.9 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.565 -0.454 . . . . 73.54 110.52 179.257 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -146.99 117.13 7.3 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 108.261 -1.014 . . . . 75.34 108.261 178.574 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.37 118.35 18.97 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.454 -0.339 . . . . 52.54 111.149 -176.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.85 98.48 2.0 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.512 -0.551 . . . . 52.23 109.512 172.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.8 t70 79.92 -43.29 0.26 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 114.957 -1.019 . . . . 70.03 112.279 173.284 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.4 mt -52.08 -79.95 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.016 0.747 . . . . 74.23 113.016 -175.266 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.0 m -81.04 -15.55 55.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.992 0.425 . . . . 74.52 111.475 -176.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.7 m -88.73 15.29 8.48 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.177 -0.465 . . . . 73.35 110.725 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -71.48 153.03 42.52 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.953 -0.567 . . . . 72.44 111.549 -179.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 12.0 t -156.52 164.87 37.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.962 -0.563 . . . . 71.1 109.558 178.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 43.6 mt -121.71 152.19 39.68 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.165 0.507 . . . . 73.11 111.166 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -124.44 129.76 51.25 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.63 -0.713 . . . . 75.45 109.253 175.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.458 ' HA ' ' NE2' ' B' ' 164' ' ' GLN . 11.4 tt -104.0 108.72 25.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-O 121.699 0.762 . . . . 72.55 110.712 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 45.4 m -129.96 150.49 51.22 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.237 -0.892 . . . . 61.1 110.941 -178.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.934 ' HD3' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -81.48 86.3 6.35 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.348 -0.842 . . . . 64.23 110.047 178.596 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -97.14 178.6 5.2 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.438 -0.801 . . . . 72.25 110.809 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -123.0 -162.74 1.05 Allowed 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 120.707 0.289 . . . . 60.53 110.464 -176.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.409 ' C ' ' H ' ' A' ' 30' ' ' VAL . 4.7 t -108.24 19.21 20.18 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.027 0.441 . . . . 43.11 111.168 -173.137 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.475 ' OD1' ' HB3' ' A' ' 32' ' ' ASN . 64.0 t30 -72.92 6.98 2.25 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.471 0.653 . . . . 63.24 110.858 178.596 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.478 HG23 HD22 ' B' ' 166' ' ' LEU . 6.2 p -57.35 -42.65 80.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 CA-C-N 115.479 -0.782 . . . . 74.22 112.639 -175.491 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 11.2 p90 -90.87 -13.4 33.75 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.338 0.495 . . . . 73.12 112.338 -173.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.475 ' HB3' ' OD1' ' A' ' 29' ' ' ASN . 8.1 t30 -73.3 -52.27 14.54 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.999 -0.28 . . . . 74.25 111.073 -175.359 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.537 HG21 ' HB3' ' B' ' 179' ' ' LEU . 43.3 mm -55.56 -45.33 78.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.22 0.533 . . . . 43.31 111.338 -178.457 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.032 HD12 HD21 ' B' ' 149' ' ' LEU . 66.2 mt -66.78 -26.87 67.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.809 -0.632 . . . . 42.33 111.414 -176.332 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.472 ' HB2' ' HG3' ' A' ' 41' ' ' PRO . 1.0 OUTLIER -68.77 -40.34 79.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.785 0.326 . . . . 64.42 110.39 176.994 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -76.56 -23.82 53.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.106 0.479 . . . . 71.23 110.8 -177.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -100.54 4.3 43.43 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.017 -0.538 . . . . 71.52 110.906 -179.308 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.7 t70 56.11 58.59 4.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.507 -0.77 . . . . 74.21 111.85 177.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.615 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 5.8 m-85 -96.69 7.15 47.23 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.797 -0.638 . . . . 71.2 109.578 172.663 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.458 ' O ' ' HA ' ' B' ' 151' ' ' PHE . 30.7 tt0 61.55 80.03 0.26 Allowed Pre-proline 0 C--N 1.333 -0.117 0 CA-C-N 114.829 -1.078 . . . . 73.22 110.942 -178.389 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.472 ' HG3' ' HB2' ' A' ' 35' ' ' ARG . 69.3 Cg_endo -75.31 152.36 39.24 Favored 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.583 2.189 . . . . 73.31 111.966 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.651 ' H ' HD12 ' B' ' 149' ' ' LEU . 0.2 OUTLIER -108.81 152.07 25.38 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.785 -0.366 . . . . 74.02 110.675 -179.922 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 1.065 ' HA ' HG11 ' B' ' 147' ' ' VAL . 64.7 m-85 -155.74 -10.47 0.11 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.481 -0.781 . . . . 63.43 111.008 -170.57 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.406 ' H ' ' H ' ' A' ' 43' ' ' PHE . 7.0 mp -64.11 104.33 0.72 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.412 0.625 . . . . 72.1 110.543 -177.03 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.492 ' HB2' ' HB ' ' B' ' 147' ' ' VAL . 35.9 t -135.65 159.63 41.02 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.401 -0.818 . . . . 65.22 109.825 -175.133 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -66.51 100.59 0.68 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.468 -0.938 . . . . 70.13 108.468 173.017 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.891 HG22 ' H ' ' A' ' 48' ' ' LYS . 7.7 p -138.18 -161.87 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 115.183 -0.917 . . . . 75.4 109.527 -166.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.891 ' H ' HG22 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -105.73 124.74 50.05 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.421 -0.955 . . . . 75.22 108.421 176.377 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.683 HD11 ' HB3' ' B' ' 141' ' ' PRO . 12.5 tp -74.93 86.49 2.28 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.012 0.434 . . . . 75.24 109.961 -176.585 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.541 ' HB2' HG22 ' A' ' 59' ' ' THR . . . -88.17 103.85 16.15 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.488 -0.778 . . . . 63.32 110.255 177.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -125.7 169.89 12.09 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.101 -0.5 . . . . 64.53 110.088 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.435 ' HE3' HD11 ' A' ' 57' ' ' ILE . 32.2 ttmt -101.71 116.62 33.13 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.333 -0.394 . . . . 75.35 110.758 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.619 ' O ' ' HG2' ' A' ' 56' ' ' GLU . 52.7 t -116.18 104.12 11.21 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.937 -0.574 . . . . 33.32 110.365 179.288 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.8 t70 70.24 4.33 4.82 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.854 0.835 . . . . 61.15 110.805 175.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.12 -31.43 4.27 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.542 -0.753 . . . . 75.3 112.017 -179.488 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.619 ' HG2' ' O ' ' A' ' 53' ' ' CYS . 11.7 pt-20 -84.24 131.16 34.77 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.014 0.435 . . . . 74.21 110.082 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.435 HD11 ' HE3' ' A' ' 52' ' ' LYS . 41.1 mm -82.21 114.81 23.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.486 -0.561 . . . . 74.32 109.486 178.206 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.427 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 32.1 mmmt -109.63 129.72 55.57 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.23 -0.441 . . . . 73.14 111.187 -174.421 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.541 HG22 ' HB2' ' A' ' 50' ' ' ALA . 2.5 p -103.07 118.16 36.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.095 -0.502 . . . . 73.23 110.593 176.341 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.463 ' CD2' HD13 ' A' ' 66' ' ' LEU . 49.7 m-85 -129.72 121.36 26.75 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.206 0.527 . . . . 75.44 110.669 177.188 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.0 p -95.34 1.81 54.48 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.841 -0.618 . . . . 73.24 110.599 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -155.2 166.88 32.21 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.543 -0.753 . . . . 74.4 110.158 -178.305 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.603 ' HB3' ' HB3' ' B' ' 126' ' ' GLN . 2.8 tm? -87.6 -21.22 25.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.167 -0.469 . . . . 74.3 109.898 -177.752 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -62.88 -47.66 82.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.088 -0.506 . . . . 71.52 110.946 -177.525 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' A' ' 68' ' ' LYS . 12.2 t -71.31 -34.26 70.43 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.372 -0.376 . . . . 71.24 110.196 178.835 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.463 HD13 ' CD2' ' A' ' 60' ' ' PHE . 57.1 tp -68.45 -34.53 76.12 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 120.996 -0.281 . . . . 72.24 110.457 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.567 ' HG3' HD13 ' A' ' 84' ' ' LEU . 50.8 ttt180 -56.17 -46.33 79.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.231 0.539 . . . . 74.31 109.914 173.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.487 ' HE2' HD13 ' B' ' 121' ' ' LEU . 15.8 mmmt -57.57 -36.16 71.32 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.058 -0.974 . . . . 64.53 111.299 177.76 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.484 ' CE2' ' HE3' ' A' ' 73' ' ' LYS . 58.5 t80 -84.87 -44.19 13.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.742 -0.663 . . . . 74.11 111.511 -175.519 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.12 -22.21 63.98 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.46 -0.336 . . . . 64.5 111.364 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 14.2 t -74.71 -17.9 60.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.316 -0.402 . . . . 74.4 111.286 -178.303 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 13.0 pt20 -101.79 -8.94 21.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.229 0.538 . . . . 74.13 110.185 176.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.534 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 70.0 mmtt -94.0 104.34 16.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.704 -0.68 . . . . 73.4 109.631 176.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.5 m -53.42 -32.58 50.36 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.879 0.371 . . . . 75.12 111.713 -178.393 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 26.9 m -76.94 -45.13 28.82 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.813 0.339 . . . . 71.11 111.297 179.384 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.534 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 61.4 mtp -78.38 -17.09 56.93 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.901 0.382 . . . . 54.33 111.422 -175.764 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.475 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 12.9 tmtt? -63.97 -24.15 67.61 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.944 -0.571 . . . . 63.22 110.593 177.205 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.564 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 28.3 mm-40 -98.24 6.62 47.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.295 0.569 . . . . 52.35 110.287 -178.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.761 ' HB3' HG21 ' B' ' 133' ' ' ILE . 43.2 mt -100.59 -46.99 5.02 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.226 -0.897 . . . . 65.24 110.233 178.542 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -94.92 -0.39 53.99 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.939 -0.573 . . . . 54.03 111.052 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.564 ' HD2' ' HA ' ' A' ' 78' ' ' GLU . 20.5 ptmt -51.2 -21.31 1.96 Allowed 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.364 0.876 . . . . 75.5 113.364 -178.09 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -76.25 -46.67 27.03 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.801 0.334 . . . . 72.44 111.476 -178.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 29.2 m -89.19 -12.58 9.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.263 -0.426 . . . . 74.24 111.221 -175.505 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.567 HD13 ' HG3' ' A' ' 67' ' ' ARG . 80.3 mt -106.34 156.87 36.19 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 116.076 -0.511 . . . . 64.45 109.622 178.415 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -74.35 58.17 4.34 Favored 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 122.727 2.285 . . . . 70.33 111.706 177.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.458 ' OE1' ' HA ' ' A' ' 81' ' ' LYS . 96.6 mt-30 -111.78 95.45 5.5 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.963 -1.017 . . . . 71.14 110.362 -177.552 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 23.3 tttp -138.26 -34.96 0.63 Allowed 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.206 -0.906 . . . . 71.34 110.137 -178.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 115.833 -0.621 . . . . 42.24 110.911 177.111 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 N-CA-C 112.079 -0.408 . . . . 31.33 112.079 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 61.2 t -77.76 -41.74 28.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 121.275 0.56 . . . . 74.41 109.663 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 3.7 pp -129.86 168.9 15.89 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.345 -0.843 . . . . 64.43 109.601 177.097 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 86.9 mmm -92.48 91.0 7.41 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.014 0.435 . . . . 74.23 111.43 -178.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -98.04 116.31 29.99 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.175 -0.676 . . . . 74.23 109.175 170.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -101.15 104.73 15.83 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.507 -0.769 . . . . 72.55 110.194 -176.011 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -118.51 -135.58 5.26 Favored Glycine 0 N--CA 1.446 -0.675 0 CA-C-N 115.764 -0.653 . . . . 32.15 112.416 -179.072 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -139.21 122.14 16.66 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.82 0.343 . . . . 62.43 110.939 -177.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 43.6 t -87.77 -20.93 7.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.521 0.676 . . . . 55.11 110.089 178.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 9.1 mp -88.73 153.19 21.29 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.279 -0.873 . . . . 54.21 110.716 -178.157 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 7.2 t -151.45 160.2 43.84 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.073 -0.714 . . . . 71.05 109.073 176.347 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 112' ' ' LEU . . . . . 0.412 ' HA ' HD22 ' B' ' 112' ' ' LEU . 0.3 OUTLIER -131.91 127.08 35.69 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.814 -0.439 . . . . 75.34 109.814 -177.83 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.95 137.8 57.97 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 116.425 -0.352 . . . . 44.14 110.812 -179.07 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -98.09 100.14 11.44 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.193 -0.458 . . . . 75.1 110.511 177.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 16.1 t70 77.5 -32.05 0.17 Allowed 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 114.814 -1.084 . . . . 54.51 112.395 170.054 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 4.4 tt -69.05 -80.29 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.568 -0.287 . . . . 63.41 111.202 -175.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 21.3 m -79.59 -29.86 41.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.676 0.274 . . . . 63.15 111.463 -175.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 23.1 m -74.51 101.56 4.21 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.876 -0.416 . . . . 63.31 109.876 177.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -150.59 143.06 24.4 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.146 -0.479 . . . . 61.51 110.644 -177.215 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 31.2 m -138.35 125.37 21.33 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.194 -0.457 . . . . 63.35 109.979 175.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 121' ' ' LEU . . . . . 0.487 HD13 ' HE2' ' A' ' 68' ' ' LYS . 3.9 mm? -101.24 148.38 25.17 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.236 -0.438 . . . . 74.43 110.843 -178.591 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -139.76 146.9 40.09 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.975 -0.557 . . . . 64.03 110.032 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 12.8 tt -114.03 133.21 60.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.237 -0.438 . . . . 72.52 110.54 -179.102 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 63.1 m -147.34 170.85 16.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.15 -0.477 . . . . 73.21 111.111 -177.399 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 125' ' ' LYS . . . . . 0.814 ' HD3' ' H ' ' B' ' 125' ' ' LYS . 0.0 OUTLIER -85.2 81.67 8.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.665 0.745 . . . . 73.12 110.306 -179.771 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 126' ' ' GLN . . . . . 0.603 ' HB3' ' HB3' ' A' ' 63' ' ' LEU . 4.2 mm-40 -94.27 150.99 19.77 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.7 -0.682 . . . . 74.22 109.841 -179.793 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 38.5 m95 -116.26 -165.17 1.02 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.966 0.412 . . . . 73.21 111.145 -173.013 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 25.1 m -100.44 18.15 19.77 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.869 -0.605 . . . . 55.1 111.575 -172.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -84.13 23.43 1.06 Allowed 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.866 0.841 . . . . 72.42 110.011 179.031 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.457 HG23 HD23 ' A' ' 66' ' ' LEU . 2.9 p -74.15 -48.2 38.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.228 -0.896 . . . . 74.22 112.459 -174.526 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 34.9 p90 -78.52 -14.99 59.08 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 111.791 0.293 . . . . 72.3 111.791 -173.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.408 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 31.7 t30 -64.25 -58.64 5.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.524 -0.307 . . . . 43.43 111.178 -177.053 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 133' ' ' ILE . . . . . 0.761 HG21 ' HB3' ' A' ' 79' ' ' LEU . 27.3 mm -61.05 -38.95 80.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-O 121.194 0.521 . . . . 42.24 110.828 -176.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.613 ' HA ' ' HD2' ' B' ' 139' ' ' PHE . 51.6 mt -65.4 -33.28 75.59 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.67 -0.695 . . . . 73.24 111.235 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 42.2 ttt-85 -65.36 -48.23 73.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.146 0.498 . . . . 61.14 110.154 175.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 136' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 6.6 mm-40 -61.2 -42.03 97.87 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.149 -0.932 . . . . 72.14 111.616 -177.009 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -86.46 0.12 54.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.304 -0.407 . . . . 65.51 110.997 -179.612 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 15.6 t70 56.66 62.79 2.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.298 -0.864 . . . . 74.54 112.016 177.202 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 139' ' ' PHE . . . . . 0.613 ' HD2' ' HA ' ' B' ' 134' ' ' LEU . 75.3 m-85 -91.3 -4.5 55.82 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.06 -0.518 . . . . 73.42 110.394 169.604 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 60.1 84.67 0.2 Allowed Pre-proline 0 CA--C 1.529 0.157 0 CA-C-N 115.316 -0.857 . . . . 65.22 110.859 -176.62 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.683 ' HB3' HD11 ' A' ' 49' ' ' LEU . 17.6 Cg_exo -67.03 161.96 40.33 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 123.179 2.586 . . . . 72.12 112.092 177.655 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 142' ' ' LYS . . . . . 0.474 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 23.4 tptt -105.95 172.19 6.93 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.819 -0.352 . . . . 73.23 110.133 179.294 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 143' ' ' PHE . . . . . 0.817 ' HA ' HG11 ' A' ' 47' ' ' VAL . 3.2 m-85 -176.56 -35.01 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 122.982 0.513 . . . . 73.3 110.133 -170.755 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 9.8 mp -50.45 109.39 0.3 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.045 -0.979 . . . . 73.12 111.196 -177.428 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 38.2 t -160.14 -174.95 4.8 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.64 -0.874 . . . . 72.21 108.64 -177.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -71.29 106.74 3.96 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.686 -0.857 . . . . 74.15 108.686 174.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 147' ' ' VAL . . . . . 1.065 HG11 ' HA ' ' A' ' 43' ' ' PHE . 12.4 p -135.84 -158.46 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 CA-C-N 114.888 -1.051 . . . . 74.43 109.236 -168.228 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 148' ' ' LYS . . . . . 0.949 ' H ' HG22 ' B' ' 147' ' ' VAL . 0.1 OUTLIER -124.91 127.75 47.57 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.374 -0.602 . . . . 74.51 109.374 178.586 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 1.032 HD21 HD12 ' A' ' 34' ' ' LEU . 66.4 tp -77.32 92.57 3.92 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.519 -0.764 . . . . 71.31 110.811 -174.631 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.633 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -95.01 85.75 4.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.677 -0.692 . . . . 71.52 109.788 175.062 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 151' ' ' PHE . . . . . 0.592 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 45.4 p90 -102.54 171.95 7.14 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.876 -0.602 . . . . 75.31 110.349 -177.036 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -103.2 119.56 39.09 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.103 0.478 . . . . 75.14 110.625 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 153' ' ' CYS . . . . . 0.432 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 23.0 t -113.15 101.22 9.23 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.802 -0.636 . . . . 72.15 109.618 177.764 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 65.69 14.69 9.67 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.605 -0.725 . . . . 62.35 112.115 176.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 128.89 -32.82 3.21 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.103 -1.046 . . . . 70.01 112.84 177.26 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -100.2 142.13 32.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.145 0.498 . . . . 71.45 110.918 -177.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 157' ' ' ILE . . . . . 0.43 ' HA ' ' O ' ' B' ' 151' ' ' PHE . 49.1 mm -80.3 124.96 38.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.809 -0.632 . . . . 53.43 110.278 178.781 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 158' ' ' LYS . . . . . 0.448 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 26.7 mmmt -114.34 132.47 56.18 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.888 -0.412 . . . . 61.23 109.888 179.155 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.4 109.93 21.85 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.902 0.382 . . . . 72.14 111.667 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 160' ' ' PHE . . . . . 0.448 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 33.9 m-85 -119.8 128.99 54.22 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.047 -0.524 . . . . 73.34 110.438 177.853 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 2.9 p -100.85 -16.56 17.21 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.125 -0.489 . . . . 54.14 111.764 -178.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -139.37 164.44 29.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.924 0.392 . . . . 63.34 110.786 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 163' ' ' LEU . . . . . 0.458 ' O ' HD13 ' B' ' 163' ' ' LEU . 3.0 tm? -86.45 -25.29 25.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.763 -0.653 . . . . 73.42 110.251 -176.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 164' ' ' GLN . . . . . 0.458 ' NE2' ' HA ' ' A' ' 23' ' ' ILE . 51.3 tt0 -60.85 -46.76 89.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.011 0.434 . . . . 64.55 110.86 -177.575 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 14.2 m -68.63 -34.43 75.73 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.845 -0.616 . . . . 74.22 110.373 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 166' ' ' LEU . . . . . 0.478 HD22 HG23 ' A' ' 30' ' ' VAL . 42.8 tp -71.45 -26.95 62.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.915 -0.584 . . . . 72.21 110.615 -178.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -56.2 -43.35 78.41 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.664 -0.244 . . . . 70.33 110.681 177.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 28.0 mtmt -67.36 -43.15 82.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.033 0.444 . . . . 74.54 110.234 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 169' ' ' PHE . . . . . 0.582 ' O ' ' HG2' ' B' ' 173' ' ' LYS . 70.8 t80 -64.16 -45.9 86.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.516 -0.765 . . . . 72.34 110.54 -177.775 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -71.63 -28.62 63.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.101 -0.5 . . . . 61.45 111.286 -178.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 22.9 t -67.89 -32.89 73.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.622 -0.263 . . . . 63.24 111.127 -177.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -84.45 -16.04 43.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.872 0.368 . . . . 70.1 110.403 178.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 173' ' ' LYS . . . . . 0.582 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 31.6 mmmt -83.22 145.72 28.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.151 -0.477 . . . . 75.3 110.129 178.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 12.7 m -83.67 -44.79 14.14 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.284 0.564 . . . . 53.13 109.557 176.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 3.2 m -72.54 -40.29 66.86 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.52 -0.764 . . . . 63.23 111.504 -177.228 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.446 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 81.6 mtp -85.2 -17.85 35.86 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.391 0.515 . . . . 75.25 112.391 -172.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 177' ' ' LYS . . . . . 0.537 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 88.0 tttt -63.93 -31.06 72.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.979 0.419 . . . . 44.32 110.795 -178.696 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 178' ' ' GLU . . . . . 0.871 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 51.7 mm-40 -90.08 -0.3 57.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.521 0.677 . . . . 65.42 110.419 -175.356 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 179' ' ' LEU . . . . . 0.537 ' HB3' HG21 ' A' ' 33' ' ' ILE . 52.8 mt -94.78 -49.71 5.47 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.024 -0.989 . . . . 64.04 109.806 -179.244 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 180' ' ' LEU . . . . . 0.61 ' O ' ' HG ' ' B' ' 184' ' ' LEU . 3.4 mm? -88.89 -14.93 35.64 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.531 -0.759 . . . . 72.01 111.858 -176.542 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 181' ' ' LYS . . . . . 0.871 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 20.4 ptmt -53.89 -23.96 14.46 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 111.959 0.355 . . . . 73.51 111.959 -178.113 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -65.66 -23.75 66.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.022 -0.535 . . . . 71.53 111.942 -174.63 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 183' ' ' VAL . . . . . 0.426 HG11 HD22 ' A' ' 29' ' ' ASN . 19.3 m -124.88 3.34 4.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 112.201 0.445 . . . . 64.31 112.201 -178.248 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 184' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' B' ' 180' ' ' LEU . 81.9 mt -90.0 147.64 37.72 Favored Pre-proline 0 C--N 1.326 -0.452 0 C-N-CA 121.21 -0.196 . . . . 74.13 110.874 -179.151 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -69.91 83.39 0.73 Allowed 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.622 2.215 . . . . 60.41 111.397 173.716 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -132.59 -137.46 0.19 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.519 -0.764 . . . . 74.15 110.593 -175.182 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 62.9 mttp 69.94 25.0 5.0 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 122.003 0.906 . . . . 74.33 109.673 -176.111 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 . . . . . 0 C--O 1.249 1.041 0 CA-C-N 114.124 -1.398 . . . . 43.51 109.102 176.721 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.761 0 N-CA-C 111.861 -0.495 . . . . 64.03 111.861 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.3 p -85.64 -33.73 7.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.159 0.504 . . . . 72.54 109.668 177.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 94.4 mt -132.09 119.76 21.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.694 -0.684 . . . . 72.32 109.432 174.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 24.7 mmt -85.36 -76.08 0.34 Allowed 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.226 -0.443 . . . . 73.4 111.571 -175.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -178.68 123.44 0.09 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.824 -0.626 . . . . 73.3 110.092 -174.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -138.34 -17.07 1.18 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.467 0.651 . . . . 74.21 110.449 -178.31 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.27 5.25 64.01 Favored Glycine 0 N--CA 1.449 -0.44 0 CA-C-N 115.494 -0.775 . . . . 70.42 112.344 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.58 87.26 1.63 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.164 0.506 . . . . 43.31 110.414 176.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.1 p -127.5 132.8 68.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.734 -0.666 . . . . 74.12 109.418 176.436 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.408 HD23 ' N ' ' A' ' 10' ' ' LEU . 2.3 pt? -149.25 135.72 19.34 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.239 -0.437 . . . . 73.44 110.058 -178.35 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.2 m -90.9 95.76 10.29 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.967 0.413 . . . . 75.31 110.128 174.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.9 ' HG ' ' HD2' ' A' ' 81' ' ' LYS . 0.3 OUTLIER -79.51 133.64 36.49 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 107.987 -1.116 . . . . 73.23 107.987 174.641 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.586 ' CB ' ' HB3' ' A' ' 17' ' ' SER . . . -71.02 165.2 23.99 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.014 0.435 . . . . 41.14 111.161 -175.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -96.2 97.16 9.32 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.073 -0.512 . . . . 52.1 110.229 174.074 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.1 t70 74.26 -58.77 0.58 Allowed 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.191 -0.913 . . . . 73.43 112.819 171.287 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -69.37 -66.43 0.58 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.344 -0.389 . . . . 73.43 111.896 -170.413 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.586 ' HB3' ' CB ' ' A' ' 13' ' ' ALA . 7.8 t -82.39 5.91 18.86 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.92 0.391 . . . . 41.42 111.648 -170.159 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.6 m -75.21 53.39 0.64 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.302 0.573 . . . . 62.41 110.534 176.021 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.95 158.33 30.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.788 -0.642 . . . . 42.21 110.964 -176.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.431 HG21 HD23 ' A' ' 84' ' ' LEU . 28.6 m -150.14 122.64 8.51 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.156 -0.474 . . . . 63.04 110.235 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 50.4 tp -147.4 145.84 29.39 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.479 -0.328 . . . . 72.41 111.523 -178.052 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.6 t70 72.82 156.18 0.17 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 122.169 0.985 . . . . 63.13 113.591 170.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.62 ' O ' ' HD3' ' A' ' 25' ' ' LYS . 15.4 tt -149.71 152.47 11.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 106.216 -1.772 . . . . 73.32 106.216 170.492 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 45.4 m -76.08 -17.01 59.81 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 118.7 0.682 . . . . 54.23 111.869 -175.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.62 ' HD3' ' O ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER 39.56 53.49 2.41 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.199 1.0 . . . . 73.03 113.691 -178.114 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -95.62 4.09 53.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.32 0.581 . . . . 72.11 109.791 170.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 4.0 m-90 -84.27 92.26 7.94 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.701 -0.681 . . . . 71.41 110.738 -175.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.3 t -165.76 -52.44 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.08 0.467 . . . . 63.33 110.413 179.147 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.458 HD22 ' HB ' ' B' ' 183' ' ' VAL . 44.8 t30 -82.93 90.72 7.01 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.173 0.511 . . . . 52.13 111.354 -175.328 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.653 HG13 HD21 ' B' ' 163' ' ' LEU . 59.5 t -113.29 -65.95 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 115.636 -0.711 . . . . 74.34 110.145 175.084 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -107.05 6.78 29.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.972 -0.558 . . . . 70.01 110.601 -179.306 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.422 ' HB3' ' OD1' ' A' ' 29' ' ' ASN . 52.4 t30 -61.03 -50.96 71.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.893 -0.594 . . . . 71.24 110.962 -175.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.488 HG21 ' HB3' ' B' ' 179' ' ' LEU . 28.4 mm -60.59 -39.98 83.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.905 -0.589 . . . . 74.54 111.411 -178.167 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.48 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 86.4 mt -68.29 -22.49 64.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.863 -0.608 . . . . 71.51 110.982 -176.574 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 46.4 ttt-85 -73.32 -42.6 62.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.09 -0.505 . . . . 73.44 109.914 175.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -72.05 -23.43 61.37 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.925 -0.579 . . . . 64.24 111.04 -177.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -103.89 6.17 36.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.382 -0.372 . . . . 62.22 110.731 179.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 52.06 62.27 2.79 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.387 -0.824 . . . . 71.24 112.816 176.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.484 ' HB3' ' HB2' ' B' ' 151' ' ' PHE . 12.4 m-85 -94.36 -4.8 47.86 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.74 -0.664 . . . . 72.31 109.794 173.251 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 58.82 74.69 0.58 Allowed Pre-proline 0 C--O 1.232 0.183 0 CA-C-N 115.25 -0.886 . . . . 63.02 110.195 -174.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -78.58 142.42 18.29 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 123.006 2.471 . . . . 44.11 112.334 -176.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.702 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 1.4 mptm? -104.27 121.94 44.37 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.072 -0.513 . . . . 75.34 110.061 177.624 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.587 ' HA ' ' CG1' ' B' ' 147' ' ' VAL . 18.9 t80 -172.19 96.7 0.16 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.859 -0.61 . . . . 61.04 109.824 -177.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -157.2 124.08 5.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.221 -0.445 . . . . 72.14 109.908 176.367 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.443 ' HB3' ' CG2' ' B' ' 147' ' ' VAL . 18.4 p -162.67 122.73 2.35 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.29 -0.414 . . . . 61.3 110.887 -179.099 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -83.84 66.62 9.2 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.185 0.516 . . . . 50.05 109.839 175.489 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 34.6 m -109.06 142.83 20.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.026 -0.534 . . . . 45.04 110.658 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.564 ' HD3' HG22 ' A' ' 59' ' ' THR . 0.2 OUTLIER -163.13 144.7 9.81 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.242 -0.89 . . . . 63.35 109.225 -179.458 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.689 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 11.2 mp -70.43 86.57 0.62 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.469 -0.332 . . . . 61.3 110.491 -178.751 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.587 ' HA ' ' O ' ' A' ' 58' ' ' LYS . . . -84.98 63.08 7.9 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.629 -0.714 . . . . 54.54 110.047 175.459 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.689 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 51.8 p90 -95.33 171.57 8.63 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.485 -0.78 . . . . 74.03 110.077 -177.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -102.51 133.56 47.27 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.324 -0.398 . . . . 74.52 111.25 -178.424 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 42.3 t -135.8 114.69 12.11 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.695 -0.684 . . . . 74.5 109.453 175.319 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 70.34 13.95 7.52 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.143 0.577 . . . . 73.43 111.308 177.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 110.21 -32.32 6.76 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.682 -0.77 . . . . 74.4 112.186 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -89.01 156.1 19.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.006 0.432 . . . . 54.34 110.271 -179.292 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.1 mm -91.94 124.54 44.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 116.007 -0.542 . . . . 75.55 110.425 -179.442 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.587 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 27.4 mmmt -100.82 155.2 18.06 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.872 -0.788 . . . . 73.33 108.872 177.413 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.564 HG22 ' HD3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -133.45 102.18 5.43 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.177 0.513 . . . . 61.12 111.426 177.088 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.544 ' CD2' HD13 ' A' ' 66' ' ' LEU . 84.6 m-85 -108.35 119.83 40.63 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.804 -0.634 . . . . 74.45 110.448 177.327 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 32.6 t -97.06 -13.57 22.15 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.761 -0.654 . . . . 63.32 110.005 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -130.21 154.54 47.45 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.715 -0.675 . . . . 71.1 110.296 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.403 HD23 ' O ' ' A' ' 63' ' ' LEU . 10.4 tt -83.23 -24.36 32.37 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.409 -0.589 . . . . 73.43 109.409 -178.23 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 49.6 tp60 -54.18 -52.72 60.29 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.443 -0.798 . . . . 60.02 111.013 -178.493 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.8 m -69.75 -44.13 70.84 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.96 -0.564 . . . . 72.43 111.346 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.544 HD13 ' CD2' ' A' ' 60' ' ' PHE . 54.6 tp -65.74 -35.87 81.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.429 -0.35 . . . . 63.1 111.379 -174.766 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.428 ' HE ' ' HB3' ' A' ' 67' ' ' ARG . 17.7 ttp180 -58.11 -41.85 84.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.957 0.408 . . . . 73.3 110.342 176.425 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -72.4 -32.0 66.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.967 -0.561 . . . . 70.45 110.688 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 31.6 t80 -65.31 -44.86 86.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.907 -0.588 . . . . 74.11 109.907 177.392 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.73 -24.57 61.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.192 -0.458 . . . . 53.11 111.399 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.761 ' HA ' ' HE2' ' A' ' 77' ' ' LYS . 70.4 m -73.42 -18.78 61.1 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.599 -0.273 . . . . 65.45 111.294 -179.841 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -106.52 4.1 27.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.367 0.604 . . . . 75.2 110.194 176.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 56.3 mmtt -105.11 107.58 18.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.599 -0.728 . . . . 71.35 110.183 177.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.3 t -56.89 -33.0 66.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.976 0.417 . . . . 65.22 110.598 -178.277 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.8 p -80.87 -52.12 7.83 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.123 -0.49 . . . . 74.41 111.293 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.618 ' HA ' HD13 ' A' ' 79' ' ' LEU . 72.9 mtp -67.76 -12.77 61.25 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.843 0.354 . . . . 64.15 111.578 -177.331 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.761 ' HE2' ' HA ' ' A' ' 71' ' ' SER . 16.7 mmtt -61.83 -25.96 67.83 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.072 -0.513 . . . . 62.23 110.513 174.181 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.448 ' O ' ' HE2' ' A' ' 81' ' ' LYS . 3.6 mm-40 -94.95 -5.31 45.02 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.411 0.625 . . . . 74.31 110.131 -178.581 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.618 HD13 ' HA ' ' A' ' 76' ' ' MET . 8.5 mp -92.43 -56.84 2.89 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.265 -0.88 . . . . 74.43 110.094 178.1 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.821 ' HB3' HD13 ' A' ' 84' ' ' LEU . 3.7 mm? -83.22 -4.47 58.44 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.023 -0.535 . . . . 62.0 111.752 -174.133 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.9 ' HD2' ' HG ' ' A' ' 12' ' ' LEU . 64.9 pttt -56.46 -18.5 11.57 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.611 0.597 . . . . 74.41 112.611 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -76.25 -26.03 55.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.76 0.314 . . . . 74.25 111.55 -177.489 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 7.5 p -116.14 -28.51 2.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.84 0.352 . . . . 71.14 111.375 -177.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.821 HD13 ' HB3' ' A' ' 80' ' ' LEU . 8.8 mp -72.74 134.83 81.3 Favored Pre-proline 0 C--N 1.328 -0.342 0 N-CA-C 109.76 -0.459 . . . . 64.13 109.76 177.245 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 84' ' ' LEU . 38.1 Cg_exo -60.16 94.3 0.1 OUTLIER 'Trans proline' 0 C--O 1.235 0.332 0 C-N-CA 123.068 2.512 . . . . 52.02 113.409 -176.042 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -121.03 112.96 19.38 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.764 -0.828 . . . . 74.44 108.764 173.448 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.463 ' NZ ' ' HB2' ' A' ' 87' ' ' LYS . 8.7 mtmp? -84.96 -21.23 29.65 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.072 0.463 . . . . 65.24 111.174 -172.76 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.419 ' OE2' ' HB2' ' A' ' 87' ' ' LYS . 1.2 pm0 . . . . . 0 C--N 1.322 -0.601 0 CA-C-N 115.897 -0.592 . . . . 62.13 110.889 -179.04 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.52 0 N-CA-C 112.132 -0.387 . . . . 64.11 112.132 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.538 HG13 ' HG ' ' B' ' 103' ' ' LEU . 14.2 p -89.53 -25.45 5.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.317 0.58 . . . . 71.11 110.146 177.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 103' ' ' LEU . . . . . 0.538 ' HG ' HG13 ' B' ' 102' ' ' VAL . 95.6 mt -128.81 129.45 45.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.923 -0.58 . . . . 62.25 110.177 178.465 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 23.3 mmt -100.25 -72.91 0.65 Allowed 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.483 -0.562 . . . . 72.24 109.483 179.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -136.99 121.65 18.51 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.219 -0.9 . . . . 61.21 108.75 176.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -97.05 -38.37 9.79 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.434 0.635 . . . . 71.11 110.357 -177.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -172.6 114.12 0.51 Allowed Glycine 0 C--N 1.312 -0.755 0 CA-C-N 114.928 -1.033 . . . . 54.01 111.551 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -121.63 96.85 5.24 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.204 0.526 . . . . 41.03 111.057 -176.642 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 9.7 p -103.62 136.77 35.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 108.936 -0.764 . . . . 72.25 108.936 174.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 110' ' ' LEU . . . . . 0.474 ' H ' HD23 ' B' ' 110' ' ' LEU . 2.5 pt? -133.16 154.82 50.26 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.953 0.406 . . . . 74.23 110.931 -175.37 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 38.5 m -98.68 117.47 33.22 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.865 -0.607 . . . . 55.24 110.028 176.198 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 112' ' ' LEU . . . . . 0.442 HD22 ' HA ' ' B' ' 112' ' ' LEU . 0.3 OUTLIER -160.96 135.94 7.57 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.015 -1.106 . . . . 75.41 108.015 177.983 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -84.7 176.51 8.51 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.24 0.543 . . . . 70.11 111.024 -178.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.461 ' O ' ' HB3' ' B' ' 115' ' ' ASP . . . -123.12 95.79 4.75 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.068 -0.515 . . . . 63.34 110.078 174.116 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 115' ' ' ASP . . . . . 0.461 ' HB3' ' O ' ' B' ' 114' ' ' ALA . 17.0 t70 75.28 -17.03 0.53 Allowed 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.221 -0.899 . . . . 71.54 112.256 176.256 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.42 HD22 ' HA ' ' B' ' 116' ' ' LEU . 0.5 OUTLIER -71.97 -73.18 0.2 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.751 0.31 . . . . 73.34 111.238 -175.699 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 26.0 m -106.5 -10.18 16.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.363 -0.381 . . . . 72.14 111.902 -173.569 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 118' ' ' SER . . . . . 0.463 ' HA ' ' O ' ' B' ' 188' ' ' GLU . 5.4 m -61.17 115.33 3.71 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.178 -0.465 . . . . 34.43 111.578 -173.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -126.23 164.37 21.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.746 -0.661 . . . . 51.4 110.232 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 4.9 t -85.24 155.0 21.58 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 110.147 -0.316 . . . . 65.53 110.147 -177.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 121' ' ' LEU . . . . . 0.407 HD23 ' HB2' ' B' ' 185' ' ' PRO . 21.2 tp -140.91 146.32 37.28 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.91 -0.404 . . . . 62.22 109.91 -179.279 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 122' ' ' ASP . . . . . 0.503 ' HA ' ' NH1' ' B' ' 167' ' ' ARG . 33.0 t70 -93.6 112.96 24.95 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.21 0.528 . . . . 70.31 111.815 -175.535 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 11.8 tt -81.96 144.33 10.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.358 -0.837 . . . . 63.0 109.059 172.094 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 69.6 m -65.62 103.14 0.81 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.398 0.618 . . . . 73.15 111.24 -176.72 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 125' ' ' LYS . . . . . 0.874 ' HD3' ' H ' ' B' ' 125' ' ' LYS . 0.0 OUTLIER -86.74 32.81 0.65 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.325 -0.852 . . . . 64.35 111.554 -176.718 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -89.02 13.76 12.19 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.807 -0.633 . . . . 61.14 110.221 176.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 30.0 t-105 -104.08 100.31 10.06 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.069 -0.514 . . . . 61.31 109.734 -178.574 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 20.7 t -156.28 -12.77 0.1 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.008 -0.542 . . . . 70.12 110.831 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 129' ' ' ASN . . . . . 0.654 ' OD1' ' HB3' ' B' ' 132' ' ' ASN . 34.4 t30 -89.6 124.4 34.52 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.953 0.406 . . . . 74.23 111.091 -178.841 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 4.6 p -163.03 -49.22 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 115.579 -0.737 . . . . 73.25 109.251 173.61 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 45.5 p90 -88.75 -13.62 39.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.062 -0.517 . . . . 65.11 110.016 175.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.654 ' HB3' ' OD1' ' B' ' 129' ' ' ASN . 8.1 t30 -67.47 -35.43 79.17 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.115 -0.493 . . . . 72.42 110.137 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 133' ' ' ILE . . . . . 0.535 HD11 HD21 ' B' ' 129' ' ' ASN . 46.4 mm -64.32 -41.03 91.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.204 0.526 . . . . 75.45 110.231 175.508 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.419 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 91.4 mt -70.42 -22.06 62.76 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.926 -0.579 . . . . 73.04 110.363 177.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.54 ' HB3' ' O ' ' B' ' 132' ' ' ASN . 22.6 ttt180 -68.71 -51.54 40.42 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.679 -0.489 . . . . 74.31 109.679 171.447 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 136' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 69.7 mm-40 -55.36 -48.74 73.8 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.248 -0.887 . . . . 75.54 111.508 -179.744 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -87.82 0.64 55.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.47 . . . . 72.45 111.174 -177.261 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 33.2 t70 52.14 63.46 2.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.643 0.735 . . . . 74.51 111.95 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 139' ' ' PHE . . . . . 0.419 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 4.0 m-85 -93.16 0.81 57.28 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.485 -0.779 . . . . 74.12 109.835 174.081 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 74.3 81.97 0.14 Allowed Pre-proline 0 N--CA 1.465 0.294 0 O-C-N 124.328 1.017 . . . . 73.54 110.679 -176.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -85.27 127.81 3.45 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 122.521 2.147 . . . . 65.1 112.904 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -119.35 117.2 27.9 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.885 -0.598 . . . . 75.31 110.017 174.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -170.57 28.94 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.528 0.68 . . . . 73.1 109.911 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 144' ' ' LEU . . . . . 0.854 ' H ' HD23 ' B' ' 144' ' ' LEU . 2.0 pt? -80.97 102.63 10.27 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.582 0.706 . . . . 71.44 109.577 -179.602 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 16.3 p -104.88 109.82 21.95 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.441 -0.799 . . . . 53.3 111.764 -173.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -78.43 55.47 1.6 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.23 0.538 . . . . 73.34 109.887 173.483 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 147' ' ' VAL . . . . . 0.587 ' CG1' ' HA ' ' A' ' 43' ' ' PHE . 40.7 t -120.38 148.89 23.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.782 -0.645 . . . . 74.14 110.502 -174.681 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -170.78 136.45 1.18 Allowed 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.543 -0.91 . . . . 73.31 108.543 175.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.646 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.8 mp -70.0 91.48 0.68 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.268 -0.424 . . . . 71.42 109.934 -178.376 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.702 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -93.02 61.05 3.39 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.656 -0.498 . . . . 71.53 109.656 175.781 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 151' ' ' PHE . . . . . 0.646 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 50.5 p90 -88.93 165.7 14.42 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.661 -0.699 . . . . 73.43 110.711 -176.481 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 152' ' ' LYS . . . . . 0.583 ' HE2' ' HA2' ' B' ' 155' ' ' GLY . 57.9 tttt -98.03 115.87 29.09 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.079 -0.51 . . . . 74.12 110.172 -178.082 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 153' ' ' CYS . . . . . . . . . . . . . 53.6 t -117.68 103.38 9.97 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.236 -0.438 . . . . 60.33 110.147 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 65.89 29.14 10.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.444 -0.798 . . . . 74.01 111.374 175.266 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 155' ' ' GLY . . . . . 0.583 ' HA2' ' HE2' ' B' ' 152' ' ' LYS . . . 108.5 -33.35 6.28 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.525 -0.845 . . . . 31.12 112.987 176.495 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 156' ' ' GLU . . . . . 0.571 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 10.1 pt-20 -99.6 140.3 34.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.911 0.386 . . . . 65.21 110.92 -178.363 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 50.9 mm -76.63 120.56 27.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.045 -0.525 . . . . 75.54 110.173 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 158' ' ' LYS . . . . . 0.571 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 29.9 mmmt -110.54 110.05 20.62 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.827 -0.435 . . . . 74.22 109.827 -177.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 159' ' ' THR . . . . . 0.466 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.5 OUTLIER -87.82 126.77 35.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.086 0.47 . . . . 55.12 111.954 -178.75 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -130.27 124.78 33.19 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.783 -0.644 . . . . 74.21 110.592 177.003 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 34.3 t -112.51 -5.94 14.0 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.789 -0.642 . . . . 62.24 109.899 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -137.8 163.37 31.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.031 -0.531 . . . . 65.14 109.997 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 163' ' ' LEU . . . . . 0.653 HD21 HG13 ' A' ' 30' ' ' VAL . 91.5 mt -97.92 1.41 48.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.424 -0.353 . . . . 63.14 111.583 -176.838 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -82.47 -53.08 6.27 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.371 -0.604 . . . . 72.33 109.371 178.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 15.1 m -62.96 -38.89 92.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.74 -0.663 . . . . 54.43 110.039 176.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 53.2 tp -67.66 -35.85 79.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.621 -0.718 . . . . 63.52 110.951 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 167' ' ' ARG . . . . . 0.503 ' NH1' ' HA ' ' B' ' 122' ' ' ASP . 54.4 ttp180 -61.09 -46.04 92.28 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.989 0.423 . . . . 73.54 109.944 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -63.38 -41.31 98.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.632 -0.713 . . . . 64.0 110.611 178.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 169' ' ' PHE . . . . . 0.479 ' O ' ' HG2' ' B' ' 172' ' ' GLN . 51.7 t80 -65.32 -46.64 79.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.7 -0.682 . . . . 72.12 110.985 -178.51 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -66.23 -28.38 68.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.361 -0.381 . . . . 61.12 111.373 -178.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 40.2 m -75.28 -34.06 61.3 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.52 -0.309 . . . . 72.13 111.305 -178.256 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 172' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 4.3 pt20 -81.97 -25.56 34.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.247 0.546 . . . . 74.12 110.229 178.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 58.0 mmtt -81.25 109.11 15.46 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.587 -0.733 . . . . 71.45 110.762 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 11.8 t -67.2 -24.36 65.84 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.074 -0.713 . . . . 72.11 109.074 176.346 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 4.8 m -82.68 -12.26 57.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.411 -0.813 . . . . 73.42 111.617 -179.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.426 ' O ' ' HB2' ' B' ' 179' ' ' LEU . 79.1 mtp -121.77 -10.05 8.77 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.924 0.392 . . . . 71.05 111.441 -179.203 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 177' ' ' LYS . . . . . 0.403 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 89.0 tttt -64.81 -34.99 79.65 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.083 -0.508 . . . . 72.41 111.056 -177.259 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -84.43 -6.67 59.4 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 122.001 0.905 . . . . 65.54 109.494 -176.465 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 179' ' ' LEU . . . . . 0.488 ' HB3' HG21 ' A' ' 33' ' ' ILE . 11.0 mp -90.33 -56.29 3.27 Favored 'General case' 0 N--CA 1.438 -1.06 0 CA-C-N 114.054 -1.43 . . . . 73.54 109.801 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.01 -10.64 56.78 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.782 -0.644 . . . . 63.23 112.242 -173.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 181' ' ' LYS . . . . . 0.569 ' HB2' ' OE1' ' B' ' 186' ' ' GLN . 64.0 pttt -64.8 -5.92 6.97 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.405 -0.518 . . . . 73.02 111.493 178.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -74.75 -30.99 61.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.201 -0.454 . . . . 62.13 110.434 175.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 183' ' ' VAL . . . . . 0.458 ' HB ' HD22 ' A' ' 29' ' ' ASN . 10.7 p -104.58 -18.87 6.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 52.33 110.764 -178.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 184' ' ' LEU . . . . . 0.439 ' HB2' ' HA ' ' B' ' 181' ' ' LYS . 9.1 mp -76.64 137.1 67.01 Favored Pre-proline 0 C--N 1.33 -0.258 0 N-CA-C 109.898 -0.408 . . . . 74.43 109.898 176.276 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 185' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' B' ' 184' ' ' LEU . 9.4 Cg_exo -71.51 81.17 1.3 Allowed 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.816 2.344 . . . . 64.32 112.256 -178.869 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 186' ' ' GLN . . . . . 0.569 ' OE1' ' HB2' ' B' ' 181' ' ' LYS . 85.8 mt-30 -115.68 141.34 48.21 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.957 -0.565 . . . . 64.24 109.584 179.108 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -107.53 -25.83 11.19 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.587 -0.733 . . . . 70.01 109.991 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 188' ' ' GLU . . . . . 0.463 ' O ' ' HA ' ' B' ' 118' ' ' SER . 0.5 OUTLIER . . . . . 0 C--O 1.251 1.172 0 CA-C-O 118.298 -0.858 . . . . 74.33 109.722 177.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.851 0 N-CA-C 112.273 -0.331 . . . . 72.3 112.273 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.726 HG23 ' HG2' ' A' ' 4' ' ' MET . 22.8 m -97.71 176.91 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 120.751 0.31 . . . . 64.32 110.518 -179.166 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.437 HD12 ' N ' ' A' ' 3' ' ' LEU . 5.6 mp -75.03 97.38 3.39 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.125 -0.489 . . . . 74.53 110.076 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.726 ' HG2' HG23 ' A' ' 2' ' ' VAL . 87.7 mmm -127.14 102.05 6.78 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.821 -0.627 . . . . 52.11 110.982 -177.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -97.76 107.7 20.25 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.59 0.709 . . . . 72.05 109.217 172.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -143.16 -179.52 6.43 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 114.521 -1.218 . . . . 74.44 110.001 -173.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -178.86 -117.48 0.54 Allowed Glycine 0 N--CA 1.443 -0.835 0 N-CA-C 111.554 -0.619 . . . . 62.44 111.554 178.119 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -150.3 138.24 20.11 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 110.1 -0.333 . . . . 75.23 110.1 178.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 35.0 m -66.82 159.85 4.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.175 -0.466 . . . . 55.2 109.985 174.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 68.5 mt -56.59 101.4 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.139 0.495 . . . . 73.43 111.025 -177.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 59.7 m -96.09 107.98 20.36 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.581 -0.736 . . . . 70.41 110.282 178.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.41 HD23 ' N ' ' A' ' 13' ' ' ALA . 1.9 tt -141.35 136.52 31.57 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 108.2 -1.037 . . . . 60.23 108.2 179.15 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.41 ' N ' HD23 ' A' ' 12' ' ' LEU . . . -64.91 162.43 16.42 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.095 0.474 . . . . 64.34 111.885 -174.689 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -89.5 -43.74 10.62 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.956 -0.566 . . . . 74.14 110.527 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -111.05 -41.58 4.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.251 -0.432 . . . . 75.3 110.778 179.49 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.5 mt -87.62 46.42 1.38 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.012 -0.54 . . . . 71.11 109.709 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.6 m -78.17 51.1 0.96 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.261 -0.881 . . . . 72.43 110.72 -173.268 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 46.2 m -67.64 136.39 54.32 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 114.986 -1.006 . . . . 54.43 111.061 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -113.93 4.61 15.85 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.279 -0.419 . . . . 61.12 111.128 -178.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 28.3 m -87.46 119.58 27.88 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.186 -0.461 . . . . 31.5 109.868 177.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -83.22 153.3 24.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.124 0.487 . . . . 70.43 111.577 -176.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -84.55 144.17 28.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.523 -0.762 . . . . 74.42 110.342 177.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 6.0 tp -60.36 116.62 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.592 0.71 . . . . 63.42 110.738 -178.568 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.632 ' HB3' ' HB3' ' B' ' 124' ' ' SER . 32.0 m -85.23 123.14 30.39 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.336 -0.847 . . . . 50.22 110.814 -177.245 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.557 ' HG2' ' OE1' ' A' ' 26' ' ' GLN . 0.0 OUTLIER -132.71 14.8 4.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.174 0.512 . . . . 73.4 111.038 179.468 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.557 ' OE1' ' HG2' ' A' ' 25' ' ' LYS . 2.8 mp0 -97.72 82.96 3.12 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.275 -0.639 . . . . 74.13 109.275 175.692 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.418 ' HZ2' ' HB2' ' A' ' 63' ' ' LEU . 86.9 m95 -100.83 -75.05 0.59 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.968 0.413 . . . . 72.51 111.786 -174.089 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 14.6 m -83.33 19.86 1.43 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.835 0.679 . . . . 74.43 112.835 -169.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.522 ' OD1' ' HB ' ' B' ' 183' ' ' VAL . 27.3 t-20 -85.82 -21.49 28.09 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 122.073 -0.392 . . . . 74.45 110.629 179.739 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.711 HG12 ' HG ' ' B' ' 163' ' ' LEU . 27.5 m -55.79 -37.32 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 112.593 0.59 . . . . 63.44 112.593 -174.416 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.438 ' HB3' HD11 ' B' ' 149' ' ' LEU . 53.1 p90 -101.99 -5.41 24.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.713 0.292 . . . . 74.42 110.99 -177.614 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.554 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 8.7 t30 -62.96 -57.23 11.45 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.211 -0.449 . . . . 60.13 111.478 -172.348 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.586 HG21 ' HB3' ' B' ' 179' ' ' LEU . 4.2 mp -65.35 -37.2 79.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.142 0.496 . . . . 71.11 110.985 -176.562 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.0 mt -63.92 -32.37 73.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.978 -0.555 . . . . 64.12 110.527 178.188 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -77.08 -29.16 54.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.745 -0.661 . . . . 72.4 110.417 178.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 95.6 mt-10 -70.21 -47.98 59.08 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.073 -0.512 . . . . 74.55 110.952 177.567 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -92.13 6.09 47.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.067 -0.515 . . . . 70.43 111.536 -175.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 57.2 60.67 2.84 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 113.089 0.774 . . . . 71.12 113.089 177.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -86.32 -1.1 57.21 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.883 -0.784 . . . . 75.4 108.883 167.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 60.43 78.15 0.34 Allowed Pre-proline 0 C--O 1.235 0.291 0 CA-C-N 114.333 -1.303 . . . . 64.22 110.946 -179.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -79.14 161.77 26.14 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.639 2.226 . . . . 72.02 111.529 177.061 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.42 ' HB3' ' H ' ' A' ' 43' ' ' PHE . 12.7 mptt -91.22 -162.88 0.96 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.146 0.498 . . . . 72.03 111.63 -179.174 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.42 ' H ' ' HB3' ' A' ' 42' ' ' LYS . 12.8 p90 -85.42 154.38 21.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.297 -0.865 . . . . 71.23 112.053 -172.256 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.413 HD22 ' N ' ' A' ' 44' ' ' LEU . 2.9 mm? -110.73 79.45 1.21 Allowed 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.391 -0.822 . . . . 71.32 109.06 175.086 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 37.8 t -76.84 93.01 3.67 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.916 -0.583 . . . . 54.4 109.516 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -67.16 108.54 2.72 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.864 -0.607 . . . . 73.52 110.226 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.465 HG11 ' HB3' ' B' ' 145' ' ' CYS . 15.3 m -87.2 152.19 3.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 N-CA-C 108.784 -0.821 . . . . 72.12 108.784 172.116 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.589 ' H ' ' HD2' ' A' ' 48' ' ' LYS . 0.1 OUTLIER -102.46 140.22 37.02 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.947 -0.76 . . . . 62.1 108.947 -175.934 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.779 HD11 ' HB3' ' B' ' 131' ' ' PHE . 9.6 tp -66.01 -33.25 75.37 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.973 -0.751 . . . . 75.32 108.973 175.876 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.548 ' HB3' ' HG2' ' B' ' 142' ' ' LYS . . . 43.09 43.43 3.76 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 124.484 1.115 . . . . 75.1 112.639 169.859 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 41.6 p90 -84.55 165.08 18.33 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.061 -0.518 . . . . 51.42 110.544 -176.069 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -101.17 115.26 30.08 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.048 -0.524 . . . . 74.22 110.561 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.608 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 42.5 t -108.37 102.3 11.42 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.782 -0.644 . . . . 73.4 109.844 178.556 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.4 t70 68.2 8.39 6.53 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.878 -0.601 . . . . 72.2 111.435 174.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 129.52 -32.06 3.28 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.476 -0.869 . . . . 75.14 112.654 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.763 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 11.6 pt-20 -92.71 141.65 28.23 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.783 0.325 . . . . 74.11 110.602 -178.644 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.4 mm -85.88 120.71 36.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.708 -0.478 . . . . 72.32 109.708 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.763 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 26.7 mmmt -108.4 119.22 38.88 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.032 0.444 . . . . 73.13 110.634 -177.567 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.4 p -95.5 108.58 20.82 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.34 0.591 . . . . 65.25 111.838 -179.087 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -129.71 145.98 51.5 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.4 -0.818 . . . . 74.34 109.616 176.069 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.6 m -131.24 14.51 5.11 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.031 0.443 . . . . 71.1 110.576 178.164 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -152.3 173.14 15.4 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.991 -0.55 . . . . 71.34 109.631 177.523 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.854 ' HG ' HG12 ' B' ' 130' ' ' VAL . 3.1 mt -90.53 -25.68 20.12 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.264 0.468 . . . . 72.51 112.264 -174.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 51.0 tp60 -73.23 -43.55 61.02 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.651 0.262 . . . . 71.24 110.786 -173.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.0 p -68.09 -40.85 82.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.231 -0.44 . . . . 71.43 110.672 179.353 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.482 ' O ' HD23 ' A' ' 66' ' ' LEU . 6.3 tt -67.35 -36.65 81.82 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.05 -0.523 . . . . 72.5 109.969 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.642 ' HG3' HD13 ' A' ' 84' ' ' LEU . 66.7 ttt180 -58.21 -34.51 70.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.953 -0.567 . . . . 73.33 110.618 -179.269 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -59.27 -51.81 68.35 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.909 -0.587 . . . . 74.44 110.59 175.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -70.8 -45.94 63.73 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.024 -0.989 . . . . 72.52 111.195 -174.051 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.59 -31.22 71.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.298 -0.41 . . . . 62.2 111.859 -178.062 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.7 t -72.79 -40.88 65.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.706 0.289 . . . . 65.32 110.933 -178.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -82.85 -12.77 57.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.012 0.434 . . . . 74.44 111.226 -176.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.608 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 31.0 mmmt -80.78 143.37 32.92 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.244 -0.434 . . . . 74.25 110.141 174.216 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 5.5 m -77.18 -46.43 23.38 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.085 0.469 . . . . 61.3 109.949 178.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 14.0 p -70.15 -50.23 42.59 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.756 -0.657 . . . . 74.25 111.413 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.55 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 68.2 mtp -66.36 -20.13 65.99 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.409 -0.359 . . . . 74.45 111.571 -175.77 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 4.5 ttmp? -61.23 -31.76 71.55 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.017 0.437 . . . . 61.24 110.492 177.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -97.36 1.42 49.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.452 0.644 . . . . 50.31 110.585 -177.291 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.476 ' HB3' HG21 ' B' ' 133' ' ' ILE . 81.4 mt -98.12 -47.59 5.43 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.377 -0.828 . . . . 64.43 109.433 177.665 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.577 ' HB3' HD12 ' A' ' 84' ' ' LEU . 4.2 mm? -85.5 -8.57 58.27 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.492 -0.776 . . . . 65.13 111.463 -177.035 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -56.84 -20.63 23.82 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.868 0.366 . . . . 54.51 111.284 176.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -72.73 -45.54 58.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.192 -0.458 . . . . 74.11 111.46 -176.378 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 27.1 m -105.67 -22.6 4.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 112.494 0.553 . . . . 74.5 112.494 -174.149 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.642 HD13 ' HG3' ' A' ' 67' ' ' ARG . 94.2 mt -98.12 126.89 38.48 Favored Pre-proline 0 C--N 1.324 -0.537 0 C-N-CA 120.753 -0.379 . . . . 70.32 110.107 -179.444 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -53.11 127.76 26.35 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 123.408 2.739 . . . . 70.41 112.502 -178.676 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 86.0 mm-40 -122.59 -160.03 0.86 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.662 -0.699 . . . . 73.44 110.23 -178.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm 67.39 13.4 9.33 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.481 0.712 . . . . 73.11 111.519 178.333 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 115.515 -0.766 . . . . 72.44 111.1 177.679 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.465 0 N-CA-C 112.003 -0.439 . . . . 73.33 112.003 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.483 HG12 ' HG2' ' B' ' 104' ' ' MET . 48.2 t -91.84 108.37 19.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.814 0.34 . . . . 63.22 110.176 178.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 10.0 mp -80.07 104.73 10.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.207 0.527 . . . . 62.31 111.267 -177.362 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 104' ' ' MET . . . . . 0.483 ' HG2' HG12 ' B' ' 102' ' ' VAL . 87.9 mmm -127.61 100.75 6.11 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.216 -0.902 . . . . 72.21 109.043 176.759 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 45.9 m-20 -98.27 126.86 43.94 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.279 0.561 . . . . 75.01 111.371 -173.445 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -153.73 108.71 3.14 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.122 -0.945 . . . . 64.22 108.785 177.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -73.01 -97.08 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.628 -0.796 . . . . 71.32 112.482 -176.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -135.39 174.56 10.48 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.862 0.363 . . . . 74.1 110.321 -178.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 p -87.12 103.0 12.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 121.635 0.731 . . . . 72.41 110.066 177.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 5.0 tt -75.62 104.0 5.98 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.683 -0.689 . . . . 75.14 109.149 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 56.5 m -149.93 118.25 6.43 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.011 0.434 . . . . 64.3 111.036 -178.253 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 112' ' ' LEU . . . . . 0.417 HD13 ' N ' ' B' ' 113' ' ' ALA . 1.2 tm? -89.45 131.51 35.46 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.669 -0.863 . . . . 72.55 108.669 174.711 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 113' ' ' ALA . . . . . 0.553 ' HB3' ' HA ' ' B' ' 117' ' ' SER . . . -55.13 128.34 33.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.828 0.346 . . . . 72.14 111.589 -177.533 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -91.06 -44.4 9.32 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.31 -0.405 . . . . 34.11 111.778 -177.43 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -79.15 -55.7 4.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.087 -0.506 . . . . 71.45 110.696 -174.165 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 6.6 mp -90.56 -28.53 18.41 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.002 -0.545 . . . . 74.01 110.368 -178.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.553 ' HA ' ' HB3' ' B' ' 113' ' ' ALA . 50.7 m 50.96 58.01 6.03 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.534 -0.757 . . . . 65.01 110.906 -175.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 3.4 m -70.67 74.49 0.58 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.902 -1.044 . . . . 74.24 110.39 178.064 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -101.5 9.89 40.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.537 -0.756 . . . . 74.23 110.202 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 21.5 m -88.27 117.38 27.14 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.48 -0.782 . . . . 74.4 109.616 177.203 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 121' ' ' LEU . . . . . 0.519 ' HB2' ' HA ' ' B' ' 183' ' ' VAL . 3.5 mm? -70.04 167.07 18.39 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.22 -0.446 . . . . 63.41 110.867 -178.086 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -142.46 143.6 32.67 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.996 -0.547 . . . . 71.23 109.956 -176.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 5.1 tp -66.45 108.11 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.783 0.802 . . . . 75.4 111.399 -176.499 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.632 ' HB3' ' HB3' ' A' ' 24' ' ' SER . 48.1 m -91.86 141.14 28.98 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.277 -0.874 . . . . 74.2 110.156 178.648 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.51 17.21 3.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.903 0.382 . . . . 63.14 111.644 -178.323 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -101.12 91.72 4.67 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.076 0.465 . . . . 52.52 110.132 176.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 39.5 m95 -114.89 -57.44 2.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.738 -0.664 . . . . 71.11 110.426 -176.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 19.4 m -82.35 -1.77 50.81 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.71 -0.677 . . . . 61.41 111.692 -173.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 129' ' ' ASN . . . . . 0.422 ' HA ' ' HB2' ' B' ' 132' ' ' ASN . 9.8 t-20 -77.96 -14.19 59.62 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.988 0.423 . . . . 74.5 110.496 -177.62 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.854 HG12 ' HG ' ' A' ' 63' ' ' LEU . 35.6 m -63.01 -32.76 57.3 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-N 116.25 -0.432 . . . . 63.31 111.982 -176.301 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 131' ' ' PHE . . . . . 0.779 ' HB3' HD11 ' A' ' 49' ' ' LEU . 53.8 p90 -108.93 3.56 22.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.743 0.306 . . . . 74.45 110.823 -178.457 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.422 ' HB2' ' HA ' ' B' ' 129' ' ' ASN . 7.5 t30 -62.79 -50.63 70.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.018 -0.537 . . . . 73.33 111.151 -173.614 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 133' ' ' ILE . . . . . 0.476 HG21 ' HB3' ' A' ' 79' ' ' LEU . 3.4 mp -68.39 -41.52 83.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.176 0.512 . . . . 73.22 110.456 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.409 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 88.8 mt -62.95 -29.22 70.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.739 -0.664 . . . . 43.23 111.172 -178.878 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -72.02 -40.11 68.7 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.197 -0.456 . . . . 70.43 110.692 179.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 136' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 9.6 mm-40 -72.8 -32.09 65.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.13 -0.486 . . . . 70.44 110.79 -178.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -95.48 3.72 53.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.005 -0.543 . . . . 72.51 111.072 -179.37 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 53.19 58.14 5.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.435 -0.802 . . . . 74.41 112.8 177.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 139' ' ' PHE . . . . . 0.409 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 3.4 m-85 -89.31 -1.07 57.92 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.282 0.563 . . . . 63.02 109.604 170.472 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 63.58 84.05 0.19 Allowed Pre-proline 0 C--O 1.233 0.225 0 CA-C-N 114.508 -1.224 . . . . 74.43 111.534 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.488 ' HB3' ' HB2' ' B' ' 131' ' ' PHE . 60.0 Cg_endo -75.19 132.83 15.6 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.463 2.109 . . . . 52.32 110.604 172.849 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 142' ' ' LYS . . . . . 0.548 ' HG2' ' HB3' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -79.86 -171.09 2.71 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.605 0.595 . . . . 74.33 112.605 -173.205 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 13.5 p90 -68.67 131.59 45.45 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.156 0.799 . . . . 72.21 113.156 -163.387 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -90.22 85.54 6.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.543 -0.753 . . . . 71.25 109.838 174.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 145' ' ' CYS . . . . . 0.465 ' HB3' HG11 ' A' ' 47' ' ' VAL . 45.4 t -82.07 106.18 13.77 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.42 -0.585 . . . . 64.31 109.42 177.672 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.55 94.91 6.98 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.899 -0.592 . . . . 74.25 111.389 -176.519 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 8.3 m -84.24 152.07 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 N-CA-C 108.438 -0.949 . . . . 70.24 108.438 170.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 148' ' ' LYS . . . . . 0.426 ' H ' ' HD3' ' B' ' 148' ' ' LYS . 0.0 OUTLIER -121.28 145.27 48.04 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.896 -0.409 . . . . 71.25 109.896 -173.163 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.628 ' HB3' ' HD1' ' B' ' 151' ' ' PHE . 4.2 mm? -53.44 -46.15 69.74 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 123.48 0.488 . . . . 72.14 109.963 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.416 ' HB2' ' HE3' ' B' ' 148' ' ' LYS . . . 48.14 36.35 6.48 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 124.118 0.886 . . . . 22.13 111.871 174.634 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 151' ' ' PHE . . . . . 0.628 ' HD1' ' HB3' ' B' ' 149' ' ' LEU . 42.3 p90 -82.59 169.68 16.02 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.099 -0.5 . . . . 72.31 109.952 -178.846 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 28.4 ttmt -106.39 125.34 50.87 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.214 -0.448 . . . . 65.34 110.581 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 153' ' ' CYS . . . . . . . . . . . . . 35.4 t -124.96 105.2 9.03 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.279 -0.637 . . . . 60.54 109.279 177.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 34.7 t70 67.19 28.6 8.09 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.529 0.68 . . . . 62.01 110.81 176.536 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 107.12 -35.76 4.83 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.552 -0.832 . . . . 73.21 112.877 175.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 156' ' ' GLU . . . . . 0.401 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 10.7 pt-20 -92.87 145.26 24.52 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.047 0.451 . . . . 54.32 110.762 -177.495 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 50.0 mm -84.74 125.13 40.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.755 -0.657 . . . . 54.24 110.06 -179.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 158' ' ' LYS . . . . . 0.401 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 28.6 mmmt -106.17 110.77 23.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.141 0.496 . . . . 72.31 110.063 -178.579 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -98.34 107.49 19.97 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.924 -0.58 . . . . 72.11 112.119 -175.471 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -131.53 151.97 51.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.54 -0.755 . . . . 75.44 109.928 176.821 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 64.3 m -131.29 5.63 4.45 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.346 0.594 . . . . 63.15 109.89 173.464 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -125.4 145.13 50.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.541 -0.754 . . . . 64.31 109.894 -179.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 163' ' ' LEU . . . . . 0.711 ' HG ' HG12 ' A' ' 30' ' ' VAL . 1.0 OUTLIER -71.58 -35.11 70.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.098 0.475 . . . . 51.11 109.776 178.993 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 164' ' ' GLN . . . . . 0.473 ' O ' ' HG2' ' B' ' 168' ' ' LYS . 50.5 tp60 -66.72 -42.73 85.86 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.934 -0.575 . . . . 72.14 111.414 -176.29 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 10.3 p -69.6 -39.22 77.38 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.846 0.355 . . . . 64.13 110.925 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 54.0 tp -65.53 -36.24 83.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.964 0.412 . . . . 72.42 109.973 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 167' ' ' ARG . . . . . 0.429 ' HB3' ' O ' ' B' ' 164' ' ' GLN . 61.4 ttt180 -57.29 -39.84 76.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.711 -0.677 . . . . 74.4 110.57 174.176 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 168' ' ' LYS . . . . . 0.58 ' HB3' ' HZ2' ' B' ' 168' ' ' LYS . 2.8 mmmp? -60.39 -39.24 86.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.717 -0.674 . . . . 62.35 110.91 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -77.66 -45.02 26.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.081 -0.509 . . . . 64.21 110.799 -178.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 170' ' ' ALA . . . . . 0.755 ' HB2' HD12 ' B' ' 180' ' ' LEU . . . -59.19 -38.1 79.02 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.115 -0.493 . . . . 75.43 111.666 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 8.7 t -65.55 -31.68 72.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.092 -0.504 . . . . 72.32 111.157 -176.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -94.17 4.62 53.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.988 0.423 . . . . 71.44 110.718 -179.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -105.55 140.84 38.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.23 -0.441 . . . . 74.55 110.477 177.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.4 p -67.26 -54.92 16.47 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.994 -0.548 . . . . 71.22 111.166 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 175' ' ' SER . . . . . 0.444 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 25.0 p -76.55 -46.99 24.06 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.829 -0.623 . . . . 71.43 111.653 -174.548 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 69.8 mtp -66.49 -21.59 66.18 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.127 0.417 . . . . 74.23 112.127 -174.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 177' ' ' LYS . . . . . 0.417 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 4.2 ttmp? -64.94 -29.26 70.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.21 0.528 . . . . 63.12 109.828 176.132 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -94.7 -13.77 25.45 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 115.578 -0.737 . . . . 62.54 110.084 -176.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 179' ' ' LEU . . . . . 0.586 ' HB3' HG21 ' A' ' 33' ' ' ILE . 81.6 mt -86.71 -47.94 8.7 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.389 -0.823 . . . . 60.45 109.823 178.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 180' ' ' LEU . . . . . 0.755 HD12 ' HB2' ' B' ' 170' ' ' ALA . 8.9 mt -89.81 -2.17 58.16 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.759 -0.655 . . . . 64.45 111.339 -173.212 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 181' ' ' LYS . . . . . 0.417 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 64.1 pttt -64.92 -9.07 18.41 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.298 0.571 . . . . 74.42 110.518 173.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -61.71 -33.88 74.81 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.571 -0.741 . . . . 55.25 109.914 175.646 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 183' ' ' VAL . . . . . 0.522 ' HB ' ' OD1' ' A' ' 29' ' ' ASN . 14.3 p -113.15 -29.4 2.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 115.845 -0.616 . . . . 62.5 110.99 178.546 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 184' ' ' LEU . . . . . . . . . . . . . 91.8 mt -91.52 118.17 68.23 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.431 -0.35 . . . . 75.03 110.975 -176.796 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_exo -61.54 130.54 32.07 Favored 'Trans proline' 0 C--O 1.236 0.399 0 C-N-CA 122.835 2.357 . . . . 55.43 111.862 178.195 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 87.7 mm-40 -105.94 -152.68 0.48 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.938 -0.574 . . . . 74.34 110.685 -177.042 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 63.2 mttm 61.53 34.21 18.03 Favored 'General case' 0 N--CA 1.447 -0.625 0 O-C-N 123.994 0.809 . . . . 70.14 112.313 178.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.425 -0.798 . . . . 65.53 109.012 171.553 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.759 0 N-CA-C 112.065 -0.414 . . . . 43.45 112.065 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 27.0 m -108.88 1.23 9.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.138 0.494 . . . . 64.03 110.445 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 90.6 mt -99.15 -143.97 0.32 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.776 -0.647 . . . . 71.22 109.63 178.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.432 ' O ' ' HG2' ' A' ' 4' ' ' MET . 1.2 pmm? -73.62 81.67 1.52 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.797 0.808 . . . . 73.21 110.644 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -106.09 119.14 38.43 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.369 -0.832 . . . . 55.22 109.986 -178.263 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -108.09 9.61 28.31 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.441 -0.799 . . . . 73.42 111.28 -175.458 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 152.11 -85.78 0.15 Allowed Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.339 -0.934 . . . . 73.43 112.76 -178.5 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -155.35 156.91 36.28 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.971 0.415 . . . . 45.42 111.432 -177.039 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 28.9 m -83.5 173.3 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.88 -0.6 . . . . 61.22 110.78 176.521 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.7 mp -90.98 132.71 35.82 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.187 -0.46 . . . . 75.15 111.08 -177.147 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 26.7 m -120.75 121.6 38.57 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.891 -0.595 . . . . 65.31 109.931 177.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.8 tt -93.43 122.25 35.66 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.313 -0.625 . . . . 64.51 109.313 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.709 ' H ' ' HB3' ' A' ' 17' ' ' SER . . . -125.94 149.33 48.82 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.634 -0.712 . . . . 54.25 110.285 -179.753 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.65 -17.09 63.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.164 -0.471 . . . . 65.33 112.177 -175.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 23.2 p-10 -133.29 -44.54 0.84 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.896 0.379 . . . . 75.33 111.157 -178.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.69 44.26 1.19 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.991 0.424 . . . . 75.32 110.575 -176.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.709 ' HB3' ' H ' ' A' ' 13' ' ' ALA . 22.9 t -176.56 -52.48 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.692 -0.685 . . . . 54.41 109.225 -179.695 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.0 t -87.69 93.44 9.44 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.515 -0.55 . . . . 74.13 109.515 174.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -92.77 -158.77 0.62 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.927 -0.579 . . . . 54.02 111.769 -174.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.67 -157.85 0.24 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.671 -0.695 . . . . 61.4 110.82 -178.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.499 ' H ' HD23 ' A' ' 21' ' ' LEU . 2.6 pt? -71.38 -175.73 1.33 Allowed 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.328 0.585 . . . . 64.35 111.515 -176.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.436 ' O ' ' HB ' ' A' ' 23' ' ' ILE . 6.2 p-10 -106.16 178.58 4.52 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.332 -0.849 . . . . 62.14 111.566 -173.71 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.567 HG23 ' HB2' ' B' ' 122' ' ' ASP . 17.3 tt 169.35 128.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 114.476 -1.238 . . . . 62.14 108.054 172.541 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.7 p -147.82 141.46 25.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.205 0.526 . . . . 54.13 112.055 -172.42 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.793 ' HB3' ' HA ' ' B' ' 117' ' ' SER . 34.5 mttp -136.58 -7.45 1.94 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.632 -0.713 . . . . 73.13 110.561 177.011 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.652 ' HG2' HD22 ' B' ' 163' ' ' LEU . 21.3 mp0 -87.29 99.52 12.03 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.513 -0.767 . . . . 52.23 111.237 -166.506 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.583 ' CZ2' ' HB2' ' A' ' 62' ' ' ASP . 68.5 m95 -110.99 -74.33 0.65 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.408 -0.815 . . . . 72.44 111.466 -179.384 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 44.8 t -88.26 -62.85 1.4 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.737 -0.665 . . . . 54.03 112.144 -171.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.52 ' HA ' ' HB3' ' A' ' 32' ' ' ASN . 57.9 t30 -80.28 68.53 6.47 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.338 0.589 . . . . 71.5 111.951 -170.405 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 48.5 t -120.11 -63.1 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 108.698 -0.852 . . . . 62.42 108.698 171.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -88.04 -6.59 57.88 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.191 -0.913 . . . . 70.22 110.292 175.291 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.52 ' HB3' ' HA ' ' A' ' 29' ' ' ASN . 10.6 t30 -65.38 -43.04 92.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.548 -0.751 . . . . 72.52 111.074 -176.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.839 HG21 ' HB3' ' B' ' 179' ' ' LEU . 38.5 mm -60.41 -40.27 83.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-O 121.478 0.656 . . . . 72.4 110.594 177.176 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.705 HD12 HD21 ' B' ' 149' ' ' LEU . 82.9 mt -69.23 -25.84 64.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.489 -0.778 . . . . 73.1 110.71 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 54.1 ttt180 -67.47 -47.49 69.95 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.117 -0.492 . . . . 71.55 110.085 175.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -64.11 -39.3 93.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.499 -0.773 . . . . 63.14 111.777 -177.366 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -97.43 8.37 44.74 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.348 -0.387 . . . . 52.3 111.036 -175.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 14.3 t70 53.32 64.38 1.87 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.213 -0.903 . . . . 70.4 111.949 177.131 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.667 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 16.8 m-85 -92.82 -6.24 49.29 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.307 -0.627 . . . . 73.1 109.307 167.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 69.43 88.43 0.1 Allowed Pre-proline 0 CA--C 1.53 0.182 0 CA-C-N 114.789 -1.096 . . . . 71.2 111.233 -178.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.443 ' HA ' HD11 ' B' ' 149' ' ' LEU . 16.8 Cg_exo -67.23 135.03 35.63 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.633 2.222 . . . . 71.42 110.505 174.119 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.657 ' H ' HD12 ' B' ' 149' ' ' LEU . 33.4 tptt -80.66 -74.47 0.31 Allowed 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.284 -0.566 . . . . 53.13 111.565 -171.884 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.575 ' HD2' HG22 ' B' ' 147' ' ' VAL . 44.7 t80 -120.53 130.19 54.14 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.864 0.364 . . . . 75.32 110.024 -178.36 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -78.18 146.33 35.08 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.063 -0.517 . . . . 71.33 110.031 -179.066 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 49.0 t -78.04 88.11 4.18 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.214 0.531 . . . . 63.23 110.781 -177.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -117.1 11.71 14.29 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 122.01 0.909 . . . . 53.55 109.024 174.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 48.9 t -91.26 104.52 15.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.182 -0.917 . . . . 73.44 110.246 -178.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.446 ' H ' ' HD2' ' A' ' 48' ' ' LYS . 0.1 OUTLIER -114.68 142.22 46.77 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.62 -0.718 . . . . 61.2 109.637 177.731 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.735 ' HB3' ' HD1' ' A' ' 51' ' ' PHE . 7.1 mp -57.74 -44.77 86.29 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.334 0.494 . . . . 72.45 112.334 -173.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.858 ' HB3' ' HD2' ' B' ' 142' ' ' LYS . . . 39.49 49.48 1.94 Allowed 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.806 0.691 . . . . 74.34 111.85 -179.422 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.735 ' HD1' ' HB3' ' A' ' 49' ' ' LEU . 48.4 p90 -88.48 167.92 13.05 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.889 -0.596 . . . . 74.42 110.415 -175.467 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.411 ' HE3' ' HB2' ' A' ' 52' ' ' LYS . 29.3 ttmt -99.68 115.0 28.46 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.223 0.535 . . . . 74.52 110.809 -178.161 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.553 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 34.9 t -110.47 95.23 5.44 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.668 -0.696 . . . . 74.34 110.018 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 69.08 12.45 8.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.998 -1.001 . . . . 43.55 112.3 176.23 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 138.78 -40.87 1.41 Allowed Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.523 -0.846 . . . . 44.21 112.675 176.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.485 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 9.8 pt-20 -96.42 150.91 20.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.106 0.479 . . . . 73.02 111.157 -175.258 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.6 mm -83.44 120.57 34.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.585 -0.734 . . . . 45.4 110.533 178.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.555 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 29.1 mmmt -106.25 106.92 17.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.02 -0.536 . . . . 73.15 110.124 -179.574 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -81.44 98.49 8.26 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.952 0.406 . . . . 74.14 111.256 178.545 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.555 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 41.3 m-85 -117.74 138.26 52.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.228 -0.442 . . . . 73.33 110.953 179.455 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 4.3 p -136.78 3.96 2.76 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.565 -0.743 . . . . 53.31 109.979 175.023 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.583 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 29.9 t70 -125.18 122.44 37.07 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.416 -0.811 . . . . 65.31 109.965 -178.885 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.1 tt -66.98 -42.82 84.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 72.43 110.032 -176.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.464 ' HB3' ' OD2' ' A' ' 62' ' ' ASP . 51.1 tt0 -51.77 -50.69 60.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.815 -0.629 . . . . 74.23 111.376 -179.719 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 10.5 m -69.21 -38.02 78.36 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.855 -0.611 . . . . 60.23 110.934 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.5 tp -68.79 -38.68 80.16 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.234 -0.439 . . . . 62.2 111.001 -178.018 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -57.28 -43.15 82.85 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.076 -0.511 . . . . 73.04 111.135 179.065 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -63.48 -40.43 97.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 72.42 110.429 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.506 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 81.3 t80 -67.55 -42.41 82.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.757 -0.656 . . . . 75.43 110.598 179.124 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.98 -32.52 73.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.998 -0.547 . . . . 72.32 111.293 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.4 m -71.61 -31.81 67.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.401 -0.363 . . . . 63.14 111.377 -179.278 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.506 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 20.6 pt20 -85.21 -9.5 57.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.229 0.538 . . . . 54.13 110.394 179.285 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.553 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 28.3 mmmt -93.42 111.24 22.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.713 -0.676 . . . . 73.3 109.651 174.46 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.6 m -55.55 -37.11 67.56 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.669 0.271 . . . . 74.31 111.137 -178.058 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.548 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 21.6 m -75.33 -42.92 53.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.569 -0.287 . . . . 71.43 111.325 -178.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.464 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 80.8 mtp -77.87 -24.16 48.6 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.659 0.266 . . . . 72.22 111.614 -174.436 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -60.13 -36.7 78.08 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.853 0.359 . . . . 73.41 111.31 -179.315 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -84.42 -16.11 43.81 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.953 0.883 . . . . 72.31 109.473 -174.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 75' ' ' SER . 59.6 mt -81.1 -51.78 8.09 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 114.312 -1.313 . . . . 54.4 109.697 178.366 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 80' ' ' LEU . 4.2 mm? -78.49 -30.45 47.24 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.374 -0.83 . . . . 72.2 112.638 -174.001 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -64.53 -10.18 24.09 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 118.367 0.531 . . . . 72.04 112.003 -173.097 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -75.55 -39.66 57.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.912 0.387 . . . . 73.31 110.98 -177.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 27.7 m -114.59 -5.92 11.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.091 -0.504 . . . . 70.32 110.92 -178.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 67.9 tp -122.01 95.84 47.19 Favored Pre-proline 0 C--N 1.321 -0.649 0 CA-C-N 115.777 -0.647 . . . . 75.34 109.841 -178.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -69.85 116.2 4.46 Favored 'Trans proline' 0 C--O 1.233 0.233 0 C-N-CA 123.385 2.723 . . . . 74.53 112.753 -177.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -83.05 100.35 10.43 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.012 0.434 . . . . 73.34 110.855 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -85.16 -22.4 28.81 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.775 -0.648 . . . . 75.41 110.008 175.667 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 . . . . . 0 C--N 1.325 -0.465 0 CA-C-N 115.415 -0.811 . . . . 73.25 110.033 -178.654 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.235 0 N-CA-C 112.316 -0.314 . . . . 54.52 112.316 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.655 HG22 ' HG ' ' B' ' 103' ' ' LEU . 2.7 p -93.8 -57.11 4.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.617 0.246 . . . . 74.4 110.926 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 103' ' ' LEU . . . . . 0.655 ' HG ' HG22 ' B' ' 102' ' ' VAL . 97.6 mt -139.01 169.51 17.65 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.042 -0.355 . . . . 71.33 110.042 -179.39 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 47.55 28.45 1.19 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.437 1.095 . . . . 72.24 112.861 176.076 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -96.36 119.56 35.08 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.744 -0.662 . . . . 52.11 110.701 178.769 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -97.16 5.12 50.73 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.415 -0.811 . . . . 74.41 110.428 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 91.05 -63.43 2.81 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 121.034 -0.603 . . . . 64.54 112.507 179.426 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -111.88 145.15 40.02 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.744 0.307 . . . . 70.22 110.435 179.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 23.3 m -99.67 -179.91 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.077 -0.51 . . . . 74.12 110.561 179.241 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 8.0 mp -85.16 113.66 21.7 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.925 -0.398 . . . . 72.11 109.925 177.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 12.4 m -118.62 114.13 22.3 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.369 -0.378 . . . . 75.22 110.495 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 2.9 tt -78.95 111.58 15.28 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.101 -0.703 . . . . 73.54 109.101 177.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 113' ' ' ALA . . . . . 0.483 ' O ' ' HB3' ' B' ' 117' ' ' SER . . . -95.42 104.39 16.29 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.709 -0.678 . . . . 72.24 110.568 -176.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.514 ' HA ' ' HB3' ' B' ' 118' ' ' SER . . . -81.75 -2.01 49.17 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.158 0.504 . . . . 75.43 111.024 -178.843 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 29.7 p-10 -123.81 -21.65 5.1 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.75 -0.659 . . . . 54.42 111.456 -177.63 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 7.0 mp -119.3 6.36 11.19 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 111.976 0.361 . . . . 74.35 111.976 -179.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.793 ' HA ' ' HB3' ' A' ' 25' ' ' LYS . 41.3 t -140.43 -59.73 0.52 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.798 -0.445 . . . . 73.33 109.798 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 118' ' ' SER . . . . . 0.514 ' HB3' ' HA ' ' B' ' 114' ' ' ALA . 22.7 t -78.87 83.09 5.02 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.682 -0.488 . . . . 71.12 109.682 177.465 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -158.97 -148.85 0.2 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.846 -0.616 . . . . 74.33 110.228 -176.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 120' ' ' THR . . . . . 0.517 ' O ' ' HE2' ' A' ' 25' ' ' LYS . 1.2 m -55.77 110.74 0.77 Allowed 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.559 0.344 . . . . 64.43 110.218 176.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 121' ' ' LEU . . . . . 0.45 ' HB3' ' HD2' ' B' ' 185' ' ' PRO . 0.2 OUTLIER -65.94 166.24 11.73 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 113.465 0.913 . . . . 74.53 113.465 -171.42 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 122' ' ' ASP . . . . . 0.567 ' HB2' HG23 ' A' ' 23' ' ' ILE . 1.8 p30 -154.73 -177.76 6.73 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-N 114.149 -1.387 . . . . 74.53 109.022 176.042 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -152.01 149.93 13.42 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 115.901 -0.591 . . . . 62.11 111.423 -170.046 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 2.7 p -86.08 137.76 32.44 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.559 -0.746 . . . . 74.54 111.222 -179.051 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.71 6.71 6.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.375 0.607 . . . . 64.23 109.552 175.088 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 23.6 mp0 -114.4 121.88 44.93 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.461 -0.79 . . . . 71.54 109.762 -176.231 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -94.54 -79.76 0.42 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.18 0.514 . . . . 75.45 110.435 -176.784 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 128' ' ' SER . . . . . 0.408 ' O ' ' HB2' ' B' ' 132' ' ' ASN . 23.1 t -104.37 1.2 29.95 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.408 0.623 . . . . 73.4 109.825 -178.897 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -57.91 -32.02 67.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.198 -0.91 . . . . 71.4 111.822 -174.018 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 21.8 t -60.94 -61.37 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.961 -0.563 . . . . 74.51 111.897 -174.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -94.19 -4.36 49.17 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.447 -0.342 . . . . 65.24 111.775 -173.18 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.544 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 63.7 t30 -59.75 -50.25 74.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.096 0.474 . . . . 72.14 110.201 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 133' ' ' ILE . . . . . 0.545 ' CG2' ' HB3' ' A' ' 79' ' ' LEU . 46.8 mm -59.38 -48.19 87.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.679 -0.691 . . . . 73.24 110.966 -179.033 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 80.9 mt -57.86 -36.58 72.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.022 -0.535 . . . . 73.14 111.263 177.039 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 36.9 ttt180 -67.17 -44.21 80.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.231 -0.44 . . . . 75.34 110.532 179.393 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 136' ' ' GLU . . . . . 0.544 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 10.6 mm-40 -68.3 -39.67 81.98 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.923 -0.581 . . . . 73.42 111.562 -178.046 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 52.4 m-80 -90.0 5.16 47.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.996 0.427 . . . . 74.52 110.695 -179.258 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 11.8 t70 56.53 57.03 5.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.112 -0.949 . . . . 74.4 112.19 173.781 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -90.61 8.9 31.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.791 -0.64 . . . . 72.05 109.996 173.052 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 60.61 80.93 0.25 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 114.926 -1.034 . . . . 73.42 111.488 -176.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -71.15 156.12 60.02 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 121.732 1.622 . . . . 61.33 109.831 171.389 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 142' ' ' LYS . . . . . 0.858 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -77.69 -144.19 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.239 -0.585 . . . . 70.23 111.739 -176.804 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -75.72 165.64 24.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.115 -0.493 . . . . 75.44 111.089 -169.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 144' ' ' LEU . . . . . 0.927 ' H ' HD13 ' B' ' 144' ' ' LEU . 0.0 OUTLIER -64.16 160.94 17.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.785 -0.643 . . . . 75.24 110.48 175.757 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 50.1 t -94.91 108.89 20.94 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.226 0.536 . . . . 53.12 111.271 -176.173 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -97.45 8.5 44.5 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.656 -0.702 . . . . 74.1 109.647 171.694 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 147' ' ' VAL . . . . . 0.575 HG22 ' HD2' ' A' ' 43' ' ' PHE . 41.2 t -82.22 82.67 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 CA-C-N 115.581 -0.736 . . . . 73.11 111.258 -175.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.75 112.58 16.88 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.14 -1.059 . . . . 74.21 108.14 165.649 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.705 HD21 HD12 ' A' ' 34' ' ' LEU . 63.0 tp -73.68 85.79 1.64 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.101 -0.5 . . . . 75.21 110.173 -176.446 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -90.71 86.51 6.37 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.366 -0.833 . . . . 73.22 110.485 178.528 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 151' ' ' PHE . . . . . 0.599 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 51.6 p90 -103.24 171.23 7.49 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.934 -0.575 . . . . 65.43 109.785 178.492 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -106.5 125.76 51.41 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.088 0.47 . . . . 54.24 111.009 -179.07 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 153' ' ' CYS . . . . . 0.43 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 48.6 t -122.09 104.29 9.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.74 -0.663 . . . . 72.23 109.746 176.647 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 65.38 26.48 12.0 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.809 -0.632 . . . . 65.13 111.504 176.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 114.94 -35.95 4.15 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.719 -0.753 . . . . 53.21 113.148 176.573 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -92.64 145.13 24.66 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.971 0.415 . . . . 73.24 110.909 -176.184 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.2 mm -83.0 131.31 34.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.893 -0.594 . . . . 64.45 109.669 175.611 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 158' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -117.05 100.7 7.92 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.319 -0.401 . . . . 55.55 110.468 -177.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.09 103.45 10.91 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.127 0.489 . . . . 44.31 111.318 178.313 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -116.6 113.87 23.31 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.962 -0.563 . . . . 74.31 110.84 177.315 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 14.5 m -103.79 -0.14 29.66 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.454 0.645 . . . . 60.3 109.753 174.329 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 162' ' ' ASP . . . . . 0.418 ' OD2' ' HB3' ' B' ' 164' ' ' GLN . 0.3 OUTLIER -133.65 141.78 47.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.3 -0.864 . . . . 73.14 110.612 -175.936 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 163' ' ' LEU . . . . . 0.652 HD22 ' HG2' ' A' ' 26' ' ' GLN . 44.8 tp -71.6 -34.33 69.8 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.952 -0.567 . . . . 74.34 111.341 -177.347 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 164' ' ' GLN . . . . . 0.467 ' O ' ' HG3' ' B' ' 168' ' ' LYS . 46.9 tt0 -60.09 -49.19 78.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.071 0.462 . . . . 73.11 110.238 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 20.9 m -58.43 -42.5 87.43 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.559 -0.746 . . . . 63.42 111.21 178.332 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 67.4 tp -68.66 -40.34 80.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.451 -0.341 . . . . 64.32 110.756 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 167' ' ' ARG . . . . . 1.098 ' HG3' HD21 ' B' ' 184' ' ' LEU . 15.1 ttp180 -61.11 -44.64 97.03 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.357 -0.383 . . . . 74.14 110.38 -178.783 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 168' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' B' ' 164' ' ' GLN . 48.9 mtmt -60.32 -29.77 69.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.978 -0.555 . . . . 71.14 111.317 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -84.7 -50.19 7.84 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.337 -0.392 . . . . 54.23 110.762 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.53 -32.82 74.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.084 -0.507 . . . . 70.42 111.968 -176.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 17.6 t -69.6 -19.0 63.66 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.886 0.328 . . . . 71.55 111.886 -176.497 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -104.88 2.34 29.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.912 0.387 . . . . 74.42 110.485 177.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 173' ' ' LYS . . . . . 0.43 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 29.6 mmmt -103.04 111.48 23.84 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.767 -0.651 . . . . 72.52 110.056 179.003 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 69.5 m -55.41 -34.38 64.34 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.8 0.333 . . . . 75.12 111.775 -178.152 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 175' ' ' SER . . . . . 0.46 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 6.8 m -77.03 -46.49 23.56 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.899 0.38 . . . . 75.13 110.975 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.401 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 73.9 mtp -78.31 -21.97 48.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.588 -0.278 . . . . 74.02 111.471 -173.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 177' ' ' LYS . . . . . 0.473 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 79.2 tttt -58.65 -37.46 76.01 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.164 0.507 . . . . 74.1 110.393 178.283 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -85.36 -13.95 47.9 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.6 0.714 . . . . 72.12 109.916 -175.519 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 179' ' ' LEU . . . . . 0.839 ' HB3' HG21 ' A' ' 33' ' ' ILE . 59.3 mt -84.28 -50.03 8.23 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 114.674 -1.148 . . . . 75.14 110.351 -179.296 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -88.84 -20.09 25.08 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.594 0.59 . . . . 71.03 112.594 -173.471 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 181' ' ' LYS . . . . . 0.473 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 62.7 pttt -59.95 -18.41 45.09 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.2 0.445 . . . . 64.31 112.2 -174.287 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -55.76 -49.42 73.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.004 0.43 . . . . 64.33 110.879 -177.272 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 183' ' ' VAL . . . . . 0.433 HG13 HD22 ' A' ' 29' ' ' ASN . 18.4 m -109.71 3.66 9.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.768 -0.651 . . . . 42.43 110.48 -179.089 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 184' ' ' LEU . . . . . 1.098 HD21 ' HG3' ' B' ' 167' ' ' ARG . 46.1 tp -135.34 83.53 37.78 Favored Pre-proline 0 N--CA 1.447 -0.614 0 CA-C-N 115.956 -0.565 . . . . 73.3 110.352 -175.823 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 185' ' ' PRO . . . . . 0.45 ' HD2' ' HB3' ' B' ' 121' ' ' LEU . 66.8 Cg_endo -75.73 103.74 1.79 Allowed 'Trans proline' 0 CA--C 1.528 0.219 0 C-N-CA 122.979 2.453 . . . . 73.42 112.772 -177.532 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 77.7 mm-40 -61.84 132.16 52.15 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.798 -0.637 . . . . 64.02 110.788 -176.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -95.79 -11.04 27.53 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.429 -0.805 . . . . 73.33 110.507 177.564 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 . . . . . 0 C--O 1.246 0.895 0 CA-C-O 118.54 -0.743 . . . . 65.05 110.492 179.645 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 112.038 -0.425 . . . . 70.24 112.038 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.68 HG23 HD22 ' A' ' 3' ' ' LEU . 18.8 m -107.1 -29.43 2.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 120.831 0.348 . . . . 72.4 110.417 178.25 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.68 HD22 HG23 ' A' ' 2' ' ' VAL . 4.1 mm? -85.26 88.2 7.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.182 0.515 . . . . 62.02 109.751 174.283 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 89.3 mtp -103.18 97.12 7.26 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.658 -0.701 . . . . 73.34 109.8 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -129.45 122.47 29.4 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.764 -0.653 . . . . 74.23 110.38 -178.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -127.74 101.16 6.25 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.357 -0.838 . . . . 74.54 110.002 -178.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.98 -145.12 13.57 Favored Glycine 0 N--CA 1.441 -0.97 0 C-N-CA 120.446 -0.883 . . . . 52.35 111.96 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -160.75 111.84 1.83 Allowed 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 110.228 -0.286 . . . . 24.31 110.228 -179.337 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 57.5 t -67.96 115.69 6.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 109.841 -0.429 . . . . 63.32 109.841 176.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 94.8 mt -54.7 130.54 40.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.93 -0.577 . . . . 71.22 110.704 -178.06 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 46.1 m -73.05 108.54 6.01 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.758 -0.655 . . . . 65.24 111.451 -178.104 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.506 HD23 ' N ' ' A' ' 13' ' ' ALA . 2.2 tt -81.72 141.59 33.43 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.306 -0.998 . . . . 73.34 108.306 174.114 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.56 ' HB2' ' HB3' ' A' ' 17' ' ' SER . . . -54.09 161.07 1.36 Allowed 'General case' 0 C--O 1.236 0.39 0 N-CA-C 112.507 0.558 . . . . 63.14 112.507 -177.672 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.28 -28.0 69.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.629 -0.714 . . . . 63.35 111.487 -174.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -149.09 -47.88 0.14 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.346 -0.388 . . . . 72.35 110.347 176.131 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.7 mt -157.38 137.22 12.38 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.676 -0.693 . . . . 73.22 110.916 -174.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.56 ' HB3' ' HB2' ' A' ' 13' ' ' ALA . 33.1 t 174.93 -24.59 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.966 -1.016 . . . . 72.43 108.539 176.157 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.9 t -77.81 83.77 4.15 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.423 -0.808 . . . . 70.03 110.155 178.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -98.03 26.94 4.85 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.044 -0.98 . . . . 64.4 108.722 173.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.8 m -59.43 105.19 0.33 Allowed 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 113.856 -1.52 . . . . 73.35 110.939 -173.193 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.43 ' HA ' ' HG2' ' B' ' 126' ' ' GLN . 4.0 tt -161.11 109.32 1.54 Allowed 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.948 -0.569 . . . . 72.21 109.593 -178.684 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.612 ' OD2' ' HA ' ' B' ' 124' ' ' SER . 3.5 p-10 -119.55 143.3 47.68 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.453 -0.573 . . . . 71.43 109.453 178.345 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 10.9 tt -126.43 123.44 63.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-O 121.177 0.513 . . . . 71.4 111.09 -174.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.574 ' HB2' ' OD1' ' B' ' 122' ' ' ASP . 31.7 p -94.97 -171.0 2.32 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.815 -0.63 . . . . 51.2 110.401 179.289 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -119.74 -54.03 2.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.152 0.501 . . . . 74.11 109.929 176.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -92.05 53.57 2.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.788 -0.642 . . . . 74.23 111.81 -173.035 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.447 ' HE3' ' C ' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -84.33 42.45 0.89 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.481 0.657 . . . . 65.11 111.439 178.053 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.1 m -110.44 17.4 20.85 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.778 -0.647 . . . . 74.33 110.42 -179.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -85.44 44.21 1.08 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.226 0.536 . . . . 72.01 110.516 -176.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 15.3 m -69.14 114.55 6.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.086 -0.507 . . . . 52.14 111.64 -176.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 44.3 p90 44.47 28.16 0.29 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.4 1.08 . . . . 73.45 112.887 178.53 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -61.72 -53.33 57.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 64.24 111.108 -174.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.509 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 48.9 mm -59.3 -43.65 90.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.924 -0.58 . . . . 73.45 110.832 -177.597 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 86.5 mt -63.26 -35.13 79.33 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.759 -0.655 . . . . 74.41 111.012 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.439 HH11 ' HD3' ' A' ' 35' ' ' ARG . 35.0 ttt180 -70.58 -46.6 63.17 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.92 0.391 . . . . 64.35 110.322 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -59.21 -46.4 88.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.903 -0.59 . . . . 61.34 111.308 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -86.89 1.34 52.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.983 -0.553 . . . . 73.15 111.227 -177.03 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.6 t70 60.64 71.26 0.57 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.33 -0.85 . . . . 74.0 112.455 175.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -96.41 -6.8 36.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.508 -0.769 . . . . 74.43 110.105 167.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 57.84 73.69 0.72 Allowed Pre-proline 0 CA--C 1.53 0.199 0 CA-C-N 115.263 -0.881 . . . . 62.14 110.582 -176.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -78.44 150.35 25.05 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 122.918 2.412 . . . . 73.53 112.629 -177.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.554 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 5.5 mptp? -108.74 135.95 49.12 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.859 -0.61 . . . . 74.12 109.681 177.027 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 74.5 t80 174.28 100.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 O-C-N 123.637 0.585 . . . . 64.2 109.758 -175.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 86.7 mt -123.39 114.75 20.57 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.516 -0.55 . . . . 72.42 109.516 175.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.681 ' SG ' HG22 ' A' ' 47' ' ' VAL . 47.2 t -130.31 108.28 9.89 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.359 -0.382 . . . . 72.1 111.066 -175.159 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 46' ' ' GLU . 36.9 tt0 -117.5 21.61 12.92 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.738 0.78 . . . . 75.21 109.48 176.631 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.681 HG22 ' SG ' ' A' ' 45' ' ' CYS . 17.5 m -75.67 157.38 5.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.814 -0.63 . . . . 74.13 110.471 -178.102 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.485 ' HB3' ' OG ' ' A' ' 61' ' ' SER . 0.1 OUTLIER -153.84 143.44 21.69 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.554 -0.748 . . . . 73.14 110.092 -179.657 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.562 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.0 mp -69.64 82.06 0.42 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.155 -0.475 . . . . 52.24 109.957 175.065 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.454 ' H ' ' HB2' ' B' ' 142' ' ' LYS . . . -82.56 67.38 8.59 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.259 0.552 . . . . 74.31 110.365 178.14 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.562 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 49.2 p90 -97.85 164.51 12.35 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.883 -0.599 . . . . 75.14 110.672 -177.714 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.411 ' HD2' ' C ' ' A' ' 55' ' ' GLY . 11.2 tppt? -88.41 123.97 33.49 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.636 -0.711 . . . . 73.3 110.57 -178.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 17.6 t -141.72 119.84 12.12 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.326 -0.397 . . . . 63.15 109.954 176.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 69.99 13.9 7.87 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.711 -0.677 . . . . 73.54 112.194 177.561 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.411 ' C ' ' HD2' ' A' ' 52' ' ' LYS . . . 104.64 -18.53 43.95 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.33 -0.938 . . . . 54.21 112.351 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -110.37 153.04 25.5 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.86 0.362 . . . . 65.3 110.08 179.454 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 47.6 mm -81.31 115.48 23.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.739 -0.467 . . . . 72.34 109.739 177.308 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -101.19 103.17 14.19 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.403 -0.362 . . . . 70.42 110.223 -177.63 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.58 124.82 28.57 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.391 -0.368 . . . . 72.12 111.526 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.428 ' CE2' ' HA ' ' A' ' 66' ' ' LEU . 74.6 m-85 -124.38 104.04 8.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.144 0.497 . . . . 70.31 111.44 176.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.485 ' OG ' ' HB3' ' A' ' 48' ' ' LYS . 5.8 m -95.2 -2.81 48.92 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.389 -0.823 . . . . 73.14 109.407 173.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -130.86 136.94 49.1 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.225 -0.898 . . . . 72.34 110.783 -177.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.6 tp -81.95 -27.24 33.37 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.909 -0.587 . . . . 65.03 110.801 -177.144 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 63.5 tp60 -65.91 -44.2 85.93 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.244 0.545 . . . . 75.32 110.112 -178.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.424 ' HA ' ' HZ2' ' A' ' 68' ' ' LYS . 45.5 m -65.66 -41.16 92.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.665 -0.698 . . . . 73.01 110.567 175.522 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.428 ' HA ' ' CE2' ' A' ' 60' ' ' PHE . 45.8 tp -61.1 -46.8 89.14 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 63.25 111.05 -178.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.449 ' HG3' HD21 ' A' ' 84' ' ' LEU . 50.3 ttt-85 -55.31 -48.34 74.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.135 -0.484 . . . . 65.11 111.063 178.292 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.424 ' HZ2' ' HA ' ' A' ' 65' ' ' SER . 9.9 mtmp? -70.52 -30.39 67.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.199 -0.455 . . . . 72.54 111.333 -177.713 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.514 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 81.7 t80 -70.22 -45.86 65.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.309 -0.405 . . . . 53.22 110.149 176.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.21 -30.48 71.62 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.095 0.474 . . . . 73.12 110.465 178.17 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.5 t -71.02 -29.61 65.58 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.721 -0.672 . . . . 64.11 111.226 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.514 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 9.7 pt20 -86.66 -9.48 55.9 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.215 0.531 . . . . 71.32 110.01 177.828 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.917 ' HE2' ' HA ' ' A' ' 73' ' ' LYS . 9.0 mmpt? -81.79 164.03 21.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.653 -0.703 . . . . 74.11 109.945 176.073 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.2 t -100.45 -42.82 6.44 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.239 -0.652 . . . . 71.23 109.239 173.585 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.49 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 15.1 p -73.16 -58.8 3.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.648 -0.706 . . . . 71.4 110.778 179.018 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.457 ' HA ' HD12 ' A' ' 79' ' ' LEU . 86.9 mtp -65.09 -17.2 64.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.68 -0.691 . . . . 75.13 111.746 -176.564 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.535 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 24.8 ttpp -59.02 -38.32 78.99 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.272 -0.422 . . . . 65.25 110.825 -178.792 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -106.8 5.05 28.2 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.164 0.507 . . . . 72.01 110.816 -178.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.763 ' HB3' HG21 ' B' ' 133' ' ' ILE . 31.2 mt -81.41 -54.0 5.83 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.819 -0.628 . . . . 72.23 110.301 176.682 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.53 -5.59 50.61 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.095 -0.502 . . . . 75.34 111.98 -174.13 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 62.7 pttt -65.93 -9.07 26.29 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.958 0.408 . . . . 72.14 111.19 -178.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -61.02 -37.53 82.89 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.774 -0.648 . . . . 75.13 110.406 176.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.435 ' O ' ' HD3' ' A' ' 85' ' ' PRO . 14.8 p -115.54 -23.18 4.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.801 -0.636 . . . . 74.03 110.453 178.46 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.462 ' O ' ' HA ' ' A' ' 81' ' ' LYS . 58.8 tp -96.42 105.27 21.43 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.975 -0.557 . . . . 75.13 110.315 -179.638 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.435 ' HD3' ' O ' ' A' ' 83' ' ' VAL . 9.1 Cg_exo -71.88 103.86 1.54 Allowed 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 123.178 2.585 . . . . 72.41 111.969 -177.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -100.44 118.22 36.21 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.053 -0.521 . . . . 62.02 111.261 -176.138 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt 53.41 76.84 0.19 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.792 -1.095 . . . . 71.3 112.425 174.735 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 . . . . . 0 C--N 1.308 -1.207 0 CA-C-N 114.224 -1.353 . . . . 74.14 110.087 173.828 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.391 0 N-CA-C 111.942 -0.463 . . . . 51.11 111.942 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 17.3 t -67.51 -18.35 23.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.948 0.404 . . . . 54.25 110.902 -177.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 103' ' ' LEU . . . . . 0.405 ' H ' HD22 ' B' ' 103' ' ' LEU . 2.8 mm? -71.28 -17.47 62.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.284 -0.416 . . . . 72.25 110.606 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 73.5 mtp 60.9 21.61 11.81 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.518 0.675 . . . . 72.04 110.546 -177.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -143.25 116.49 8.99 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.345 -0.843 . . . . 73.33 108.903 177.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -82.5 136.13 34.96 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.573 -0.739 . . . . 54.34 111.116 -173.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -85.05 90.71 1.66 Allowed Glycine 0 N--CA 1.44 -1.065 0 N-CA-C 111.053 -0.819 . . . . 75.33 111.053 176.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -68.79 96.96 0.78 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.856 0.36 . . . . 51.15 110.54 -178.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 42.1 t -78.53 104.76 6.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.92 -0.582 . . . . 72.14 109.689 177.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 92.1 mt -54.54 121.39 8.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.918 -0.583 . . . . 73.53 110.93 -177.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 87.7 m -77.36 106.1 8.89 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.779 -0.646 . . . . 44.53 110.602 -179.181 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 2.9 tt -85.14 126.69 33.83 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.394 -0.821 . . . . 63.1 108.958 178.306 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.06 125.41 22.55 Favored 'General case' 0 C--N 1.329 -0.288 0 O-C-N 123.304 0.378 . . . . 70.25 110.6 178.471 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -57.43 -38.07 73.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.082 -0.508 . . . . 73.12 112.056 -172.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -84.96 27.82 0.74 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.417 -0.356 . . . . 52.13 111.114 -177.542 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 76.8 mt 62.3 27.32 16.34 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.072 0.463 . . . . 61.14 110.946 175.657 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 13.6 t -88.74 16.86 6.13 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.896 -0.593 . . . . 55.33 110.929 -176.443 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 15.4 t -134.21 94.16 3.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.244 -0.434 . . . . 73.31 109.853 178.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -161.54 162.69 30.35 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.893 -0.594 . . . . 42.43 110.57 -179.237 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 94.6 m -157.9 121.53 4.04 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.411 -0.588 . . . . 64.24 109.411 177.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 121' ' ' LEU . . . . . 0.411 HD11 HG12 ' B' ' 183' ' ' VAL . 6.3 tt -106.81 115.24 29.85 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.601 -0.518 . . . . 73.24 109.601 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 122' ' ' ASP . . . . . 0.574 ' OD1' ' HB2' ' A' ' 24' ' ' SER . 1.3 p30 -136.79 163.71 30.0 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.658 -0.701 . . . . 74.42 110.193 -179.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 12.3 tt -151.62 141.13 15.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 120.907 0.384 . . . . 73.32 111.046 -177.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.612 ' HA ' ' OD2' ' A' ' 22' ' ' ASP . 4.5 p -112.23 156.01 23.06 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.242 -0.435 . . . . 71.12 110.255 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? -112.41 -25.74 9.06 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.091 0.472 . . . . 75.23 109.862 -179.266 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 126' ' ' GLN . . . . . 0.512 ' HB2' ' H ' ' A' ' 22' ' ' ASP . 2.8 mp0 -92.47 36.07 1.01 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.59 -0.732 . . . . 74.41 111.405 -178.044 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 62.1 t-105 -77.9 67.64 3.8 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.686 0.755 . . . . 65.13 109.324 175.023 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 15.4 p -118.1 -12.39 10.05 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.374 -0.83 . . . . 73.25 111.038 -178.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -68.05 108.41 3.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.268 -0.424 . . . . 73.12 110.757 -177.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 6.1 m -130.81 105.98 11.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.148 -0.478 . . . . 62.13 111.082 178.38 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 39.0 p90 45.76 28.21 0.54 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.168 0.987 . . . . 73.5 113.27 175.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.479 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 27.3 p-10 -58.55 -48.49 80.7 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.77 0.319 . . . . 61.25 111.431 -174.272 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 133' ' ' ILE . . . . . 0.763 HG21 ' HB3' ' A' ' 79' ' ' LEU . 43.0 mm -64.73 -41.21 91.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.101 0.477 . . . . 73.41 111.156 -177.766 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.447 HD22 HD23 ' A' ' 49' ' ' LEU . 9.8 mp -65.45 -35.87 82.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.737 -0.665 . . . . 75.44 110.613 179.535 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -69.92 -41.65 74.36 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.79 -0.641 . . . . 62.31 110.264 177.498 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 136' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 5.8 mm-40 -64.25 -42.2 96.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.964 -0.562 . . . . 75.44 111.456 178.732 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -94.17 7.43 45.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.328 -0.396 . . . . 55.44 111.672 -175.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 10.4 t70 60.97 43.32 11.69 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.794 -0.639 . . . . 74.21 112.233 172.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -74.05 -10.56 59.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.877 0.37 . . . . 71.2 110.66 172.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 58.09 78.26 0.37 Allowed Pre-proline 0 C--O 1.232 0.182 0 CA-C-N 115.325 -0.852 . . . . 63.21 110.313 -174.033 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.414 ' HG3' ' HB3' ' B' ' 134' ' ' LEU . 10.9 Cg_endo -86.17 145.71 8.58 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 122.887 2.391 . . . . 52.11 112.418 -178.77 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 142' ' ' LYS . . . . . 0.454 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 4.7 mptp? -109.91 139.46 44.97 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.097 -0.502 . . . . 70.54 110.028 178.587 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -173.13 30.04 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.82 0.819 . . . . 73.4 109.098 -176.123 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 80.8 mt -80.73 112.27 17.95 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.252 -0.885 . . . . 52.23 110.536 -176.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 145' ' ' CYS . . . . . 0.6 ' HB3' HG11 ' A' ' 47' ' ' VAL . 17.4 p -158.83 138.95 12.17 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.861 -0.609 . . . . 75.32 110.721 -177.63 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -124.69 102.59 7.67 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.875 -0.602 . . . . 73.44 109.487 173.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 35.8 m -133.45 161.18 41.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.099 -0.5 . . . . 44.03 110.051 178.321 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -156.19 142.17 18.1 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.908 -0.587 . . . . 73.42 109.553 178.323 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.477 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.8 mp -68.42 75.76 0.26 Allowed 'General case' 0 C--O 1.219 -0.535 0 O-C-N 123.91 0.756 . . . . 72.22 109.558 174.463 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.554 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -81.98 59.25 4.26 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.202 0.525 . . . . 62.5 110.451 -179.123 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 151' ' ' PHE . . . . . 0.477 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 44.2 p90 -86.84 162.78 17.58 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.662 -0.699 . . . . 71.32 110.588 -177.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 152' ' ' LYS . . . . . 0.432 ' HD3' ' CD1' ' B' ' 157' ' ' ILE . 21.6 tptt -92.76 113.47 25.75 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.518 -0.765 . . . . 64.34 109.659 -177.283 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 153' ' ' CYS . . . . . 0.536 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 29.9 t -123.29 96.12 4.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.01 0.433 . . . . 62.43 110.44 -176.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 57.91 55.05 5.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.174 -0.921 . . . . 70.45 111.628 179.282 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 95.17 -35.85 4.08 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.596 -0.729 . . . . 73.14 113.054 172.251 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -107.31 141.13 39.13 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.22 0.533 . . . . 60.1 111.277 -175.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 157' ' ' ILE . . . . . 0.432 ' CD1' ' HD3' ' B' ' 152' ' ' LYS . 43.3 mm -76.01 119.51 24.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.522 -0.763 . . . . 74.41 109.525 174.717 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 158' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -106.28 97.79 7.55 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.909 -0.316 . . . . 74.24 110.386 -177.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 2.6 p -76.47 124.24 27.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.221 -0.445 . . . . 73.42 111.815 -177.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 86.9 m-85 -125.37 107.32 10.57 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.27 -0.423 . . . . 64.22 111.206 176.093 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 39.6 m -97.21 -0.67 46.39 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.748 -0.66 . . . . 51.21 109.448 172.108 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -129.56 131.84 46.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.198 -0.91 . . . . 75.01 109.797 -179.233 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 51.0 tp -76.49 -35.35 58.44 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.354 -0.385 . . . . 73.11 110.79 -175.501 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -62.27 -44.64 96.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.936 0.398 . . . . 71.42 110.491 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 165' ' ' SER . . . . . 0.674 ' HA ' ' HE2' ' B' ' 168' ' ' LYS . 32.0 m -61.55 -32.14 72.2 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.976 -0.557 . . . . 72.53 110.932 178.411 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 49.5 tp -68.09 -40.16 82.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 75.42 110.414 179.064 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 167' ' ' ARG . . . . . 0.555 ' HG3' HD21 ' B' ' 184' ' ' LEU . 24.2 ttt180 -57.22 -45.65 83.67 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.047 0.451 . . . . 74.41 110.543 175.745 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 168' ' ' LYS . . . . . 0.674 ' HE2' ' HA ' ' B' ' 165' ' ' SER . 52.0 mtmt -63.34 -36.46 83.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.519 -0.764 . . . . 62.2 111.195 -179.086 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -71.26 -44.95 64.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.092 -0.504 . . . . 74.5 110.736 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.08 -28.65 69.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.212 -0.449 . . . . 72.51 110.972 -179.514 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 33.2 t -66.29 -30.92 71.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.96 -0.564 . . . . 64.31 111.29 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -100.53 10.93 40.52 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.098 0.475 . . . . 74.21 110.695 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 173' ' ' LYS . . . . . 0.536 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 30.7 mmmt -108.05 117.88 35.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.939 -0.573 . . . . 61.4 110.738 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 39.8 t -64.27 -37.13 86.38 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.956 -0.565 . . . . 71.13 110.456 -178.227 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 16.9 p -78.25 -35.75 47.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.748 -0.66 . . . . 71.51 111.778 -177.054 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 76.9 mtp -90.7 -16.64 28.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.317 -0.401 . . . . 74.23 111.824 -172.168 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -56.68 -37.73 71.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.495 -0.321 . . . . 70.23 111.558 -177.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -96.73 0.15 49.13 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.305 0.574 . . . . 63.5 110.529 -174.358 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 179' ' ' LEU . . . . . 0.509 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 59.6 mt -88.72 -51.97 5.38 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.245 -0.889 . . . . 31.43 109.408 176.076 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.0 -19.64 59.99 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.368 -0.833 . . . . 74.22 111.797 -176.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -60.34 -15.08 22.25 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.057 0.391 . . . . 63.12 112.057 -177.65 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -75.05 -32.54 61.56 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.086 0.47 . . . . 62.5 110.659 -173.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 183' ' ' VAL . . . . . 0.411 HG12 HD11 ' B' ' 121' ' ' LEU . 27.0 m -117.05 -15.39 9.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.811 -0.631 . . . . 60.42 110.997 -179.585 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 184' ' ' LEU . . . . . 0.555 HD21 ' HG3' ' B' ' 167' ' ' ARG . 42.5 tp -114.56 111.49 46.33 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.024 -0.534 . . . . 71.15 109.969 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -62.44 114.68 2.47 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.959 2.439 . . . . 73.03 112.121 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -109.45 107.2 17.26 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.075 -0.511 . . . . 74.21 110.734 -178.413 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 187' ' ' LYS . . . . . 0.948 ' HA ' ' HE2' ' B' ' 187' ' ' LYS . 11.1 mmpt? 56.09 83.89 0.09 Allowed 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 122.058 0.933 . . . . 72.31 112.201 178.558 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 . . . . . 0 C--N 1.31 -1.148 0 CA-C-N 114.281 -1.327 . . . . 75.12 109.072 174.603 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.88 0 N-CA-C 112.082 -0.407 . . . . 74.11 112.082 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.42 HG22 ' H ' ' A' ' 4' ' ' MET . 7.6 p -106.42 122.82 60.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.153 0.502 . . . . 73.1 110.774 -178.696 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 86.4 mt -90.65 -6.93 53.93 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.226 -0.443 . . . . 75.3 111.009 -178.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.42 ' H ' HG22 ' A' ' 2' ' ' VAL . 90.5 mtp -77.64 95.16 4.52 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.29 -0.414 . . . . 65.33 110.604 -178.4 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -82.43 137.55 34.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.92 -0.582 . . . . 61.44 110.233 175.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.434 ' HA ' HD12 ' A' ' 10' ' ' LEU . 48.2 mt-10 -89.81 -85.84 0.2 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.563 0.697 . . . . 74.15 111.583 -177.467 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 75.7 21.21 77.31 Favored Glycine 0 C--N 1.316 -0.582 0 N-CA-C 110.505 -1.038 . . . . 72.53 110.505 -172.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -173.1 177.74 2.65 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.655 -0.868 . . . . 30.35 108.655 -178.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.0 t -84.26 102.19 9.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.578 -0.527 . . . . 72.13 109.578 177.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 6' ' ' GLU . 91.0 mt -120.9 -178.09 3.65 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.144 -0.48 . . . . 64.42 110.745 -177.445 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.6 t -143.09 160.65 39.99 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.897 -0.592 . . . . 74.42 109.457 -179.247 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 44.4 tp -97.83 125.47 42.7 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.031 0.444 . . . . 73.4 110.924 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.838 ' HB1' ' HB2' ' A' ' 16' ' ' LEU . . . -83.54 116.34 22.52 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.661 -0.699 . . . . 74.44 110.629 174.887 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.31 95.39 1.71 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.045 0.45 . . . . 65.12 110.978 179.074 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 1.014 ' HA ' ' HA ' ' A' ' 19' ' ' ALA . 9.5 m-20 76.07 0.23 3.26 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.916 -1.038 . . . . 63.22 111.658 172.167 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.838 ' HB2' ' HB1' ' A' ' 13' ' ' ALA . 62.9 mt -83.29 -19.46 36.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.388 0.613 . . . . 70.13 110.557 -178.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 40.8 m -145.53 -62.37 0.34 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.773 -0.825 . . . . 72.13 108.773 175.026 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 66.3 m -90.17 100.14 13.03 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.143 -0.688 . . . . 52.34 109.143 169.691 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 1.014 ' HA ' ' HA ' ' A' ' 15' ' ' ASP . . . -77.1 169.77 17.73 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.823 -0.626 . . . . 75.21 110.904 -177.466 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 19.8 m -63.08 98.14 0.13 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.255 0.55 . . . . 74.1 110.536 178.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.598 ' O ' HD22 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -82.37 101.97 10.94 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 122.011 0.91 . . . . 64.4 109.124 176.33 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -146.19 172.67 13.09 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.116 -0.947 . . . . 52.54 109.888 -175.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.749 ' HB ' ' HG3' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -144.02 123.09 7.37 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 CA-C-N 115.689 -0.687 . . . . 73.11 111.994 -166.948 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 m -84.31 34.09 0.51 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.065 -0.97 . . . . 73.05 110.468 -177.356 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.749 ' HG3' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -81.44 42.96 0.71 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.399 0.619 . . . . 74.12 112.177 -174.657 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -124.09 -168.89 1.86 Allowed 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.853 -0.612 . . . . 63.1 110.508 -175.277 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 45.0 m95 -68.64 97.39 0.79 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.36 0.6 . . . . 71.23 110.252 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.7 m -88.88 -2.86 58.8 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.785 0.802 . . . . 74.32 109.425 -178.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -70.48 -25.81 63.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.56 -1.2 . . . . 71.44 110.945 -176.614 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.447 HG22 ' HG ' ' B' ' 163' ' ' LEU . 21.8 t -51.67 -56.07 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 115.754 -0.657 . . . . 71.2 112.02 -174.519 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.49 ' HB2' ' HB2' ' A' ' 41' ' ' PRO . 14.0 p90 -97.13 -7.64 32.1 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.587 -0.278 . . . . 73.35 110.991 -176.105 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.418 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 12.1 t30 -61.58 -53.68 53.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.454 -0.339 . . . . 73.42 111.114 -173.387 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.447 ' H ' HD12 ' A' ' 33' ' ' ILE . 3.6 mp -62.77 -39.73 85.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.134 0.493 . . . . 72.4 110.378 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.498 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 88.8 mt -62.49 -34.79 77.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.014 -0.539 . . . . 64.45 110.736 178.362 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -69.88 -38.67 76.46 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.141 -0.481 . . . . 75.1 110.441 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 34.1 mm-40 -65.93 -31.3 72.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.052 -0.522 . . . . 71.21 111.08 178.854 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -100.39 4.35 43.82 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.13 -0.486 . . . . 73.44 111.281 -177.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.5 t0 67.69 47.09 1.21 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.617 -0.719 . . . . 74.02 112.054 171.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.498 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 28.7 m-85 -81.21 -7.63 59.6 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.525 -0.307 . . . . 64.21 111.608 173.215 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.93 69.53 1.35 Allowed Pre-proline 0 CA--C 1.538 0.515 0 CA-C-O 121.321 0.581 . . . . 71.14 110.076 -175.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.551 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 87.2 Cg_endo -89.07 175.75 3.38 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 123.017 2.478 . . . . 75.55 112.637 -177.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.64 ' HZ1' ' N ' ' B' ' 101' ' ' GLY . 12.7 mptt -109.7 -178.48 3.55 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.276 -0.42 . . . . 72.22 111.125 -178.03 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -90.39 178.01 6.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.141 -0.482 . . . . 73.12 111.596 -168.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -82.62 151.91 26.13 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.771 -0.649 . . . . 64.52 109.938 178.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 35.9 m -85.94 70.59 10.64 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.007 0.432 . . . . 62.25 110.036 177.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -83.63 63.78 7.59 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.466 0.651 . . . . 64.23 110.8 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.881 HG21 ' HB2' ' B' ' 145' ' ' CYS . 1.2 m -156.86 119.97 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 114.525 -1.216 . . . . 74.23 109.423 174.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.509 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER -139.92 166.94 23.29 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.381 -0.372 . . . . 63.52 111.022 179.919 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.653 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.9 mp -73.67 92.18 1.95 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.904 -0.589 . . . . 72.02 110.889 -177.859 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -94.11 68.18 3.7 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.272 -0.64 . . . . 73.2 109.272 171.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.653 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 44.9 p90 -91.68 165.12 13.47 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.994 -0.548 . . . . 75.41 111.132 -173.288 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.2 tptm -92.24 116.61 29.11 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.568 -0.742 . . . . 65.11 110.338 -176.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.554 ' HB3' ' HG2' ' A' ' 58' ' ' LYS . 47.3 t -120.06 100.49 7.24 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.993 0.425 . . . . 65.31 110.362 178.871 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 64.41 15.9 9.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.265 -0.88 . . . . 64.22 112.317 174.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.63 -32.26 3.92 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.297 -0.954 . . . . 74.14 112.638 177.201 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -100.66 153.74 19.17 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 110.117 -0.327 . . . . 75.53 110.117 -179.666 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 48.1 mm -83.9 116.48 27.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.401 -0.363 . . . . 72.33 110.166 177.243 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.739 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 31.8 mmmt -101.01 115.9 31.56 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.381 -0.6 . . . . 73.23 109.381 177.006 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -97.8 112.06 24.11 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.864 -0.607 . . . . 72.45 111.16 -174.716 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.739 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 23.8 m-85 -121.6 140.72 51.89 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.839 -0.619 . . . . 64.22 111.228 -178.239 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.509 ' HB3' ' HB3' ' A' ' 48' ' ' LYS . 17.1 p -137.08 15.55 3.04 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.811 -0.631 . . . . 74.22 109.75 175.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.466 ' OD2' ' HB3' ' A' ' 64' ' ' GLN . 4.9 t70 -148.1 127.55 13.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.488 -0.778 . . . . 73.32 110.692 -177.681 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.525 HD13 HG22 ' B' ' 130' ' ' VAL . 56.1 tp -68.25 -29.61 68.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.915 -0.584 . . . . 74.04 111.144 -177.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.466 ' HB3' ' OD2' ' A' ' 62' ' ' ASP . 44.3 tt0 -62.1 -47.92 82.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.26 0.552 . . . . 61.33 109.674 178.339 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 42.6 m -58.03 -45.05 87.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.389 -0.823 . . . . 75.04 111.109 177.097 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 37.1 tp -68.71 -34.63 75.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.285 -0.416 . . . . 73.41 110.977 -177.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 67' ' ' ARG . 46.4 ttp180 -61.96 -31.91 72.29 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.143 0.497 . . . . 71.45 110.463 177.663 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 64' ' ' GLN . 3.8 mtmp? -75.71 -42.62 50.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.988 -0.551 . . . . 74.32 110.343 176.514 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.469 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 63.7 t80 -65.98 -41.98 90.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.652 -0.703 . . . . 74.34 111.011 -176.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.38 -26.89 64.88 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.524 -0.307 . . . . 63.0 111.009 177.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.7 t -75.58 -28.6 59.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.915 0.388 . . . . 73.1 110.522 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 19.9 pt20 -87.69 -10.53 50.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.383 0.611 . . . . 72.3 109.847 176.059 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.458 ' O ' ' HE3' ' A' ' 77' ' ' LYS . 26.9 mmmt -94.03 163.33 13.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.334 -0.848 . . . . 71.21 109.431 173.016 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.1 t -105.42 -44.86 4.61 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.645 -0.502 . . . . 65.41 109.645 176.177 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.594 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 17.7 p -65.91 -53.35 40.57 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.969 -0.56 . . . . 70.51 110.891 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 81.3 mtp -64.87 -26.63 68.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.786 -0.643 . . . . 74.12 111.383 -177.005 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.458 ' HE3' ' O ' ' A' ' 73' ' ' LYS . 37.1 ttmt -61.12 -34.12 74.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.268 0.556 . . . . 63.34 110.47 178.468 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -102.88 8.08 39.25 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.631 0.729 . . . . 72.31 109.799 -176.672 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 75' ' ' SER . 45.6 mt -94.14 -52.87 4.19 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.063 -0.971 . . . . 72.33 108.912 172.041 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.483 ' HA ' HG13 ' B' ' 133' ' ' ILE . 9.1 mt -80.25 6.67 11.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.427 -0.806 . . . . 75.31 111.306 -173.319 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -54.36 -20.81 8.0 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.628 0.58 . . . . 71.22 112.481 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.586 ' HB3' HD11 ' B' ' 133' ' ' ILE . 27.6 t70 -67.69 -41.99 82.78 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.972 0.415 . . . . 72.4 110.365 175.451 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 35.6 t -91.33 -42.55 13.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.069 -0.514 . . . . 73.41 110.405 -178.316 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.1 mp -79.94 122.55 83.37 Favored Pre-proline 0 C--N 1.322 -0.597 0 CA-C-N 116.107 -0.497 . . . . 74.32 110.495 -179.247 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -59.7 119.51 6.76 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.947 2.431 . . . . 64.43 112.266 -177.073 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -108.3 148.05 30.59 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 121.405 0.621 . . . . 74.21 110.456 -178.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -102.43 -34.74 9.04 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.225 -0.898 . . . . 75.43 110.049 178.397 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 115.7 -0.682 . . . . 61.35 110.518 179.152 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 101' ' ' GLY . . . . . 0.64 ' N ' ' HZ1' ' A' ' 42' ' ' LYS . . . . . . . . 0 N--CA 1.45 -0.41 0 N-CA-C 111.551 -0.62 . . . . 51.21 111.551 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 7.6 p 30.03 82.07 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.738 1.215 . . . . 74.11 113.323 -179.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 95.8 mt -91.76 -21.71 20.56 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 115.458 -0.792 . . . . 72.15 110.138 177.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 85.1 mtp -56.08 112.26 1.16 Allowed 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.556 -0.747 . . . . 73.12 110.131 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -31.23 119.36 0.21 Allowed 'General case' 0 N--CA 1.47 0.543 0 O-C-N 124.946 1.404 . . . . 75.11 112.94 -178.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -75.46 146.71 40.44 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.006 -0.997 . . . . 72.45 111.583 -172.343 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -159.41 -65.09 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.685 0 N-CA-C 111.332 -0.707 . . . . 74.13 111.332 177.343 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -141.22 -173.56 3.77 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.397 -0.594 . . . . 41.34 109.397 177.671 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 94.7 t -68.49 114.96 5.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.244 0.545 . . . . 75.23 110.044 176.109 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 84.7 mt -120.45 176.33 5.54 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.435 -0.802 . . . . 62.44 109.755 -178.26 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 4.7 t -81.18 153.27 27.3 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.373 -0.603 . . . . 73.41 109.373 176.164 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 43.9 tp -137.04 111.75 8.76 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.226 0.536 . . . . 71.34 110.79 177.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 113' ' ' ALA . . . . . 0.63 ' HB1' ' HB2' ' B' ' 116' ' ' LEU . . . -94.54 82.9 4.03 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.594 -0.73 . . . . 72.23 110.113 177.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.67 ' HA ' ' OG ' ' B' ' 118' ' ' SER . . . -71.08 -20.51 62.34 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.245 -0.889 . . . . 65.22 110.558 -178.441 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -97.53 -2.34 42.05 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.347 -0.842 . . . . 62.14 110.636 -177.053 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.63 ' HB2' ' HB1' ' B' ' 113' ' ' ALA . 98.0 mt -133.63 -66.7 0.63 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.016 0.376 . . . . 44.04 112.016 -174.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 20.6 m -75.16 -47.39 28.7 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.29 0.478 . . . . 73.41 112.29 -171.375 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 118' ' ' SER . . . . . 0.67 ' OG ' ' HA ' ' B' ' 114' ' ' ALA . 34.6 p -78.89 110.31 13.97 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.828 0.347 . . . . 62.45 110.621 -179.473 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -80.85 147.5 30.37 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.115 -0.493 . . . . 52.22 110.625 -179.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 1.6 p -72.44 153.58 41.33 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.04 -0.527 . . . . 73.21 111.436 -179.08 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 121' ' ' LEU . . . . . 0.554 HD13 ' H ' ' B' ' 121' ' ' LEU . 0.0 OUTLIER -130.35 6.93 4.91 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.787 0.803 . . . . 64.1 109.293 177.967 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -68.98 147.88 50.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.199 -1.364 . . . . 74.11 111.059 -174.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -148.17 143.62 19.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-N 114.479 -1.237 . . . . 72.34 110.575 -171.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.617 ' HA ' ' OE2' ' B' ' 146' ' ' GLU . 66.5 m -78.78 85.17 4.8 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.183 0.516 . . . . 54.43 110.704 -179.446 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 125' ' ' LYS . . . . . 0.526 ' HD2' ' HG3' ' B' ' 126' ' ' GLN . 0.0 OUTLIER -115.64 20.52 14.6 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.686 -0.688 . . . . 65.21 110.996 177.959 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 126' ' ' GLN . . . . . 0.526 ' HG3' ' HD2' ' B' ' 125' ' ' LYS . 9.1 mt-30 -115.4 -163.8 0.91 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.515 -0.766 . . . . 60.32 110.048 -178.532 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -80.24 65.17 5.31 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.131 0.491 . . . . 72.05 109.857 176.351 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 11.7 m -99.95 11.72 38.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.64 -0.709 . . . . 61.02 110.25 -174.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -78.36 23.45 0.29 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.509 -0.769 . . . . 74.15 111.197 -175.354 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.525 HG22 HD13 ' A' ' 63' ' ' LEU . 21.9 t -84.31 -36.22 11.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.113 -0.494 . . . . 71.02 111.848 -172.271 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 26.0 p90 -88.47 -17.22 30.84 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.219 0.451 . . . . 74.52 112.219 -171.017 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.466 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 54.7 t30 -55.52 -60.14 3.84 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.142 0.276 . . . . 75.51 111.661 -171.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 133' ' ' ILE . . . . . 0.586 HD11 ' HB3' ' A' ' 82' ' ' ASP . 39.5 mm -59.52 -46.52 92.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.27 0.557 . . . . 75.42 111.482 -176.007 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.432 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 88.0 mt -58.22 -30.71 66.71 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.587 -0.733 . . . . 54.32 111.613 -179.564 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -77.73 -33.61 52.91 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.751 0.31 . . . . 63.03 110.599 -178.477 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 136' ' ' GLU . . . . . 0.469 ' OE1' ' HA ' ' B' ' 133' ' ' ILE . 33.5 mt-10 -64.72 -46.56 81.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.406 0.622 . . . . 62.24 110.296 177.609 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 39.3 m-80 -90.83 5.25 49.19 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.363 -0.835 . . . . 65.11 110.796 -175.162 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 31.5 t70 60.2 65.13 1.12 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.982 -1.008 . . . . 64.41 112.754 173.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 139' ' ' PHE . . . . . 0.432 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 9.7 m-85 -95.92 1.29 52.82 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.667 -0.697 . . . . 65.21 109.938 169.756 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 60.34 76.5 0.42 Allowed Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.647 -0.706 . . . . 62.01 110.796 -178.747 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -79.86 157.19 24.15 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.814 2.342 . . . . 75.21 112.087 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 11.8 mptt -93.44 -172.65 2.98 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.925 0.393 . . . . 75.21 111.766 -176.134 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -70.83 150.53 45.73 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.43 -0.805 . . . . 71.24 111.468 -170.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -109.51 87.0 2.4 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.063 -0.517 . . . . 62.2 110.274 -179.148 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 145' ' ' CYS . . . . . 0.881 ' HB2' HG21 ' A' ' 47' ' ' VAL . 60.5 m -116.53 82.95 1.88 Allowed 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.17 0.509 . . . . 65.11 109.978 177.471 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 146' ' ' GLU . . . . . 0.617 ' OE2' ' HA ' ' B' ' 124' ' ' SER . 6.7 pt-20 -83.25 95.01 8.02 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.742 0.782 . . . . 74.42 110.281 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 3.5 t -96.11 163.69 2.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.142 -0.935 . . . . 71.31 109.527 -178.512 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.68 158.55 38.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.736 -0.211 . . . . 65.02 110.504 178.406 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.569 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.9 mp -73.04 88.2 1.39 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.294 -0.412 . . . . 72.01 110.576 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -91.69 72.06 5.82 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.424 -0.584 . . . . 65.32 109.424 174.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 151' ' ' PHE . . . . . 0.569 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 50.3 p90 -102.09 166.08 10.8 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.04 -0.527 . . . . 74.32 110.584 -176.102 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.8 tppp? -94.69 124.36 38.68 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.014 -0.539 . . . . 63.5 110.212 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 153' ' ' CYS . . . . . 0.538 ' HB3' ' CG ' ' B' ' 158' ' ' LYS . 32.5 t -138.64 117.09 12.02 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.321 -0.399 . . . . 73.21 110.194 178.158 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 73.2 4.51 4.91 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.235 -0.893 . . . . 54.23 112.087 174.017 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 119.6 -19.46 9.75 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.439 -0.886 . . . . 55.13 112.822 178.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -114.51 156.1 25.22 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.984 -0.376 . . . . 73.14 109.984 177.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 46.4 mm -78.35 117.55 23.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 110.039 -0.356 . . . . 65.43 110.039 177.222 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 158' ' ' LYS . . . . . 0.705 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 29.0 mmmt -100.34 103.62 15.03 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.192 -0.67 . . . . 70.25 109.192 178.622 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 159' ' ' THR . . . . . 0.464 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.2 OUTLIER -89.51 113.39 24.77 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.048 -0.523 . . . . 73.2 111.165 -176.228 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 160' ' ' PHE . . . . . 0.705 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 34.3 m-85 -115.17 134.3 55.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.115 0.484 . . . . 75.22 110.989 -179.888 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 16.6 p -114.38 1.68 14.47 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.692 -0.686 . . . . 74.41 110.616 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 162' ' ' ASP . . . . . 0.577 ' HB2' ' CB ' ' B' ' 165' ' ' SER . 4.1 m-20 -134.65 150.17 50.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.891 -0.595 . . . . 74.01 110.077 -174.475 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 163' ' ' LEU . . . . . 0.447 ' HG ' HG22 ' A' ' 30' ' ' VAL . 5.6 tt -79.12 -51.03 10.08 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.006 -0.739 . . . . 72.22 109.006 177.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 61.4 tt0 -60.82 -35.78 77.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.515 -0.766 . . . . 71.41 110.771 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 165' ' ' SER . . . . . 0.665 ' HA ' ' HE3' ' B' ' 168' ' ' LYS . 13.4 t -65.02 -36.27 83.85 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.732 -0.667 . . . . 72.55 110.624 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 166' ' ' LEU . . . . . 0.509 ' HA ' ' CE2' ' B' ' 160' ' ' PHE . 52.4 tp -71.25 -31.8 67.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.797 0.332 . . . . 72.34 110.408 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 167' ' ' ARG . . . . . 0.42 ' HG3' HD11 ' B' ' 184' ' ' LEU . 56.5 ttp180 -61.54 -36.12 79.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.964 -0.562 . . . . 75.52 110.124 177.147 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 168' ' ' LYS . . . . . 0.665 ' HE3' ' HA ' ' B' ' 165' ' ' SER . 9.8 mtmp? -59.63 -43.62 93.76 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.903 -0.59 . . . . 74.0 110.558 176.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 169' ' ' PHE . . . . . 0.483 ' O ' ' HG2' ' B' ' 172' ' ' GLN . 40.4 t80 -70.7 -40.76 72.69 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.453 -0.794 . . . . 65.23 110.007 -178.34 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 170' ' ' ALA . . . . . 0.462 ' HB2' HD12 ' B' ' 180' ' ' LEU . . . -61.88 -31.44 71.72 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.995 -0.548 . . . . 64.43 111.179 177.653 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 9.1 t -78.33 -28.95 47.42 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 121.062 -0.255 . . . . 72.44 111.233 -176.573 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 172' ' ' GLN . . . . . 0.483 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 21.0 pt20 -85.82 -5.94 59.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.468 0.651 . . . . 71.24 109.937 177.563 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 10.7 mmmm -118.41 98.09 6.09 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.232 -0.894 . . . . 63.41 110.101 -179.479 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 16.8 t -51.35 -34.85 35.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.083 0.468 . . . . 32.4 110.454 -179.352 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 175' ' ' SER . . . . . 0.577 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 3.9 m -62.06 -47.29 85.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.799 -0.637 . . . . 65.44 111.059 178.852 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 86.3 mtp -82.89 -21.65 34.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.929 -0.578 . . . . 71.11 111.224 -175.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 20.5 ttmm -66.57 -23.73 66.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.678 0.752 . . . . 75.34 109.296 175.547 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -100.15 4.28 44.36 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.947 -1.024 . . . . 72.34 109.655 -177.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 179' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' B' ' 175' ' ' SER . 57.7 mt -103.16 -49.96 3.61 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.293 -0.867 . . . . 73.43 109.325 175.525 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 180' ' ' LEU . . . . . 0.462 HD12 ' HB2' ' B' ' 170' ' ' ALA . 9.8 mt -86.91 5.74 35.45 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.821 -0.627 . . . . 74.13 110.477 -176.461 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 181' ' ' LYS . . . . . 0.515 ' HB2' ' HG3' ' B' ' 186' ' ' GLN . 63.4 pttt -59.7 -11.84 5.85 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.474 -0.784 . . . . 73.23 111.673 178.317 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -63.54 -35.02 79.09 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.368 0.604 . . . . 73.15 109.683 175.25 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 23.9 t -102.76 -37.74 5.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.048 -0.978 . . . . 64.41 110.098 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 184' ' ' LEU . . . . . 0.42 HD11 ' HG3' ' B' ' 167' ' ' ARG . 10.7 mp -71.81 134.29 83.8 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.617 -0.72 . . . . 52.23 110.497 -178.832 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -61.78 123.67 13.08 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.759 2.306 . . . . 53.53 112.486 -177.108 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 186' ' ' GLN . . . . . 0.515 ' HG3' ' HB2' ' B' ' 181' ' ' LYS . 29.5 mm-40 -123.99 136.78 54.52 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.707 -0.678 . . . . 65.15 109.974 -179.25 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 187' ' ' LYS . . . . . 0.493 ' HB2' ' OE2' ' B' ' 188' ' ' GLU . 67.0 mttm -79.74 -26.75 40.66 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.227 -0.657 . . . . 61.54 109.227 173.633 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 188' ' ' GLU . . . . . 0.493 ' OE2' ' HB2' ' B' ' 187' ' ' LYS . 1.5 mp0 . . . . . 0 C--O 1.253 1.24 0 CA-C-O 118.263 -0.875 . . . . 73.41 110.144 178.253 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.649 0 N-CA-C 111.817 -0.513 . . . . 73.44 111.817 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 27.5 m -72.73 -36.63 53.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.724 0.297 . . . . 65.34 111.017 -179.221 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 32.7 tp -128.9 -41.74 1.44 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.412 -0.358 . . . . 74.32 110.223 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 24.4 ptm 41.48 91.9 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.639 1.176 . . . . 75.2 113.614 177.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -66.32 142.2 57.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.466 -0.788 . . . . 75.34 109.405 176.283 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -72.46 152.0 42.2 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.193 0.521 . . . . 52.54 111.632 -173.195 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 166.35 -143.91 8.73 Favored Glycine 0 N--CA 1.439 -1.133 0 N-CA-C 110.835 -0.906 . . . . 50.53 110.835 179.015 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -95.18 101.23 12.96 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 110.176 -0.305 . . . . 75.01 110.176 178.444 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 41.3 t -74.62 -46.72 41.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 121.391 0.615 . . . . 64.34 111.141 -178.126 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -144.69 134.37 23.51 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.367 -0.833 . . . . 74.05 110.42 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 m -106.02 143.77 33.68 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.875 -0.602 . . . . 74.03 110.312 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.521 ' HA ' ' OG ' ' A' ' 17' ' ' SER . 0.5 OUTLIER -99.74 120.42 39.7 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.454 -0.943 . . . . 73.15 108.454 175.692 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.624 ' HB3' ' O ' ' A' ' 16' ' ' LEU . . . -54.79 -69.45 0.13 Allowed 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.502 0.501 . . . . 73.43 112.242 -175.628 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -152.21 -75.41 0.14 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.064 -0.516 . . . . 71.44 109.851 178.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -90.9 -46.62 8.08 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.192 -1.04 . . . . 63.11 108.192 172.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.624 ' O ' ' HB3' ' A' ' 13' ' ' ALA . 95.8 mt -141.02 158.17 44.31 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.387 -1.279 . . . . 55.14 107.91 173.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.521 ' OG ' ' HA ' ' A' ' 12' ' ' LEU . 39.8 m -81.75 30.54 0.37 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.514 0.673 . . . . 51.3 110.812 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 42.8 t -120.53 107.0 12.33 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.4 -0.818 . . . . 33.43 109.715 -178.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.82 113.11 10.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.296 -0.411 . . . . 52.04 110.444 179.17 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 18.5 m -80.5 105.81 12.03 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.086 -0.506 . . . . 71.15 110.346 178.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 87.9 mt -99.37 -163.98 1.09 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.93 -0.577 . . . . 53.04 109.811 177.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -59.72 106.47 0.48 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.441 -0.345 . . . . 74.43 110.612 -179.528 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 13.5 tt -63.88 -38.84 83.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.978 -0.555 . . . . 71.15 110.949 -177.753 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.9 m -127.66 126.37 41.83 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.43 -0.582 . . . . 73.31 109.43 176.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -96.3 -5.57 39.83 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.962 0.41 . . . . 73.02 110.203 -178.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -107.67 99.24 8.74 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.042 -0.526 . . . . 70.23 110.568 -172.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -123.66 94.67 4.31 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.003 0.43 . . . . 72.22 110.772 178.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.2 m -124.85 10.76 8.33 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.944 -0.571 . . . . 73.2 110.384 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.73 HD22 HG21 ' B' ' 183' ' ' VAL . 17.9 p-10 -77.22 -54.56 6.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.727 -0.669 . . . . 72.31 110.618 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.669 HG23 ' H ' ' A' ' 31' ' ' PHE . 3.7 m 32.57 -98.54 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 N-CA-C 114.214 1.19 . . . . 61.0 114.214 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.669 ' H ' HG23 ' A' ' 30' ' ' VAL . 32.4 p90 -117.49 12.86 14.28 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 111.895 0.332 . . . . 74.3 111.895 -173.038 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.552 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 50.1 t30 -54.62 -54.91 35.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.052 0.453 . . . . 73.14 111.046 -176.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.752 HG21 ' HB3' ' B' ' 179' ' ' LEU . 36.1 mm -58.55 -38.47 70.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.678 -0.692 . . . . 65.12 111.489 -176.324 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.6 mt -62.66 -34.51 77.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.84 -0.618 . . . . 74.14 111.771 -177.141 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 74.8 ttt180 -81.02 -36.72 30.25 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.492 -0.483 . . . . 71.51 110.366 178.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.552 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 8.5 mm-40 -67.04 -31.4 71.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.76 0.314 . . . . 62.11 111.139 -178.486 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -98.33 -1.15 42.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.9 0.381 . . . . 65.11 111.003 178.121 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 19.5 t70 59.84 74.95 0.42 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.926 0.87 . . . . 73.04 111.749 176.195 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.484 ' HB3' ' HB2' ' B' ' 151' ' ' PHE . 3.7 m-85 -94.54 -4.21 48.42 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.986 -1.007 . . . . 71.12 109.865 169.002 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 59.39 74.7 0.56 Allowed Pre-proline 0 N--CA 1.463 0.22 0 O-C-N 124.178 0.924 . . . . 70.23 110.252 -174.131 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -80.32 -165.2 0.32 Allowed 'Trans proline' 0 N--CA 1.458 -0.599 0 C-N-CA 123.277 2.651 . . . . 54.43 112.221 -177.668 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.932 ' HD3' ' HB3' ' B' ' 150' ' ' ALA . 6.9 tptp -116.24 168.7 9.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.134 -0.485 . . . . 73.13 110.327 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.68 ' HB3' ' HZ ' ' B' ' 143' ' ' PHE . 57.5 m-85 -163.59 71.59 0.25 Allowed 'General case' 0 C--N 1.327 -0.387 0 O-C-N 123.653 0.596 . . . . 74.14 109.969 -170.04 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 45.9 tp -167.74 97.69 0.47 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.194 -0.457 . . . . 74.45 109.919 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.506 ' SG ' ' HA ' ' B' ' 147' ' ' VAL . 84.3 m -155.86 -179.97 8.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.948 -0.569 . . . . 75.24 110.326 -178.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -70.01 89.19 0.6 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.395 0.617 . . . . 74.41 110.376 176.672 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.894 HG11 ' HA ' ' B' ' 143' ' ' PHE . 48.7 t -90.57 155.21 3.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.548 -0.751 . . . . 71.42 109.779 179.471 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.531 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER -93.38 103.05 15.3 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.398 0.618 . . . . 72.21 109.802 179.349 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.521 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 9.3 mp -67.33 91.15 0.24 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.997 -1.001 . . . . 74.24 111.171 -176.387 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' B' ' 142' ' ' LYS . . . -90.38 96.72 10.79 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.911 -0.774 . . . . 71.43 108.911 170.281 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.639 ' HB3' ' HA ' ' B' ' 141' ' ' PRO . 49.5 p90 -129.93 170.01 14.49 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.71 -0.677 . . . . 54.22 110.34 -176.185 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.7 tppp? -85.08 131.22 34.48 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.257 -0.429 . . . . 73.32 110.65 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 39.4 t -146.89 119.31 8.42 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.646 -0.502 . . . . 52.11 109.646 174.522 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 31.4 t70 71.39 2.74 4.38 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.668 -0.696 . . . . 33.35 112.404 175.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 117.76 -20.06 11.04 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.415 -0.898 . . . . 74.42 112.15 -179.737 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -107.77 163.83 12.76 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.819 -0.437 . . . . 64.13 109.819 178.233 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.7 mm -93.03 125.41 45.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.734 -0.469 . . . . 74.34 109.734 177.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.559 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 30.6 mmmt -107.46 141.13 39.36 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.337 -0.392 . . . . 74.42 110.023 -179.295 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -112.63 115.67 28.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.0 0.428 . . . . 45.34 111.169 176.695 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -120.75 106.28 11.55 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.162 -0.472 . . . . 63.21 110.834 178.168 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.531 ' HB3' ' HB3' ' A' ' 48' ' ' LYS . 5.4 p -96.96 -2.42 43.67 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.102 -0.499 . . . . 51.23 110.944 178.352 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -131.14 138.69 49.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.033 -0.53 . . . . 72.3 110.775 179.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.406 HD23 ' HE3' ' B' ' 127' ' ' TRP . 46.4 tp -70.36 -31.03 68.13 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.282 -0.636 . . . . 74.34 109.282 175.59 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -56.94 -47.17 81.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.782 -0.644 . . . . 74.52 110.389 174.537 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.6 m -63.77 -43.18 97.15 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.928 -0.578 . . . . 74.23 110.952 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 33.6 tp -72.94 -32.08 65.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.414 . . . . 72.24 110.862 -177.135 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.404 ' HG2' HD21 ' A' ' 84' ' ' LEU . 55.4 ttp180 -59.29 -44.45 92.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.055 -0.52 . . . . 75.1 110.19 178.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -62.79 -46.82 86.23 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.728 -0.669 . . . . 74.53 110.827 178.177 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.46 ' CE2' ' HE3' ' A' ' 73' ' ' LYS . 46.5 t80 -63.72 -45.42 90.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.249 -0.887 . . . . 71.43 110.883 -176.388 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.73 -24.98 64.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.134 -0.484 . . . . 70.3 112.018 -176.659 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.1 m -65.05 -38.11 89.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.813 0.34 . . . . 75.2 111.231 -179.106 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -92.27 0.11 57.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.09 0.472 . . . . 70.22 111.217 -178.677 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 66.4 mmtt -97.5 116.91 30.61 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.909 -0.587 . . . . 75.0 110.247 177.278 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.2 m -64.61 -35.0 79.59 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.093 0.473 . . . . 42.44 110.561 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 23.3 t -78.78 -34.05 45.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.689 -0.687 . . . . 53.0 110.916 -179.302 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.509 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 82.4 mtp -92.15 -12.47 32.77 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.652 0.263 . . . . 61.43 111.64 -175.67 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.58 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 40.4 tttp -52.27 -43.11 64.24 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.04 -0.527 . . . . 61.11 110.972 174.406 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.467 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 28.7 mm-40 -90.88 -2.53 57.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.485 0.66 . . . . 63.1 110.444 -172.037 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.549 ' HB2' HD22 ' A' ' 80' ' ' LEU . 36.1 mt -90.48 -53.7 4.32 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.162 -0.926 . . . . 72.2 109.872 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.549 HD22 ' HB2' ' A' ' 79' ' ' LEU . 3.0 mm? -94.93 3.45 54.95 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.768 -0.651 . . . . 53.43 111.515 -176.15 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.58 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 65.3 pttt -55.98 -16.41 4.81 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.274 0.472 . . . . 70.01 112.274 178.875 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -58.63 -30.56 67.38 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.935 0.398 . . . . 74.13 111.228 177.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 19.7 m -123.18 10.34 5.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.215 0.531 . . . . 71.52 111.01 178.27 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.767 HD23 ' HD2' ' A' ' 85' ' ' PRO . 3.1 mt -112.98 129.89 24.07 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.903 -0.59 . . . . 53.43 110.602 -177.476 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.767 ' HD2' HD23 ' A' ' 84' ' ' LEU . 19.8 Cg_endo -59.52 117.8 4.59 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.844 2.363 . . . . 74.35 111.958 177.369 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.5 ' HG3' ' HB2' ' A' ' 81' ' ' LYS . 77.6 mm-40 -117.61 155.77 29.28 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.052 -0.522 . . . . 74.24 109.846 -177.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 55.0 pttt -84.42 -12.06 55.08 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.501 -0.772 . . . . 70.3 109.695 176.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 . . . . . 0 C--O 1.238 0.488 0 CA-C-N 115.167 -0.924 . . . . 75.31 110.77 176.35 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 101' ' ' GLY . . . . . 0.502 ' O ' ' HG2' ' B' ' 104' ' ' MET . . . . . . . . 0 N--CA 1.45 -0.388 0 N-CA-C 111.872 -0.491 . . . . 64.01 111.872 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 9.9 p -84.48 -11.97 11.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.571 0.7 . . . . 72.03 109.628 176.495 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 103' ' ' LEU . . . . . 0.499 HD12 ' N ' ' B' ' 104' ' ' MET . 1.2 pp -88.45 -21.4 24.24 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.618 -0.719 . . . . 72.05 111.888 -178.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 104' ' ' MET . . . . . 0.502 ' HG2' ' O ' ' B' ' 101' ' ' GLY . 22.6 ptm -75.34 96.27 3.36 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.889 0.852 . . . . 75.23 110.876 -175.371 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -70.15 179.49 2.35 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.895 -1.048 . . . . 64.42 109.497 175.077 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -79.41 136.1 36.87 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.069 0.461 . . . . 43.44 111.036 -175.71 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -167.8 -170.94 33.21 Favored Glycine 0 N--CA 1.435 -1.419 0 N-CA-C 110.761 -0.936 . . . . 65.21 110.761 178.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -79.76 79.03 6.31 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 121.024 0.44 . . . . 60.33 110.884 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 59.5 t -72.88 -53.24 19.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.586 0.708 . . . . 72.31 109.806 177.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 110' ' ' LEU . . . . . 0.651 ' H ' HD23 ' B' ' 110' ' ' LEU . 2.3 pt? -120.29 124.37 45.43 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 114.796 -1.093 . . . . 75.31 109.655 177.656 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 19.0 m -122.71 111.28 16.53 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.962 -0.295 . . . . 60.14 110.558 -178.159 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 112' ' ' LEU . . . . . 0.492 ' HA ' ' OG ' ' B' ' 117' ' ' SER . 0.1 OUTLIER -99.51 128.55 45.62 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.372 -0.603 . . . . 73.05 109.372 177.448 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 113' ' ' ALA . . . . . 0.751 ' HB3' ' O ' ' B' ' 116' ' ' LEU . . . -87.13 -170.99 3.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.175 -0.466 . . . . 52.55 110.65 -178.749 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -57.75 -76.69 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.338 0.495 . . . . 63.12 112.338 -176.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -68.94 -60.64 2.23 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.828 -0.805 . . . . 74.12 108.828 175.714 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.751 ' O ' ' HB3' ' B' ' 113' ' ' ALA . 93.6 mt -149.24 160.61 43.23 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 106.756 -1.572 . . . . 61.32 106.756 178.525 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.492 ' OG ' ' HA ' ' B' ' 112' ' ' LEU . 18.2 m -57.23 -21.97 37.77 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.404 0.621 . . . . 60.23 110.587 179.021 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 33.0 t -114.43 94.22 4.69 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.151 -0.931 . . . . 73.13 109.08 178.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -72.36 146.23 47.21 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.914 -0.585 . . . . 65.5 111.172 -175.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 26.7 m -74.86 101.23 4.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.309 0.576 . . . . 63.32 110.422 179.198 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 85.8 mt -90.63 -163.34 1.01 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.36 -0.837 . . . . 70.5 110.021 178.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -74.77 73.52 2.06 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.131 -0.322 . . . . 63.4 110.131 176.259 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 14.8 tt -59.65 -30.75 45.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.919 -0.582 . . . . 71.33 110.872 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 20.2 m -117.78 116.03 26.18 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.889 -0.596 . . . . 71.31 109.828 177.534 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.08 1.77 39.68 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.262 0.553 . . . . 64.52 109.577 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -99.91 124.4 45.19 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.591 -0.732 . . . . 72.23 111.245 -173.692 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 127' ' ' TRP . . . . . 0.406 ' HE3' HD23 ' A' ' 63' ' ' LEU . 76.2 m95 -129.03 40.69 3.59 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.146 -0.687 . . . . 64.13 109.146 178.819 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 4.9 p -81.46 8.31 9.74 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 112.909 0.707 . . . . 62.14 112.909 -171.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -95.34 97.53 9.91 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.679 -0.489 . . . . 64.51 109.679 178.371 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.467 ' C ' ' H ' ' B' ' 132' ' ' ASN . 18.7 m -105.54 -157.01 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.932 -0.576 . . . . 71.44 110.518 -179.435 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 131' ' ' PHE . . . . . 0.404 ' H ' ' HB ' ' B' ' 130' ' ' VAL . 43.4 p90 -68.48 11.08 0.19 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.456 -0.338 . . . . 74.22 111.76 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.467 ' H ' ' C ' ' B' ' 130' ' ' VAL . 8.7 t30 -54.92 -48.47 73.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.082 -0.508 . . . . 75.53 110.959 179.258 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 133' ' ' ILE . . . . . 0.515 HG21 ' HB3' ' A' ' 79' ' ' LEU . 43.2 mm -61.99 -42.54 95.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.339 0.59 . . . . 62.31 110.777 -179.279 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.518 HD12 HD23 ' A' ' 49' ' ' LEU . 98.9 mt -70.29 -26.31 63.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.613 -0.722 . . . . 52.43 111.784 -174.267 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -76.37 -35.18 58.81 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.336 -0.546 . . . . 75.12 109.875 176.591 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -63.83 -30.24 71.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.838 -0.619 . . . . 72.23 110.723 176.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -102.62 5.74 39.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.045 -0.525 . . . . 63.13 111.263 -179.472 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 57.41 51.3 10.05 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.708 -0.678 . . . . 62.33 112.317 174.811 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 139' ' ' PHE . . . . . 0.488 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 7.6 m-85 -82.72 -8.0 59.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.109 -0.496 . . . . 64.45 110.221 172.537 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 140' ' ' GLU . . . . . 0.41 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 37.0 tt0 58.42 75.89 0.5 Allowed Pre-proline 0 N--CA 1.464 0.232 0 CA-C-N 115.487 -0.779 . . . . 71.2 110.785 -176.525 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.639 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 78.1 Cg_endo -80.2 173.61 12.36 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.669 2.246 . . . . 74.33 112.491 -178.39 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 142' ' ' LYS . . . . . 0.82 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 11.5 tptp -99.1 -179.76 4.35 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.091 -0.504 . . . . 63.52 109.795 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 143' ' ' PHE . . . . . 0.894 ' HA ' HG11 ' A' ' 47' ' ' VAL . 44.1 t80 175.92 79.23 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.133 0.492 . . . . 74.42 109.921 -174.612 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 41.4 tp -165.83 91.88 0.5 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.885 -0.598 . . . . 62.03 110.098 177.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 145' ' ' CYS . . . . . 0.645 ' SG ' ' HA ' ' A' ' 47' ' ' VAL . 92.6 m -145.32 176.16 9.76 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.26 -0.882 . . . . 71.14 109.049 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -80.9 91.64 6.03 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.397 0.618 . . . . 74.44 110.689 178.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 147' ' ' VAL . . . . . 0.517 HG11 ' HA ' ' A' ' 43' ' ' PHE . 18.7 t -77.49 161.15 4.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.138 -0.937 . . . . 53.22 110.001 178.78 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 148' ' ' LYS . . . . . 0.771 ' HB3' ' HB3' ' B' ' 161' ' ' SER . 0.0 OUTLIER -92.74 90.48 7.08 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.911 -0.774 . . . . 70.41 108.911 179.99 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.627 HD22 ' H ' ' B' ' 149' ' ' LEU . 1.5 mm? -60.72 107.92 0.77 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.316 -0.857 . . . . 73.44 111.298 -171.634 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.932 ' HB3' ' HD3' ' A' ' 42' ' ' LYS . . . -97.08 87.47 4.22 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.835 -0.802 . . . . 54.31 108.835 171.799 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 151' ' ' PHE . . . . . 0.518 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 45.4 p90 -119.85 167.05 12.5 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.704 -0.68 . . . . 71.53 110.593 -175.544 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -93.65 122.25 35.91 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.997 -0.547 . . . . 72.41 110.079 177.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 153' ' ' CYS . . . . . 0.431 ' HB2' ' HE1' ' B' ' 151' ' ' PHE . 20.8 t -137.13 121.61 18.31 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.067 -0.515 . . . . 75.32 110.097 177.686 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 20.9 t70 73.54 1.8 4.07 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.874 -0.603 . . . . 61.32 111.545 171.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 116.3 -11.59 16.79 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.782 -0.723 . . . . 72.12 112.495 -179.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 156' ' ' GLU . . . . . 0.833 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 10.4 pt-20 -117.31 145.32 44.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.838 0.351 . . . . 71.32 110.667 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 46.2 mm -77.28 127.03 38.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 109.361 -0.607 . . . . 73.12 109.361 175.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 158' ' ' LYS . . . . . 0.833 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 30.6 mmmt -120.57 126.94 51.59 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.005 -0.543 . . . . 73.21 110.279 -176.379 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 159' ' ' THR . . . . . 0.58 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.9 OUTLIER -103.01 115.42 30.57 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 123.249 0.343 . . . . 71.43 110.169 172.749 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 160' ' ' PHE . . . . . 0.418 ' CE2' ' HB3' ' B' ' 158' ' ' LYS . 59.9 m-85 -115.28 102.84 10.24 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.349 0.595 . . . . 63.14 111.758 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 161' ' ' SER . . . . . 0.771 ' HB3' ' HB3' ' B' ' 148' ' ' LYS . 34.1 p -108.12 12.35 26.83 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.174 -0.921 . . . . 65.22 108.714 168.717 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -132.0 108.12 9.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.766 -1.106 . . . . 53.4 110.243 -179.114 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 50.9 tp -66.25 -26.33 67.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.656 -0.702 . . . . 73.34 110.66 -178.453 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.09 -52.1 65.26 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.093 -0.503 . . . . 73.3 110.67 -179.117 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 30.9 m -72.32 -28.71 63.24 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.645 -0.252 . . . . 61.54 110.743 178.736 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 60.6 tp -64.98 -39.88 94.14 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.054 -0.351 . . . . 70.31 110.054 178.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 167' ' ' ARG . . . . . 0.545 ' HG3' ' HG ' ' B' ' 184' ' ' LEU . 29.1 ttp180 -61.73 -36.56 81.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.12 0.486 . . . . 63.02 110.3 177.747 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -66.08 -51.45 57.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.856 -0.611 . . . . 74.21 110.882 175.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -68.56 -46.06 70.45 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.787 -0.642 . . . . 75.31 111.651 -174.043 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -60.9 -37.43 82.19 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.147 0.425 . . . . 33.11 112.147 -176.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 171' ' ' SER . . . . . 0.481 ' HB3' HD23 ' B' ' 184' ' ' LEU . 22.8 p -73.02 -23.51 60.62 Favored 'General case' 0 C--N 1.323 -0.543 0 N-CA-C 112.054 0.391 . . . . 72.21 112.054 -174.649 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -95.89 -8.71 33.3 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.839 0.352 . . . . 75.12 111.138 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 173' ' ' LYS . . . . . 1.092 ' HE2' ' HA ' ' B' ' 173' ' ' LYS . 7.2 mmpt? -86.61 129.88 34.7 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 110.049 -0.352 . . . . 62.23 110.049 177.188 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 19.2 m -58.31 -43.17 88.01 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.841 0.353 . . . . 75.55 111.541 -176.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 175' ' ' SER . . . . . 0.586 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 47.1 t -77.21 -49.29 15.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.049 0.452 . . . . 74.44 110.143 -179.484 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.811 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 73.0 mtp -66.11 -23.94 66.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.757 -0.656 . . . . 72.21 111.789 -175.352 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 177' ' ' LYS . . . . . 0.648 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 28.5 tttp -59.26 -35.94 74.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 65.53 110.788 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -88.86 -21.38 23.71 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 121.519 0.676 . . . . 72.12 110.314 -176.25 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 179' ' ' LEU . . . . . 0.752 ' HB3' HG21 ' A' ' 33' ' ' ILE . 35.8 mt -75.88 -46.24 31.24 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.845 -1.07 . . . . 74.5 110.466 -178.093 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 180' ' ' LEU . . . . . 0.821 ' HB3' HD13 ' B' ' 184' ' ' LEU . 3.7 mm? -98.57 -3.35 36.5 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.532 -0.758 . . . . 75.51 112.027 -174.726 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 181' ' ' LYS . . . . . 0.648 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 64.9 pttt -56.12 -18.24 9.35 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.904 0.705 . . . . 65.31 112.904 -177.459 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -70.04 -38.62 75.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.002 0.43 . . . . 61.02 110.937 179.161 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 183' ' ' VAL . . . . . 0.73 HG21 HD22 ' A' ' 29' ' ' ASN . 18.7 m -108.63 -9.01 11.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.996 -0.547 . . . . 72.41 111.605 -175.636 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 184' ' ' LEU . . . . . 0.821 HD13 ' HB3' ' B' ' 180' ' ' LEU . 8.6 mp -94.64 139.69 22.36 Favored Pre-proline 0 C--N 1.325 -0.488 0 N-CA-C 110.221 -0.289 . . . . 62.05 110.221 177.208 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.55 116.42 3.28 Favored 'Trans proline' 0 CA--C 1.529 0.238 0 C-N-CA 122.985 2.457 . . . . 54.43 112.87 -178.173 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -117.34 -171.72 2.09 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.427 -0.583 . . . . 74.33 109.427 177.415 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -121.56 -0.27 9.77 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.466 0.651 . . . . 70.4 110.257 179.221 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 18.3 mp0 . . . . . 0 C--O 1.25 1.126 0 CA-C-N 115.055 -0.975 . . . . 52.32 110.642 178.985 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.749 0 N-CA-C 112.234 -0.346 . . . . 64.21 112.234 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 29.3 m -87.45 156.34 3.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.586 0.193 . . . . 61.53 110.925 -178.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.489 HD13 ' O ' ' A' ' 3' ' ' LEU . 2.1 tm? -164.02 -27.88 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.141 0.496 . . . . 55.42 110.327 -176.678 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 67.3 mtt -88.99 0.87 56.29 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.221 -0.445 . . . . 74.5 111.243 -177.095 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -83.97 160.27 21.07 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.209 -0.45 . . . . 72.12 110.176 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.408 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 0.2 OUTLIER -114.57 -174.1 2.42 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.063 -0.517 . . . . 75.24 111.127 -172.019 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.95 -117.99 2.06 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 121.084 -0.579 . . . . 74.22 112.171 178.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -147.99 133.42 18.61 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.728 -0.277 . . . . 74.53 111.009 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 42.0 t -123.64 143.03 38.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.731 -0.47 . . . . 53.13 109.731 178.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 86.7 mt -77.16 115.11 16.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.695 0.283 . . . . 75.02 110.742 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.7 m -79.45 110.44 14.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.996 0.427 . . . . 73.15 110.71 178.649 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -117.24 121.59 41.61 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.465 -0.568 . . . . 54.35 109.465 178.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.442 ' HB3' ' H ' ' A' ' 18' ' ' SER . . . -77.5 127.61 32.8 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.853 -0.612 . . . . 55.45 110.898 -178.786 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.77 -56.55 3.77 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.308 -0.406 . . . . 72.2 110.823 -178.451 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -79.24 -50.12 11.44 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.159 -0.473 . . . . 44.04 110.904 -177.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.41 HD13 HD13 ' B' ' 116' ' ' LEU . 76.1 mt -75.79 -40.36 55.3 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.496 -0.774 . . . . 62.24 111.516 -175.339 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.5 m 50.32 57.92 6.07 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.366 0.603 . . . . 64.24 110.581 -172.115 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.547 ' HB2' ' HB2' ' B' ' 118' ' ' SER . 13.5 m -75.97 -1.4 25.48 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.508 -0.769 . . . . 62.12 112.243 -173.73 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.73 87.5 4.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.03 0.443 . . . . 74.32 110.097 178.363 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 14.3 t -103.87 -163.66 1.0 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.675 -0.693 . . . . 72.13 110.533 -176.643 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -78.28 98.21 5.83 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.661 0.615 . . . . 74.44 112.661 -173.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.418 ' O ' ' HB3' ' B' ' 122' ' ' ASP . 17.1 t70 -159.51 121.66 3.41 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-N 115.094 -0.957 . . . . 75.4 108.53 170.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.498 HG22 ' H ' ' B' ' 124' ' ' SER . 6.5 pt -112.58 143.18 22.81 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.136 0 CA-C-N 114.584 -1.189 . . . . 75.01 113.811 -160.721 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.2 m -98.85 136.89 38.21 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.913 -1.04 . . . . 71.21 109.325 171.641 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.533 ' HD3' ' N ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -143.09 22.44 1.9 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.136 0.493 . . . . 74.15 111.214 -171.552 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.2 mp0 -80.24 92.93 5.79 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.933 -0.576 . . . . 65.12 110.627 -177.727 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -131.25 92.49 3.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.096 -0.502 . . . . 65.14 110.138 179.393 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.2 t -115.61 -29.77 6.37 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.621 -0.718 . . . . 63.41 110.241 -179.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.47 ' OD1' ' HB3' ' A' ' 32' ' ' ASN . 36.4 t-20 -89.51 85.36 6.5 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.76 -0.654 . . . . 71.51 110.837 -176.186 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.8 m -119.99 126.59 75.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.431 -0.804 . . . . 70.33 109.575 174.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.409 ' CE2' ' HB3' ' A' ' 43' ' ' PHE . 35.3 p90 49.39 14.57 0.1 Allowed 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.395 1.078 . . . . 61.2 113.095 -177.383 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.47 ' HB3' ' OD1' ' A' ' 29' ' ' ASN . 34.4 t30 -65.11 -46.11 82.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.013 0.435 . . . . 61.0 110.437 -179.417 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.4 HG21 ' O ' ' B' ' 179' ' ' LEU . 40.6 mm -58.97 -34.35 52.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.718 -0.674 . . . . 72.42 110.769 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.479 ' CD1' HD21 ' B' ' 149' ' ' LEU . 80.2 mt -72.14 -28.41 63.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.795 -0.639 . . . . 74.13 110.524 -178.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.99 -44.3 63.7 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.497 -0.557 . . . . 64.22 109.497 174.381 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -60.32 -45.95 91.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.558 -0.746 . . . . 74.33 111.355 -179.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -85.36 0.54 51.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.445 -0.343 . . . . 75.41 111.16 -178.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 21.4 t70 58.1 69.09 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.475 -0.784 . . . . 75.24 111.609 178.416 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.6 m-30 -101.63 -2.21 30.93 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.906 -0.588 . . . . 72.22 110.861 174.155 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.638 ' HG3' ' HE2' ' A' ' 42' ' ' LYS . 7.5 tp10 62.59 80.87 0.24 Allowed Pre-proline 0 N--CA 1.466 0.35 0 O-C-N 123.68 0.613 . . . . 75.15 110.624 -174.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -88.92 138.0 3.4 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.048 2.499 . . . . 72.42 113.352 -176.398 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.678 ' O ' ' HA ' ' B' ' 149' ' ' LEU . 5.6 mptp? -117.82 136.87 53.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 63.24 109.758 177.511 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.606 ' HA ' HG11 ' B' ' 147' ' ' VAL . 12.1 t80 171.16 35.16 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.454 0.645 . . . . 61.0 109.385 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.8 mp -72.46 99.94 2.59 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.608 -0.724 . . . . 75.51 109.966 -178.585 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 1.5 p -97.35 85.14 3.59 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.427 -0.806 . . . . 44.53 110.653 -175.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.496 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.9 OUTLIER -89.52 -2.47 58.37 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.383 -0.826 . . . . 74.25 109.281 179.265 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.53 ' HB ' ' HA ' ' B' ' 143' ' ' PHE . 28.2 m -67.11 123.47 20.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.472 0.653 . . . . 60.52 110.645 177.864 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.496 ' HG3' ' O ' ' A' ' 46' ' ' GLU . 0.2 OUTLIER -147.72 154.56 40.71 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.533 -0.758 . . . . 70.53 110.028 -178.195 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.565 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.9 mp -71.52 82.41 0.81 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.001 0.429 . . . . 74.32 110.765 -178.55 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.09 58.19 4.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.792 -0.64 . . . . 75.14 109.343 173.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.565 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 52.3 p90 -89.24 169.42 11.46 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.674 -0.694 . . . . 72.41 110.723 -175.132 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.509 ' HE3' HD13 ' A' ' 57' ' ' ILE . 3.8 tppp? -100.95 124.27 46.4 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.86 -0.609 . . . . 71.1 111.035 -177.355 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.47 ' HB3' ' CG ' ' A' ' 58' ' ' LYS . 45.2 t -143.04 132.12 23.05 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.947 -0.57 . . . . 64.32 109.535 175.676 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 65.15 11.71 7.4 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.043 -0.526 . . . . 73.42 112.399 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 102.32 -6.35 53.13 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.74 -0.743 . . . . 60.05 112.734 177.467 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -123.72 159.05 30.25 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.841 0.353 . . . . 72.32 110.293 177.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.509 HD13 ' HE3' ' A' ' 52' ' ' LYS . 41.3 mm -78.43 123.97 36.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 109.787 -0.449 . . . . 75.14 109.787 176.406 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.47 ' CG ' ' HB3' ' A' ' 53' ' ' CYS . 27.7 mmmt -104.48 85.26 2.31 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.429 -0.582 . . . . 75.32 109.429 178.605 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.419 ' CG2' ' HD3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -74.07 112.08 9.86 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.021 -0.536 . . . . 73.51 111.525 -174.744 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -123.45 116.01 22.53 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.901 0.381 . . . . 74.42 110.992 178.39 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.5 m -91.1 -12.66 34.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.431 0.634 . . . . 63.3 109.451 172.227 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.462 ' OD2' ' HB3' ' A' ' 64' ' ' GLN . 33.4 t70 -115.6 118.87 34.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.34 -0.845 . . . . 54.32 109.923 -179.565 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -74.11 -25.61 59.88 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.018 0.437 . . . . 62.53 110.511 -176.244 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.463 ' O ' ' HB3' ' A' ' 67' ' ' ARG . 28.5 tt0 -63.23 -39.72 95.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.962 -0.563 . . . . 63.14 109.963 176.267 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.7 m -70.98 -29.05 64.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.641 -0.709 . . . . 75.11 110.77 177.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 69.4 tp -64.74 -38.75 92.06 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.768 -0.456 . . . . 74.02 109.768 175.293 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.463 ' HB3' ' O ' ' A' ' 64' ' ' GLN . 16.5 ttt-85 -56.34 -40.95 75.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.706 -0.679 . . . . 72.02 110.647 174.762 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 60.4 mmtt -60.94 -48.83 79.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.164 -0.471 . . . . 73.12 110.913 177.333 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.509 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 63.3 t80 -67.23 -46.65 73.18 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.673 -0.694 . . . . 75.34 111.194 -177.489 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.5 -29.76 70.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.338 -0.392 . . . . 73.53 111.818 -177.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.4 m -69.21 -25.82 64.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.518 -0.31 . . . . 52.2 111.608 -178.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.509 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 11.6 pt20 -99.37 -0.68 40.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.141 0.496 . . . . 74.24 110.524 -179.335 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.774 ' HE2' ' HA ' ' A' ' 73' ' ' LYS . 9.1 mmpt? -95.96 120.02 35.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.776 -0.647 . . . . 64.05 109.984 177.709 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.6 m -57.0 -42.96 81.25 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.933 0.396 . . . . 41.02 110.813 179.495 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.472 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 4.7 m -78.35 -42.61 30.03 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.034 -0.53 . . . . 74.41 111.212 -176.374 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.734 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 86.9 mtp -74.28 -19.9 60.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.401 -0.363 . . . . 75.12 111.339 -175.39 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.442 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 1.8 tmtm? -56.23 -41.91 76.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.181 -0.463 . . . . 71.51 110.024 177.329 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -85.13 -20.72 29.86 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.621 0.724 . . . . 61.44 110.041 -174.324 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.701 ' HB3' HG21 ' B' ' 133' ' ' ILE . 83.6 mt -75.3 -53.04 9.44 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.734 -1.121 . . . . 73.03 110.235 179.448 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.514 ' HB3' HD12 ' A' ' 84' ' ' LEU . 4.1 mm? -82.62 -16.07 49.74 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.564 -0.744 . . . . 74.55 112.516 -173.886 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.417 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 63.7 pttt -62.79 -14.69 48.31 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 120.755 0.312 . . . . 35.35 111.636 -178.102 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -68.51 -42.94 77.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.128 0.49 . . . . 65.42 110.37 179.269 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.523 HG13 ' HG ' ' A' ' 84' ' ' LEU . 7.7 p -99.09 -37.1 5.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.94 -0.573 . . . . 74.01 111.102 -178.492 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.523 ' HG ' HG13 ' A' ' 83' ' ' VAL . 90.7 mt -92.52 118.81 68.18 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.473 -0.33 . . . . 71.12 110.946 -177.059 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.424 ' HD2' ' HA ' ' A' ' 84' ' ' LEU . 29.0 Cg_endo -62.86 127.62 20.96 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.974 2.449 . . . . 71.13 112.314 179.11 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.511 ' HB3' ' OE1' ' A' ' 88' ' ' GLU . 85.3 mm-40 -100.51 -169.84 1.78 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.663 -0.699 . . . . 75.25 110.02 -178.42 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -118.16 -31.6 4.96 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.248 0.547 . . . . 70.14 110.639 -177.268 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.511 ' OE1' ' HB3' ' A' ' 86' ' ' GLN . 1.4 pm0 . . . . . 0 C--N 1.321 -0.647 0 CA-C-N 115.487 -0.779 . . . . 74.24 110.855 -178.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.544 0 N-CA-C 112.218 -0.353 . . . . 62.11 112.218 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 15.6 m -90.35 113.04 25.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.137 0.494 . . . . 70.44 110.901 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -102.52 -13.18 17.31 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.059 -0.518 . . . . 63.32 110.598 178.293 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 65.5 mtt -90.68 24.53 2.65 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.044 -0.526 . . . . 73.03 111.069 -176.26 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -89.44 166.47 13.68 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.607 -0.516 . . . . 72.55 109.607 177.228 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -135.66 179.5 6.3 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.817 0.341 . . . . 61.41 110.953 -177.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -99.05 -144.97 17.72 Favored Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.969 -0.634 . . . . 72.0 111.796 -179.687 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -125.07 108.48 11.86 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.749 0.309 . . . . 50.11 110.663 -178.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 48.0 t -86.71 94.78 4.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.244 -0.434 . . . . 73.44 110.006 178.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 88.7 mt -60.81 107.96 0.78 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.999 -0.546 . . . . 64.14 110.214 179.356 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 95.4 m -109.61 125.49 52.62 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.97 -0.559 . . . . 63.1 111.144 -176.787 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 112' ' ' LEU . . . . . 0.447 HD13 ' N ' ' B' ' 113' ' ' ALA . 0.5 OUTLIER -73.9 132.83 42.89 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.246 -1.02 . . . . 65.2 108.246 175.074 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 113' ' ' ALA . . . . . 0.656 ' HB1' ' HB2' ' B' ' 116' ' ' LEU . . . -45.25 126.18 6.07 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 123.888 0.742 . . . . 65.12 112.686 -175.877 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.458 ' O ' ' HB2' ' B' ' 115' ' ' ASP . . . -70.17 97.01 1.14 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.125 -0.488 . . . . 70.41 110.29 176.51 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 115' ' ' ASP . . . . . 0.458 ' HB2' ' O ' ' B' ' 114' ' ' ALA . 23.9 m-20 82.91 -36.92 0.08 Allowed 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 114.558 -1.201 . . . . 74.45 111.564 173.738 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.656 ' HB2' ' HB1' ' B' ' 113' ' ' ALA . 58.2 mt -61.02 -43.74 98.43 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.716 -0.475 . . . . 74.42 109.716 176.71 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.443 ' N ' ' HB3' ' B' ' 113' ' ' ALA . 14.4 t 56.34 24.89 8.81 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.42 -0.809 . . . . 45.15 112.174 172.608 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 118' ' ' SER . . . . . 0.547 ' HB2' ' HB2' ' A' ' 18' ' ' SER . 4.2 m -83.53 25.09 0.79 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.331 -0.395 . . . . 74.14 111.518 -176.437 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.479 ' O ' ' HB ' ' B' ' 120' ' ' THR . . . -112.18 107.93 17.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.539 -0.3 . . . . 64.2 110.926 -177.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 120' ' ' THR . . . . . 0.479 ' HB ' ' O ' ' B' ' 119' ' ' ALA . 10.9 t 170.81 -23.84 0.0 OUTLIER 'General case' 0 N--CA 1.461 0.119 0 O-C-N 123.835 0.709 . . . . 75.33 110.126 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.69 79.17 6.09 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.469 -0.787 . . . . 73.15 109.826 -177.37 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 122' ' ' ASP . . . . . 0.418 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 18.3 t70 -159.45 149.5 18.87 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.771 -0.649 . . . . 70.23 109.529 177.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 10.9 tt -138.79 79.39 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.932 0.872 . . . . 75.24 110.332 176.367 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.498 ' H ' HG22 ' A' ' 23' ' ' ILE . 48.8 m -85.48 116.26 23.68 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.492 -0.777 . . . . 64.42 110.284 177.156 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 125' ' ' LYS . . . . . 0.461 ' HD3' ' H ' ' B' ' 125' ' ' LYS . 0.0 OUTLIER -119.52 30.06 7.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.536 0.684 . . . . 73.41 110.429 -177.613 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 26.6 mp0 -82.34 30.72 0.4 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.468 -0.787 . . . . 73.33 111.492 -177.341 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 53.0 m95 -100.68 86.77 3.18 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.348 -0.612 . . . . 54.3 109.348 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 31.7 t -100.25 -18.37 16.88 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.771 -0.65 . . . . 73.12 110.579 -173.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 129' ' ' ASN . . . . . 0.459 ' HB3' HG21 ' A' ' 83' ' ' VAL . 29.3 t-20 -88.47 101.39 13.87 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.935 -0.575 . . . . 60.31 110.32 -177.506 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.554 HG23 ' HD1' ' B' ' 131' ' ' PHE . 10.4 m -128.47 -46.25 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.464 -0.334 . . . . 62.24 111.822 -178.699 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 131' ' ' PHE . . . . . 0.554 ' HD1' HG23 ' B' ' 130' ' ' VAL . 52.3 p90 -120.31 0.24 10.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.793 0.33 . . . . 72.31 110.533 179.259 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.45 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 7.3 t30 -55.41 -55.08 35.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.761 -0.654 . . . . 61.43 111.226 -179.555 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 133' ' ' ILE . . . . . 0.701 HG21 ' HB3' ' A' ' 79' ' ' LEU . 49.0 mm -54.75 -46.89 74.42 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.155 -0.475 . . . . 74.42 111.201 -178.54 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.545 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 84.7 mt -62.82 -37.22 85.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.71 -0.677 . . . . 73.43 111.021 -177.503 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.437 HH11 ' HG2' ' B' ' 136' ' ' GLU . 0.1 OUTLIER -65.61 -41.6 92.55 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.673 0.273 . . . . 53.43 110.53 177.944 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 136' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' B' ' 132' ' ' ASN . 16.6 mt-10 -69.75 -28.13 65.53 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.399 -0.364 . . . . 71.14 111.2 -176.621 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -101.48 8.13 42.17 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.157 0.503 . . . . 73.32 110.439 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 60.27 45.93 10.82 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.11 -0.95 . . . . 65.53 112.395 173.319 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 139' ' ' PHE . . . . . 0.545 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 8.1 m-85 -79.83 -8.92 59.56 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.12 -0.491 . . . . 70.14 109.926 172.663 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 140' ' ' GLU . . . . . 0.437 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 10.5 tp10 63.21 70.69 0.71 Allowed Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 115.306 -0.861 . . . . 73.45 110.679 179.386 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.409 ' C ' ' HD2' ' B' ' 142' ' ' LYS . 89.2 Cg_endo -87.93 151.11 7.15 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.792 2.328 . . . . 74.05 112.348 -179.355 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 142' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' B' ' 143' ' ' PHE . 4.2 mptp? -116.9 131.52 56.93 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.562 -0.533 . . . . 63.44 109.562 179.354 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 143' ' ' PHE . . . . . 0.53 ' HA ' ' HB ' ' A' ' 47' ' ' VAL . 27.8 t80 177.59 60.85 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.351 0.596 . . . . 73.45 109.481 179.298 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 32.1 tp -78.42 93.35 4.71 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.367 -0.605 . . . . 64.14 109.367 176.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 11.8 p -80.96 72.28 7.96 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.889 -0.596 . . . . 70.52 112.046 -173.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -128.59 90.01 2.99 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.922 -0.581 . . . . 74.23 110.304 172.559 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 147' ' ' VAL . . . . . 0.606 HG11 ' HA ' ' A' ' 43' ' ' PHE . 3.2 t -131.73 154.73 40.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 108.032 -1.099 . . . . 74.14 108.032 173.667 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.8 132.25 26.89 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 120.636 -0.425 . . . . 44.23 110.041 179.72 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.678 ' HA ' ' O ' ' A' ' 42' ' ' LYS . 61.7 tp -71.81 79.32 0.87 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.672 -0.694 . . . . 65.2 109.488 176.682 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.641 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -83.81 74.93 10.14 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.941 -0.572 . . . . 73.41 110.997 -177.71 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 151' ' ' PHE . . . . . 0.584 ' CD1' ' HG ' ' B' ' 149' ' ' LEU . 15.0 p90 -107.09 161.63 14.58 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.986 -0.552 . . . . 73.23 110.229 179.131 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 152' ' ' LYS . . . . . 0.417 ' HE3' ' CD1' ' B' ' 157' ' ' ILE . 4.8 tppp? -90.94 117.36 29.48 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.413 -0.812 . . . . 62.34 110.325 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 153' ' ' CYS . . . . . 0.558 ' HB2' ' CE2' ' B' ' 151' ' ' PHE . 42.6 t -135.83 122.65 21.15 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.657 -0.701 . . . . 51.33 110.035 179.013 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.7 t70 73.64 4.27 4.7 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.757 -0.656 . . . . 72.01 111.182 172.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 109.12 -4.02 31.63 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.826 -0.702 . . . . 74.34 112.351 179.041 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -125.45 155.82 39.86 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 110.017 -0.364 . . . . 73.14 110.017 176.226 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 157' ' ' ILE . . . . . 0.417 ' CD1' ' HE3' ' B' ' 152' ' ' LYS . 44.5 mm -84.76 115.52 26.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 109.358 -0.608 . . . . 50.23 109.358 177.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 158' ' ' LYS . . . . . 0.487 ' HE2' ' CE1' ' B' ' 169' ' ' PHE . 31.9 mmmt -100.24 94.63 6.31 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.555 0.217 . . . . 74.13 111.025 -175.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 1.2 p -78.09 111.88 14.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.007 0.432 . . . . 72.03 111.941 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 160' ' ' PHE . . . . . 0.454 ' CD2' HD13 ' B' ' 166' ' ' LEU . 64.1 m-85 -121.16 126.66 50.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.899 -0.591 . . . . 72.12 110.623 175.3 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 54.1 m -99.92 9.86 42.26 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.025 0.44 . . . . 73.52 110.453 174.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -143.51 138.75 29.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.93 -0.577 . . . . 71.4 110.943 -175.568 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 163' ' ' LEU . . . . . 0.478 ' O ' HD13 ' B' ' 163' ' ' LEU . 2.0 tm? -81.35 -33.41 32.44 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.781 -0.452 . . . . 74.01 109.781 -176.731 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 164' ' ' GLN . . . . . 0.449 ' O ' ' HB3' ' B' ' 167' ' ' ARG . 22.1 tt0 -57.97 -47.33 83.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.823 -0.626 . . . . 63.32 110.838 179.516 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 165' ' ' SER . . . . . 0.482 ' O ' ' HB2' ' B' ' 168' ' ' LYS . 18.5 m -70.02 -31.73 69.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.933 -0.576 . . . . 74.42 111.193 179.426 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 166' ' ' LEU . . . . . 0.454 HD13 ' CD2' ' B' ' 160' ' ' PHE . 54.9 tp -67.53 -33.64 75.47 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.709 -0.478 . . . . 73.32 109.709 175.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 167' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' B' ' 164' ' ' GLN . 50.5 ttp180 -59.87 -36.76 77.58 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.693 -0.685 . . . . 75.53 109.879 173.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 168' ' ' LYS . . . . . 0.482 ' HB2' ' O ' ' B' ' 165' ' ' SER . 67.2 mmtt -63.76 -51.69 63.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.761 -0.654 . . . . 75.02 110.522 176.287 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 169' ' ' PHE . . . . . 0.487 ' CE1' ' HE2' ' B' ' 158' ' ' LYS . 41.0 t80 -59.47 -41.6 90.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.797 -0.638 . . . . 54.1 110.509 -178.14 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 170' ' ' ALA . . . . . 0.543 ' HB2' HD12 ' B' ' 180' ' ' LEU . . . -62.79 -42.56 99.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.214 -0.448 . . . . 74.11 111.591 178.619 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 49.3 m -67.22 -28.81 68.38 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.492 -0.322 . . . . 40.13 111.598 -176.227 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -95.51 9.57 39.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.091 0.472 . . . . 71.21 110.731 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 55.6 mmtt -118.21 156.68 28.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.84 -0.618 . . . . 72.44 110.757 179.367 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.2 p -87.13 -56.18 3.49 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.17 0.509 . . . . 62.42 109.681 172.662 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 175' ' ' SER . . . . . 0.534 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 3.4 m -55.95 -53.74 53.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.449 -0.796 . . . . 73.02 111.427 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 19.0 mtp -74.7 -20.04 60.01 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.041 -0.527 . . . . 73.55 112.163 -172.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -64.36 -36.38 83.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.09 0.472 . . . . 74.23 110.671 178.295 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -94.21 -11.52 30.15 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 115.792 -0.64 . . . . 53.34 109.905 -173.082 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 179' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' B' ' 175' ' ' SER . 62.8 mt -76.03 -51.4 12.4 Favored 'General case' 0 N--CA 1.437 -1.101 0 N-CA-C 108.971 -0.752 . . . . 70.15 108.971 174.575 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 180' ' ' LEU . . . . . 0.543 HD12 ' HB2' ' B' ' 170' ' ' ALA . 8.5 mt -92.42 -1.48 56.98 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.524 -0.762 . . . . 64.2 111.574 -171.201 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -60.18 -13.22 11.15 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.769 0.319 . . . . 64.12 111.729 178.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -70.21 -29.44 66.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.991 0.424 . . . . 53.4 110.782 178.077 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 28.5 m -114.66 -19.9 6.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.185 -0.461 . . . . 63.43 111.355 179.327 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 184' ' ' LEU . . . . . . . . . . . . . 83.5 mt -98.06 118.01 64.27 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 109.877 -0.416 . . . . 71.24 109.877 178.398 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -62.29 109.92 0.94 Allowed 'Trans proline' 0 N--CA 1.464 -0.263 0 C-N-CA 122.899 2.399 . . . . 72.34 112.699 -176.308 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -84.42 121.5 27.64 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.904 -0.589 . . . . 74.14 109.658 176.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 24.8 mtmt -59.76 -59.13 5.93 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.66 -0.7 . . . . 51.22 109.536 177.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 . . . . . 0 C--O 1.251 1.163 0 CA-C-N 114.812 -1.086 . . . . 63.52 110.18 -175.405 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.454 ' CD2' HD11 ' B' ' 149' ' ' LEU . 41.3 p90 . . . . . 0 N--CA 1.477 0.916 0 N-CA-C 113.518 0.933 . . . . 70.319999999999993 113.518 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.505 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 54.0 t30 -59.53 -51.94 67.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.924 0.392 . . . . 73.239999999999995 111.334 -175.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.524 ' H ' HD12 ' A' ' 33' ' ' ILE . 3.4 mp -61.1 -39.51 82.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.822 -0.627 . . . . 63.229999999999997 111.25 -175.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.3 mt -62.19 -35.44 78.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.808 0.337 . . . . 74.140000000000001 110.964 179.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 47.8 ttt180 -69.46 -44.01 72.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.219 -0.446 . . . . 65.340000000000003 110.454 177.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.505 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 36.9 mt-10 -66.02 -26.19 67.42 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.136 -0.484 . . . . 64.230000000000004 111.263 -178.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -100.01 1.06 42.14 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.275 -0.421 . . . . 71.25 111.079 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 62.29 45.61 6.61 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 113.044 0.757 . . . . 72.129999999999995 113.044 173.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.458 ' HB3' ' HB2' ' B' ' 151' ' ' PHE . 13.5 m-85 -78.16 -8.01 57.77 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.287 -0.635 . . . . 74.140000000000001 109.287 169.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 54.24 79.4 0.34 Allowed Pre-proline 0 C--O 1.233 0.211 0 CA-C-N 114.706 -1.134 . . . . 73.319999999999993 111.286 -173.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.479 ' HB3' HD12 ' B' ' 149' ' ' LEU . 7.7 Cg_exo -72.45 165.72 31.86 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.48 2.12 . . . . 74.439999999999998 110.771 175.082 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.933 ' HD2' ' HB3' ' B' ' 150' ' ' ALA . 0.1 OUTLIER . . . . . 0 C--N 1.32 -0.716 0 C-N-CA 120.313 -0.555 . . . . 75.430000000000007 110.315 -179.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.613 ' HA ' ' HA ' ' A' ' 61' ' ' SER . 0.3 OUTLIER . . . . . 0 CA--C 1.507 -0.693 0 N-CA-C 108.884 -0.784 . . . . 73.230000000000004 108.884 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.555 ' HB3' ' CD1' ' A' ' 51' ' ' PHE . 8.5 mp -74.2 88.9 1.99 Allowed 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 109.705 -0.479 . . . . 70.129999999999995 109.705 172.327 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.936 ' HB3' ' HD2' ' B' ' 142' ' ' LYS . . . -90.62 86.66 6.45 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.709 -0.678 . . . . 71.140000000000001 109.337 173.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.555 ' CD1' ' HB3' ' A' ' 49' ' ' LEU . 44.9 p90 -124.03 167.23 14.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.343 -0.844 . . . . 71.319999999999993 110.741 -173.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.7 tppt? -90.85 112.36 24.16 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.934 -0.575 . . . . 73.25 110.448 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.533 ' HB2' ' CE2' ' A' ' 51' ' ' PHE . 46.1 t -124.76 113.71 18.31 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.032 -0.531 . . . . 73.209999999999994 110.162 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 t70 64.7 24.49 12.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.736 -0.666 . . . . 74.200000000000003 111.487 173.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 105.94 -19.3 38.45 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.239 -0.982 . . . . 72.129999999999995 113.381 177.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.461 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 10.3 pt-20 -115.68 147.48 40.8 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 117.262 0.531 . . . . 62.409999999999997 111.127 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 43.6 mm -81.31 120.48 33.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.057 -0.52 . . . . 73.340000000000003 110.033 176.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.737 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 28.9 mmmt -101.78 148.9 24.74 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.992 -0.549 . . . . 75.030000000000001 109.537 179.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -121.29 109.23 14.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.97 0.414 . . . . 74.540000000000006 110.927 173.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.421 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 69.0 m-85 -117.16 101.53 8.54 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.122 0.487 . . . . 54.210000000000001 111.027 177.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.613 ' HA ' ' HA ' ' A' ' 48' ' ' LYS . 3.2 p -85.58 -12.99 50.2 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.448 -0.797 . . . . 75.099999999999994 110.241 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.67 ' OD2' ' HB3' ' A' ' 64' ' ' GLN . 33.6 t70 -127.68 113.38 15.96 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.349 -0.841 . . . . 72.329999999999998 109.396 177.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.91 -23.01 62.19 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.088 -0.505 . . . . 50.329999999999998 111.113 -175.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.67 ' HB3' ' OD2' ' A' ' 62' ' ' ASP . 0.7 OUTLIER -58.27 -50.25 74.25 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.814 -0.81 . . . . 74.439999999999998 108.814 172.172 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.1 m -64.74 -27.8 69.15 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.335 -0.848 . . . . 51.530000000000001 110.855 177.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 64.1 tp -69.05 -32.47 71.99 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.78 0.324 . . . . 70.349999999999994 110.63 177.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 62.9 ttt180 -61.55 -34.61 75.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.938 0.399 . . . . 75.420000000000002 110.177 175.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.582 ' HE2' ' OE1' ' A' ' 64' ' ' GLN . 62.8 mttm -68.63 -26.09 65.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.204 0.526 . . . . 71.120000000000005 110.607 178.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.467 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 78.1 t80 -85.83 -52.9 5.45 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.691 -0.686 . . . . 71.140000000000001 111.257 -177.233 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.46 ' HA ' ' HB2' ' A' ' 73' ' ' LYS . . . -68.04 -14.56 63.06 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.282 0.475 . . . . 62.520000000000003 112.282 -175.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.0 p -78.55 -32.04 47.67 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.758 0.313 . . . . 62.219999999999999 110.723 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.467 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 10.5 pt20 -91.65 -21.62 20.7 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.092 0.473 . . . . 43.539999999999999 109.945 177.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.46 ' HB2' ' HA ' ' A' ' 70' ' ' ALA . 29.6 mmmt -79.97 106.3 11.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.784 -0.644 . . . . 75.209999999999994 110.375 175.189 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.8 t -58.22 -37.74 75.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.964 0.411 . . . . 74.230000000000004 110.351 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.4 m -58.8 -52.41 65.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.105 -0.498 . . . . 61.539999999999999 111.141 178.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 84.1 mtp -80.5 -17.07 52.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.197 -0.456 . . . . 72.5 111.11 -175.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.625 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 25.1 ttmm -62.66 -24.6 67.7 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-N 116.279 -0.419 . . . . 75.150000000000006 110.152 175.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -92.48 -9.23 42.2 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.301 0.572 . . . . 73.5 110.132 -177.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.61 ' HB3' HG21 ' B' ' 133' ' ' ILE . 78.5 mt -95.62 -50.87 4.77 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.857 -1.065 . . . . 51.219999999999999 109.978 178.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.9 mt -90.71 -5.52 55.63 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.967 -0.56 . . . . 62.439999999999998 111.94 -172.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.625 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 64.5 pttt -58.34 -19.01 31.73 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.228 0.455 . . . . 75.209999999999994 112.228 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -76.89 -29.54 55.81 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.784 0.326 . . . . 73.299999999999997 110.865 -178.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.464 HG23 ' HG ' ' A' ' 84' ' ' LEU . 27.6 m -108.35 -27.21 3.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.403 -0.362 . . . . 62.310000000000002 111.716 -178.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.464 ' HG ' HG23 ' A' ' 83' ' ' VAL . 93.9 mt . . . . . 0 C--N 1.326 -0.413 0 CA-C-N 116.658 -0.246 . . . . 65.109999999999999 110.418 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 131' ' ' PHE . . . . . 0.409 ' HB3' HD21 ' A' ' 49' ' ' LEU . 20.2 p90 . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 114.024 1.12 . . . . 74.340000000000003 114.024 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 132' ' ' ASN . . . . . 0.463 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 53.3 t30 -59.86 -55.23 36.78 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.713 0.292 . . . . 72.129999999999995 111.096 -176.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 133' ' ' ILE . . . . . 0.61 HG21 ' HB3' ' A' ' 79' ' ' LEU . 39.3 mm -58.84 -38.38 72.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.484 0.659 . . . . 73.319999999999993 110.771 -179.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.484 HD22 HD23 ' A' ' 49' ' ' LEU . 10.2 mp -66.3 -34.36 77.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.304 -0.862 . . . . 74.209999999999994 111.094 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -67.47 -40.38 85.31 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.036 -0.529 . . . . 72.120000000000005 110.152 178.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 136' ' ' GLU . . . . . 0.463 ' HG3' ' O ' ' B' ' 132' ' ' ASN . 27.2 mt-10 -69.16 -42.74 75.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.883 -0.599 . . . . 74.120000000000005 111.086 -178.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -87.1 1.18 53.79 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.324 -0.398 . . . . 72.129999999999995 111.396 -178.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 37.5 t70 53.78 66.99 1.08 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.681 0.753 . . . . 62.130000000000003 111.581 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -90.38 -1.35 57.9 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.281 -0.872 . . . . 73.5 109.838 171.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 57.34 67.33 2.52 Favored Pre-proline 0 C--O 1.234 0.283 0 CA-C-N 114.855 -1.066 . . . . 44.100000000000001 110.902 -176.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -74.94 161.14 39.42 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.244 1.963 . . . . 74.430000000000007 111.299 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 142' ' ' LYS . . . . . 0.936 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.602 0 C-N-CA 120.447 -0.501 . . . . 74.329999999999998 110.256 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.509 -0.613 0 N-CA-C 109.33 -0.618 . . . . 72.299999999999997 109.33 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.63 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 1.8 mm? -67.49 92.73 0.31 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.463 -0.79 . . . . 75.430000000000007 110.99 -178.264 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.933 ' HB3' ' HD2' ' A' ' 42' ' ' LYS . . . -88.89 78.76 7.5 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.116 -0.947 . . . . 33.329999999999998 109.368 173.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 151' ' ' PHE . . . . . 0.63 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 49.5 p90 -111.22 164.45 12.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.557 -0.747 . . . . 73.040000000000006 110.802 -176.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 6.8 tppt? -90.22 116.4 28.18 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.861 -0.609 . . . . 70.239999999999995 110.85 -177.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 153' ' ' CYS . . . . . . . . . . . . . 44.6 t -130.69 114.07 14.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.291 -0.413 . . . . 65.420000000000002 110.328 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 64.26 22.8 12.92 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.578 -0.737 . . . . 73.409999999999997 112.56 173.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 109.75 -24.52 19.32 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.143 -1.027 . . . . 70.010000000000005 112.988 176.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -112.73 149.89 32.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 117.163 0.482 . . . . 73.120000000000005 110.889 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 46.9 mm -79.81 130.91 35.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.074 -0.512 . . . . 71.519999999999996 109.953 176.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 158' ' ' LYS . . . . . 0.852 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 26.5 mmmt -100.71 157.3 16.79 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.068 -0.716 . . . . 72.099999999999994 109.068 178.212 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -132.58 109.32 9.67 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.94 0.4 . . . . 73.219999999999999 110.919 174.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 160' ' ' PHE . . . . . 0.441 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 80.2 m-85 -120.73 115.41 23.26 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.115 -0.493 . . . . 73.329999999999998 111.149 -179.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 33.9 m -98.03 4.6 49.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.187 0.518 . . . . 72.200000000000003 110.603 178.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -147.14 126.55 13.16 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.065 -0.516 . . . . 74.109999999999999 109.751 -177.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 92.5 mt -71.82 -21.27 61.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.515 -0.311 . . . . 73.340000000000003 110.859 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 164' ' ' GLN . . . . . 0.536 ' OE1' ' HE3' ' B' ' 168' ' ' LYS . 0.6 OUTLIER -69.73 -41.77 74.86 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.779 -0.822 . . . . 65.129999999999995 108.779 176.103 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 32.6 t -67.69 -42.38 82.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.295 -0.866 . . . . 63.219999999999999 109.895 175.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 64.9 tp -63.66 -31.52 72.72 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.041 -0.527 . . . . 65.329999999999998 110.489 178.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . 0.524 ' HD2' HD22 ' B' ' 184' ' ' LEU . 56.3 ttt180 -56.8 -45.86 81.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.226 -0.443 . . . . 74.150000000000006 110.868 176.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 168' ' ' LYS . . . . . 0.536 ' HE3' ' OE1' ' B' ' 164' ' ' GLN . 93.1 mttt -63.8 -30.56 71.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.123 -0.489 . . . . 34.210000000000001 110.864 -178.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -80.46 -47.88 13.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.947 -0.57 . . . . 62.5 110.61 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -66.18 -29.6 69.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.948 -0.569 . . . . 40.229999999999997 111.619 -175.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 34.2 p -68.68 -45.4 71.76 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 121.124 -0.23 . . . . 75.340000000000003 110.914 -179.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -82.88 -3.87 57.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.191 0.52 . . . . 63.409999999999997 110.858 -178.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 173' ' ' LYS . . . . . 0.423 ' HB3' ' HE3' ' B' ' 173' ' ' LYS . 24.2 mmmt -86.74 111.02 20.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.078 -0.51 . . . . 73.019999999999996 110.035 173.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 48.3 t -55.82 -37.48 68.72 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.797 0.332 . . . . 75.299999999999997 111.711 -177.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 8.6 p -78.26 -46.64 19.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.845 0.355 . . . . 51.130000000000003 111.602 -178.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 81.6 mtp -76.29 -12.79 60.14 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.352 -0.385 . . . . 61.240000000000002 111.688 -175.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 19.0 ttmm -57.24 -30.09 64.34 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.869 -0.605 . . . . 74.310000000000002 111.15 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -100.58 5.02 43.85 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.356 0.598 . . . . 75.439999999999998 110.716 -175.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 179' ' ' LEU . . . . . 0.493 ' HB3' HG21 ' A' ' 33' ' ' ILE . 63.4 mt -97.51 -53.59 3.4 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.578 -0.737 . . . . 74.239999999999995 110.217 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 180' ' ' LEU . . . . . 0.502 ' HB3' HD12 ' B' ' 184' ' ' LEU . 3.5 mm? -86.39 1.39 51.42 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.807 -0.633 . . . . 60.340000000000003 111.322 -176.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -49.33 -29.14 5.65 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.111 0.782 . . . . 75.310000000000002 113.111 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -73.12 -28.51 62.3 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.413 0.523 . . . . 64.140000000000001 112.413 -174.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 183' ' ' VAL . . . . . 0.748 HG23 ' HG ' ' B' ' 184' ' ' LEU . 31.5 m -112.01 -14.32 10.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.864 0.364 . . . . 51.520000000000003 111.122 179.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 184' ' ' LEU . . . . . 0.748 ' HG ' HG23 ' B' ' 183' ' ' VAL . 42.5 mt . . . . . 0 C--N 1.325 -0.484 0 CA-C-N 116.12 -0.491 . . . . 70.099999999999994 110.133 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 45.7 p90 . . . . . 0 N--CA 1.456 -0.145 0 CA-C-O 120.781 0.324 . . . . 75.140000000000001 110.838 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.519 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 6.8 t30 -62.42 -44.15 97.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.319 -0.4 . . . . 55.420000000000002 111.124 -178.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 39.5 mm -55.39 -46.22 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-O 121.332 0.587 . . . . 60.229999999999997 110.705 177.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.524 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 68.7 mt -65.46 -32.59 74.29 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.684 -0.689 . . . . 64.329999999999998 111.178 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -70.0 -38.99 76.15 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.798 0.332 . . . . 61.399999999999999 110.219 177.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 6.0 mm-40 -70.21 -23.08 62.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.172 -0.467 . . . . 75.430000000000007 110.819 179.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 28.9 m-80 -99.59 1.95 44.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.227 -0.442 . . . . 73.319999999999993 110.927 177.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 60.85 43.47 11.9 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.543 -0.753 . . . . 74.200000000000003 112.185 176.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.524 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 3.4 m-85 -80.06 -11.66 59.75 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.875 -0.602 . . . . 74.129999999999995 109.451 171.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 57.32 73.93 0.72 Allowed Pre-proline 0 C--O 1.231 0.108 0 CA-C-N 114.806 -1.088 . . . . 71.230000000000004 111.054 -175.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.558 ' C ' ' HE2' ' A' ' 42' ' ' LYS . 83.3 Cg_endo -86.42 147.27 8.66 Favored 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.735 2.29 . . . . 71.400000000000006 111.685 177.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.558 ' HE2' ' C ' ' A' ' 41' ' ' PRO . 1.4 mpmm? . . . . . 0 C--N 1.322 -0.614 0 CA-C-O 121.326 0.584 . . . . 72.040000000000006 111.072 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.449 -0.502 0 N-CA-C 108.867 -0.79 . . . . 75.109999999999999 108.867 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.858 ' H ' HD23 ' A' ' 49' ' ' LEU . 0.3 OUTLIER -76.15 91.47 3.16 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.32 0.581 . . . . 54.520000000000003 110.891 -175.404 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.638 ' HB2' HG23 ' A' ' 59' ' ' THR . . . -84.54 78.32 9.86 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.177 -0.92 . . . . 72.239999999999995 109.638 173.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.443 ' HB3' ' HA ' ' B' ' 141' ' ' PRO . 52.1 p90 -97.98 162.57 13.16 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.012 -0.54 . . . . 63.399999999999999 110.791 -174.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -93.17 119.73 32.69 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.118 -0.492 . . . . 73.349999999999994 110.078 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.479 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 45.4 t -128.7 108.96 10.9 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.372 -0.376 . . . . 54.149999999999999 110.621 178.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.5 t70 72.88 2.15 4.27 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.581 -0.736 . . . . 70.349999999999994 111.97 171.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 129.39 -25.87 4.46 Favored Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.184 -1.008 . . . . 63.210000000000001 112.587 179.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.493 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 11.2 pt-20 -106.07 149.18 26.96 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.643 -0.423 . . . . 63.439999999999998 110.788 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 44.6 mm -84.39 117.14 29.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.032 -0.531 . . . . 71.140000000000001 109.778 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.584 ' HB3' ' CE1' ' A' ' 60' ' ' PHE . 30.1 mmmt -99.2 102.43 14.08 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.328 -0.396 . . . . 64.439999999999998 110.362 -177.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.638 HG23 ' HB2' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -82.86 101.91 11.3 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.242 -0.435 . . . . 75.510000000000005 110.588 178.186 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.584 ' CE1' ' HB3' ' A' ' 58' ' ' LYS . 4.8 m-85 -108.25 136.1 48.47 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.43 -0.35 . . . . 64.409999999999997 111.576 -177.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.4 p -118.73 -0.46 11.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.996 -0.547 . . . . 71.329999999999998 111.006 174.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -130.43 135.58 48.14 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 120.853 0.359 . . . . 74.040000000000006 111.841 -177.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.9 tp -70.69 -34.96 72.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.713 -0.676 . . . . 74.239999999999995 109.594 174.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -57.45 -44.98 85.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.607 -0.724 . . . . 75.150000000000006 110.615 176.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.435 ' O ' ' HG3' ' A' ' 68' ' ' LYS . 50.9 m -69.75 -33.12 72.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.842 -0.617 . . . . 75.349999999999994 110.829 179.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 46.6 tp -68.22 -37.79 81.21 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.993 -0.373 . . . . 72.5 109.993 177.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 51.6 ttp180 -58.6 -50.16 74.82 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.874 -0.603 . . . . 73.420000000000002 111.0 178.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.528 ' HD3' ' N ' ' A' ' 69' ' ' PHE . 0.0 OUTLIER -67.7 -39.59 84.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.799 0.333 . . . . 65.310000000000002 111.396 -178.202 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.528 ' N ' ' HD3' ' A' ' 68' ' ' LYS . 74.0 t80 -67.11 -44.83 78.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.897 -0.592 . . . . 72.340000000000003 110.933 -178.58 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.74 -30.01 70.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.347 -0.388 . . . . 61.420000000000002 111.134 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.8 t -72.72 -35.16 67.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.34 -0.391 . . . . 53.030000000000001 110.818 -178.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -86.81 -11.9 49.57 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.035 0.445 . . . . 74.549999999999997 110.729 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.479 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 27.3 mmmt -89.82 122.77 33.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.095 -0.502 . . . . 74.019999999999996 110.2 175.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.5 m -63.99 -38.65 91.85 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.585 0.231 . . . . 65.140000000000001 111.344 -178.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.408 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 10.7 p -72.98 -40.23 65.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.882 0.372 . . . . 55.409999999999997 111.367 -179.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.469 ' HA ' HD12 ' A' ' 79' ' ' LEU . 74.3 mtp -85.18 -15.21 44.46 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.935 0.346 . . . . 53.32 111.935 -174.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 81.0 tttt -59.84 -37.47 79.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.217 -0.447 . . . . 65.25 111.79 -174.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.631 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 28.2 mt-10 -102.51 7.74 40.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.644 0.735 . . . . 54.119999999999997 110.651 -176.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.649 ' HB3' HG21 ' B' ' 133' ' ' ILE . 70.0 mt -87.3 -41.18 13.85 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.138 -0.937 . . . . 75.340000000000003 109.549 174.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -101.02 6.44 43.46 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.609 -0.723 . . . . 64.030000000000001 110.509 -178.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.631 ' HB3' ' HA ' ' A' ' 78' ' ' GLU . 18.8 ptmt -61.27 -12.83 14.86 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.447 -0.797 . . . . 74.329999999999998 112.124 -178.147 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -81.57 -46.08 14.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.751 0.31 . . . . 73.329999999999998 110.931 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 24.6 m -84.62 -18.83 9.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.1 0.476 . . . . 73.549999999999997 110.66 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 55.3 mt . . . . . 0 C--N 1.323 -0.555 0 N-CA-C 108.448 -0.945 . . . . 72.430000000000007 108.448 171.655 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 40.5 p90 . . . . . 0 N--CA 1.454 -0.241 0 CA-C-O 121.261 0.553 . . . . 74.120000000000005 109.604 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -63.02 -63.54 1.17 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.136 -0.938 . . . . 64.310000000000002 111.72 -173.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 133' ' ' ILE . . . . . 0.649 HG21 ' HB3' ' A' ' 79' ' ' LEU . 48.6 mm -60.45 -37.58 75.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.399 0.618 . . . . 64.230000000000004 110.609 -178.326 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.542 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 79.0 mt -60.94 -40.03 91.71 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.473 -0.785 . . . . 52.539999999999999 111.143 179.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' B' ' 135' ' ' ARG . 28.4 ttt180 -65.61 -42.93 91.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.733 0.301 . . . . 54.109999999999999 110.359 177.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -61.33 -35.62 77.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.867 -0.606 . . . . 64.239999999999995 111.317 -179.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -98.09 9.21 43.42 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.186 -0.461 . . . . 74.340000000000003 110.841 -179.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 63.1 41.09 8.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.422 -0.808 . . . . 74.219999999999999 112.619 171.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 139' ' ' PHE . . . . . 0.542 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 26.3 m-85 -74.01 -15.39 61.09 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.541 -0.54 . . . . 73.420000000000002 109.541 170.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 52.5 74.62 0.75 Allowed Pre-proline 0 C--O 1.234 0.262 0 CA-C-N 114.89 -1.05 . . . . 71.109999999999999 110.952 -176.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . 0.443 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 95.8 Cg_endo -88.22 178.42 3.04 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.875 2.383 . . . . 74.439999999999998 111.904 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 142' ' ' LYS . . . . . 0.476 ' H ' ' HA ' ' A' ' 49' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--N 1.325 -0.497 0 CA-C-O 121.33 0.586 . . . . 51.439999999999998 111.211 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.448 -0.57 0 CA-C-O 121.251 0.548 . . . . 74.140000000000001 109.756 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.787 HD23 ' H ' ' B' ' 149' ' ' LEU . 0.3 OUTLIER -76.96 90.11 3.54 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.273 -0.421 . . . . 71.230000000000004 110.692 -178.34 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.589 ' HA ' ' O ' ' B' ' 158' ' ' LYS . . . -80.15 85.0 5.76 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.531 -0.759 . . . . 71.299999999999997 109.831 174.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 151' ' ' PHE . . . . . 0.408 ' HB2' ' HB3' ' A' ' 39' ' ' PHE . 52.1 p90 -104.67 165.5 11.02 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.924 -0.58 . . . . 74.099999999999994 110.319 -177.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 2.4 tppp? -93.65 116.11 28.59 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.006 -0.543 . . . . 65.319999999999993 110.032 176.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 153' ' ' CYS . . . . . . . . . . . . . 23.1 t -88.85 -131.61 0.08 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.322 -0.854 . . . . 75.409999999999997 110.028 178.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -74.06 35.98 0.09 Allowed 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 123.962 0.905 . . . . 71.439999999999998 111.556 -179.068 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 110.59 -17.18 28.39 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.676 -0.773 . . . . 60.409999999999997 111.541 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 156' ' ' GLU . . . . . 0.431 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 13.1 pt-20 -106.06 140.85 38.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.879 0.371 . . . . 74.450000000000003 110.631 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 41.3 mm -82.93 120.65 34.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 109.494 -0.558 . . . . 64.439999999999998 109.494 176.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 158' ' ' LYS . . . . . 0.589 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 31.6 mmmt -103.99 132.75 49.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.682 0.277 . . . . 63.329999999999998 111.084 -176.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -112.58 103.7 11.76 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.212 -0.449 . . . . 74.430000000000007 111.377 177.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 160' ' ' PHE . . . . . 0.461 ' CD2' HD13 ' B' ' 166' ' ' LEU . 64.6 m-85 -120.01 143.69 47.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.135 -0.484 . . . . 63.450000000000003 110.722 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 18.9 p -118.57 -18.37 9.08 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.49 0.662 . . . . 50.329999999999998 109.481 173.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -111.16 138.66 47.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.293 -0.867 . . . . 63.329999999999998 109.206 178.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.9 pp -81.69 -10.96 59.25 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.858 -0.423 . . . . 72.349999999999994 109.858 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -65.49 -51.98 56.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.364 0.602 . . . . 72.140000000000001 109.83 175.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . 0.519 ' O ' ' HG3' ' B' ' 168' ' ' LYS . 0.3 OUTLIER -70.42 -31.64 68.91 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.363 -0.835 . . . . 53.329999999999998 110.623 179.287 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . 0.461 HD13 ' CD2' ' B' ' 160' ' ' PHE . 68.7 tp -69.99 -41.36 74.51 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.179 -0.464 . . . . 72.129999999999995 110.593 177.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . 0.67 ' HG3' HD13 ' B' ' 184' ' ' LEU . 50.6 ttp180 -61.88 -47.63 84.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.364 -0.38 . . . . 74.310000000000002 110.772 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 168' ' ' LYS . . . . . 0.519 ' HG3' ' O ' ' B' ' 165' ' ' SER . 0.0 OUTLIER -65.22 -36.54 84.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.925 0.393 . . . . 40.439999999999998 110.879 -179.711 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -65.52 -48.62 71.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.738 -0.665 . . . . 74.120000000000005 110.606 175.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.02 -37.04 83.41 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.403 -0.362 . . . . 60.130000000000003 111.446 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 10.9 t -68.43 -22.31 64.61 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.401 -0.363 . . . . 50.420000000000002 111.26 -177.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -102.05 3.53 38.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.955 0.407 . . . . 73.409999999999997 110.633 178.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 173' ' ' LYS . . . . . 0.45 ' O ' ' HB2' ' B' ' 177' ' ' LYS . 27.4 mmmt -104.27 111.81 24.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.181 -0.463 . . . . 72.439999999999998 110.747 -179.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 25.2 m -52.8 -31.75 40.38 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 123.241 0.338 . . . . 43.43 111.898 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 11.0 p -81.84 -49.49 10.3 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.757 0.313 . . . . 63.420000000000002 111.622 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.457 ' HA ' HD12 ' B' ' 179' ' ' LEU . 82.1 mtp -80.78 -18.61 47.04 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.201 0.445 . . . . 72.109999999999999 112.201 -172.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 177' ' ' LYS . . . . . 0.45 ' HB2' ' O ' ' B' ' 173' ' ' LYS . 79.8 tttt -60.88 -31.31 70.79 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.183 -0.462 . . . . 74.430000000000007 110.936 -176.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . 0.925 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 44.4 mt-10 -99.15 3.28 46.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.457 0.646 . . . . 65.439999999999998 110.641 -174.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 179' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' B' ' 176' ' ' MET . 86.3 mt -93.38 -56.44 2.94 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.464 -0.789 . . . . 54.219999999999999 110.378 178.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 180' ' ' LEU . . . . . 0.43 ' HB3' HD12 ' B' ' 184' ' ' LEU . 3.5 mm? -76.54 -10.98 59.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.665 -0.698 . . . . 64.310000000000002 111.666 -176.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 181' ' ' LYS . . . . . 0.925 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 17.5 ptmt -61.37 -9.43 5.36 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.851 0.686 . . . . 72.310000000000002 112.851 -174.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -76.09 -31.91 58.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.998 0.428 . . . . 65.409999999999997 110.585 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 20.8 m -113.24 -10.77 12.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.016 -0.538 . . . . 61.310000000000002 110.806 178.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 184' ' ' LEU . . . . . 0.67 HD13 ' HG3' ' B' ' 167' ' ' ARG . 95.7 mt . . . . . 0 C--N 1.327 -0.388 0 N-CA-C 108.977 -0.749 . . . . 71.239999999999995 108.977 173.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 43.5 p90 . . . . . 0 C--O 1.234 0.252 0 CA-C-O 120.637 0.256 . . . . 63.310000000000002 111.062 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.591 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 6.5 t30 -65.69 -42.5 91.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.27 -0.423 . . . . 63.539999999999999 110.922 -173.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.63 HG21 ' HB3' ' B' ' 179' ' ' LEU . 30.2 mm -74.26 -32.8 32.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.643 0.735 . . . . 62.240000000000002 110.479 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.507 HD12 HD23 ' B' ' 149' ' ' LEU . 76.6 mt -70.75 -34.48 71.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.387 -0.824 . . . . 70.010000000000005 111.749 -175.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.569 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 7.9 ptm180 -69.62 -37.24 76.76 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.969 0.414 . . . . 61.109999999999999 110.536 178.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.591 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 38.2 mt-10 -63.33 -44.68 94.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.61 -0.723 . . . . 75.140000000000001 111.387 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 -95.41 5.99 50.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.255 -0.43 . . . . 75.200000000000003 110.973 -175.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 55.48 65.77 1.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.355 -0.839 . . . . 74.010000000000005 112.685 177.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.409 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 4.6 m-85 -90.53 -3.61 57.48 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.461 -0.791 . . . . 73.310000000000002 109.397 170.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.402 ' O ' ' HA ' ' B' ' 151' ' ' PHE . 45.3 mt-10 56.98 71.17 1.18 Allowed Pre-proline 0 CA--C 1.53 0.186 0 CA-C-N 114.958 -1.019 . . . . 64.420000000000002 111.565 -179.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.402 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 85.1 Cg_endo -85.18 170.11 9.69 Favored 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 122.456 2.104 . . . . 63.409999999999997 111.693 177.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.651 ' HD3' ' HB3' ' B' ' 150' ' ' ALA . 5.1 mptp? . . . . . 0 C--N 1.323 -0.586 0 C-N-CA 121.07 -0.252 . . . . 73.430000000000007 110.359 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.436 0 CA-C-O 121.475 0.655 . . . . 74.420000000000002 109.79 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.79 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.9 mp -75.55 94.8 3.22 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.353 -0.84 . . . . 70.409999999999997 110.949 -175.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -87.25 59.33 5.5 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.637 -0.505 . . . . 63.340000000000003 109.637 172.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.79 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 54.9 p90 -88.08 166.94 14.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.097 -0.501 . . . . 74.239999999999995 110.713 -176.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.4 tppp? -96.15 131.51 42.52 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.524 -0.762 . . . . 73.439999999999998 110.415 179.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.473 ' SG ' ' HE2' ' A' ' 69' ' ' PHE . 49.7 t -139.35 107.73 5.82 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.869 0.366 . . . . 73.219999999999999 110.478 175.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 t70 70.54 13.56 7.36 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.429 -0.805 . . . . 74.040000000000006 111.56 172.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 120.17 -29.6 5.92 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.291 -0.957 . . . . 64.510000000000005 112.702 177.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.449 ' CD ' ' HD3' ' A' ' 58' ' ' LYS . 12.7 pt-20 -102.17 155.2 18.36 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 110.064 -0.347 . . . . 75.299999999999997 110.064 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 47.8 mm -86.86 129.2 38.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.494 -0.558 . . . . 74.319999999999993 109.494 176.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.561 ' HB3' ' CE2' ' A' ' 60' ' ' PHE . 31.7 mmmt -117.56 97.01 5.65 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 121.266 -0.174 . . . . 44.450000000000003 110.767 -176.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.58 ' HA ' ' O ' ' A' ' 49' ' ' LEU . 0.6 OUTLIER -79.09 110.31 14.22 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.872 0.323 . . . . 70.129999999999995 111.872 -179.855 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.561 ' CE2' ' HB3' ' A' ' 58' ' ' LYS . 82.6 m-85 -129.47 140.1 51.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.803 0.335 . . . . 65.5 110.369 176.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.7 p -124.01 13.32 9.09 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.234 0.54 . . . . 62.43 110.557 176.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -140.01 -177.74 5.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.849 -0.614 . . . . 72.209999999999994 110.738 -176.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 26.6 tp -127.91 32.6 4.91 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.746 -0.661 . . . . 33.549999999999997 109.972 -179.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -120.82 -42.66 2.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.171 0.51 . . . . 64.329999999999998 109.871 177.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.6 m -81.14 -43.05 19.96 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.641 -0.503 . . . . 55.43 109.641 174.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.544 HD12 ' HB2' ' A' ' 60' ' ' PHE . 5.9 tt -63.4 -41.52 98.76 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.447 -0.575 . . . . 62.409999999999997 109.447 177.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.6 ttt180 -60.0 -38.66 83.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.808 -0.633 . . . . 73.040000000000006 110.996 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.1 mtmm -64.71 -43.24 94.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.935 0.397 . . . . 70.349999999999994 110.673 175.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.473 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 64.1 t80 -63.44 -44.91 93.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.002 -0.545 . . . . 74.420000000000002 110.541 179.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.46 -25.58 66.79 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.855 -0.612 . . . . 64.530000000000001 111.95 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.1 t -80.71 -28.48 36.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.506 0.193 . . . . 73.409999999999997 111.21 -177.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -88.38 -19.32 26.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.209 0.528 . . . . 75.439999999999998 110.16 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -86.68 118.8 26.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.586 -0.733 . . . . 70.129999999999995 110.67 176.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.4 m -62.21 -40.33 95.75 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.004 0.43 . . . . 74.040000000000006 110.303 178.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.402 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 36.4 t -63.67 -49.11 74.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.679 -0.691 . . . . 73.420000000000002 110.787 -179.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 68.9 mtp -78.62 -14.99 59.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.295 -0.411 . . . . 70.109999999999999 111.183 -175.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.434 ' HB2' ' HE3' ' A' ' 77' ' ' LYS . 38.8 ttmt -64.3 -32.65 74.34 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.082 -0.508 . . . . 61.219999999999999 110.549 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.469 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 20.6 mm-40 -88.99 -4.26 58.48 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 121.639 0.733 . . . . 65.120000000000005 110.127 -178.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.612 ' HB3' HG21 ' B' ' 133' ' ' ILE . 49.0 mt -95.19 -52.96 3.97 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.835 -1.075 . . . . 73.030000000000001 109.583 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.682 ' HB3' HD13 ' A' ' 84' ' ' LEU . 4.1 mm? -84.8 -0.75 54.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.298 -0.864 . . . . 71.329999999999998 111.412 -176.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.469 ' HD3' ' HA ' ' A' ' 78' ' ' GLU . 64.7 pttt -56.74 -14.44 3.34 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 111.895 0.331 . . . . 62.149999999999999 111.895 176.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -63.4 -42.11 98.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.995 0.426 . . . . 75.230000000000004 110.862 176.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.411 HG13 HD12 ' A' ' 84' ' ' LEU . 7.5 p -111.52 -15.64 9.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.308 0.575 . . . . 64.120000000000005 111.009 -176.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.682 HD13 ' HB3' ' A' ' 80' ' ' LEU . 11.2 mp . . . . . 0 C--N 1.327 -0.412 0 N-CA-C 109.882 -0.414 . . . . 54.520000000000003 109.882 173.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 49.8 p90 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.769 0.319 . . . . 75.040000000000006 111.291 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 132' ' ' ASN . . . . . 0.487 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 50.4 t30 -59.2 -51.1 71.44 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 116.117 -0.492 . . . . 74.319999999999993 110.965 -178.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 133' ' ' ILE . . . . . 0.612 HG21 ' HB3' ' A' ' 79' ' ' LEU . 4.0 mp -67.88 -34.09 65.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.367 0.603 . . . . 72.530000000000001 110.563 -177.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.615 HD12 HD23 ' A' ' 49' ' ' LEU . 92.4 mt -73.47 -25.24 60.39 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.834 -0.621 . . . . 74.430000000000007 111.985 -175.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.601 ' HG3' ' N ' ' B' ' 136' ' ' GLU . 3.5 ptp180 -75.96 -40.43 53.96 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.54 -0.464 . . . . 74.349999999999994 109.82 175.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 136' ' ' GLU . . . . . 0.601 ' N ' ' HG3' ' B' ' 135' ' ' ARG . 10.4 mm-40 -58.7 -45.51 89.35 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.355 -0.839 . . . . 62.030000000000001 111.142 -179.183 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -95.81 5.83 50.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.783 -0.644 . . . . 63.140000000000001 111.323 -175.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 52.54 70.11 0.61 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.512 -0.767 . . . . 73.209999999999994 112.742 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -96.09 4.88 52.21 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.55 -0.75 . . . . 71.319999999999993 109.989 172.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 55.57 67.69 2.87 Favored Pre-proline 0 C--O 1.232 0.155 0 CA-C-N 115.023 -0.989 . . . . 73.239999999999995 111.238 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . 0.474 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 90.1 Cg_endo -88.2 165.31 6.93 Favored 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 122.528 2.152 . . . . 74.200000000000003 112.415 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? . . . . . 0 C--N 1.325 -0.459 0 CA-C-N 115.816 -0.629 . . . . 61.43 109.512 175.493 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.513 -0.476 0 N-CA-C 109.123 -0.695 . . . . 72.0 109.123 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.717 ' HB3' ' HD1' ' B' ' 151' ' ' PHE . 9.7 mp -71.65 90.61 1.05 Allowed 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.51 -0.768 . . . . 73.439999999999998 110.511 -178.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.651 ' HB3' ' HD3' ' A' ' 42' ' ' LYS . . . -87.7 68.29 9.43 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.621 -0.511 . . . . 63.310000000000002 109.621 174.654 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 151' ' ' PHE . . . . . 0.717 ' HD1' ' HB3' ' B' ' 149' ' ' LEU . 53.5 p90 -100.17 164.91 11.76 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.763 -0.653 . . . . 72.439999999999998 110.622 -176.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 5.3 tppp? -93.98 120.16 33.86 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.744 -0.662 . . . . 74.239999999999995 110.431 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 153' ' ' CYS . . . . . 0.477 ' SG ' ' HE2' ' B' ' 169' ' ' PHE . 43.5 t -125.77 108.77 11.82 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 116.448 -0.342 . . . . 61.539999999999999 110.528 177.316 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 2.0 t70 68.8 10.25 7.8 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.527 -0.76 . . . . 71.239999999999995 111.852 170.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 119.99 -19.94 9.35 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.314 -0.946 . . . . 75.239999999999995 112.824 179.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 156' ' ' GLU . . . . . 0.578 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 9.9 pt-20 -112.95 139.04 48.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.798 0.333 . . . . 75.340000000000003 110.284 178.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 44.0 mm -75.48 118.4 21.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.216 -0.447 . . . . 74.439999999999998 109.919 177.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 158' ' ' LYS . . . . . 0.578 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 31.7 mmmt -107.78 94.52 5.12 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.557 -0.292 . . . . 53.140000000000001 110.896 -175.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . 0.499 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.7 OUTLIER -74.44 117.21 15.99 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.954 0.406 . . . . 63.299999999999997 110.852 177.852 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 160' ' ' PHE . . . . . 0.526 ' CD2' HD13 ' B' ' 166' ' ' LEU . 41.4 m-85 -126.29 120.09 29.07 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.139 -0.482 . . . . 74.430000000000007 110.003 176.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 25.5 p -101.1 6.7 43.37 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.378 0.609 . . . . 73.329999999999998 109.844 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -150.29 162.22 40.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.322 -0.854 . . . . 65.030000000000001 110.137 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . 0.463 ' CD1' HD23 ' B' ' 166' ' ' LEU . 35.3 tp -96.28 -1.61 47.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.171 0.51 . . . . 74.109999999999999 111.151 -176.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 164' ' ' GLN . . . . . 0.471 ' O ' ' HG2' ' B' ' 168' ' ' LYS . 61.5 tt0 -81.42 -52.03 7.69 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.727 -0.472 . . . . 72.430000000000007 109.727 -178.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 3.2 m -67.25 -28.56 68.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.576 -0.738 . . . . 71.129999999999995 110.104 177.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . 0.526 HD13 ' CD2' ' B' ' 160' ' ' PHE . 43.5 tp -64.54 -39.47 93.82 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.16 -0.473 . . . . 73.010000000000005 110.258 178.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 75.2 ttt180 -65.04 -38.0 89.44 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.818 -0.438 . . . . 52.5 109.818 175.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 168' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' B' ' 164' ' ' GLN . 13.1 mmmm -56.51 -36.95 69.76 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.583 -0.735 . . . . 71.439999999999998 110.576 179.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 169' ' ' PHE . . . . . 0.528 ' O ' ' HG2' ' B' ' 173' ' ' LYS . 58.0 t80 -89.54 -47.73 7.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.463 -0.79 . . . . 73.439999999999998 110.945 -177.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.18 -33.18 74.05 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.664 0.616 . . . . 75.230000000000004 112.664 -176.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 6.5 t -67.54 -20.13 65.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.658 0.266 . . . . 34.520000000000003 111.441 -175.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 11.4 pt20 -105.49 -3.2 22.75 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.913 0.387 . . . . 75.420000000000002 110.534 179.034 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 173' ' ' LYS . . . . . 0.602 ' HB2' ' HB2' ' B' ' 176' ' ' MET . 29.8 mmmt -87.23 129.89 34.79 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.176 -0.466 . . . . 63.340000000000003 111.017 -178.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 3.5 m -56.66 -45.6 81.56 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.701 -0.681 . . . . 51.25 110.593 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 175' ' ' SER . . . . . 0.472 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 40.1 t -82.92 -49.17 9.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.018 -0.537 . . . . 73.120000000000005 111.703 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.602 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 66.1 mtp -70.75 -20.53 62.62 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.405 0.52 . . . . 72.030000000000001 112.405 -169.324 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 177' ' ' LYS . . . . . 0.498 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 88.8 tttt -62.11 -35.01 77.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.982 0.42 . . . . 74.519999999999996 110.641 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . 0.458 ' HA ' ' HD3' ' B' ' 181' ' ' LYS . 25.9 mm-40 -91.22 -8.76 47.56 Favored 'General case' 0 CA--C 1.511 -0.519 0 CA-C-O 121.619 0.723 . . . . 73.530000000000001 110.213 -176.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 179' ' ' LEU . . . . . 0.63 ' HB3' HG21 ' A' ' 33' ' ' ILE . 81.2 mt -89.9 -48.41 7.24 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.883 -1.053 . . . . 75.319999999999993 109.798 178.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 180' ' ' LEU . . . . . 0.651 ' HB3' HD13 ' B' ' 184' ' ' LEU . 4.2 mm? -86.17 -11.05 53.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.574 -0.739 . . . . 45.149999999999999 111.778 -176.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 181' ' ' LYS . . . . . 0.498 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 64.1 pttt -55.71 -18.3 7.83 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 111.625 0.232 . . . . 73.239999999999995 111.625 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -60.16 -46.85 88.27 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.821 0.343 . . . . 75.109999999999999 110.879 177.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 17.4 m -105.98 -14.46 9.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.128 -0.487 . . . . 45.229999999999997 111.375 -176.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 184' ' ' LEU . . . . . 0.651 HD13 ' HB3' ' B' ' 180' ' ' LEU . 8.2 mp . . . . . 0 C--N 1.324 -0.502 0 N-CA-C 109.739 -0.467 . . . . 64.019999999999996 109.739 176.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 81.0 t80 . . . . . 0 C--O 1.233 0.199 0 CA-C-O 120.905 0.383 . . . . 72.230000000000004 110.44 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.535 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 8.5 t30 -60.0 -51.7 68.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.629 -0.714 . . . . 75.219999999999999 110.698 178.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.482 HG22 ' OD1' ' A' ' 37' ' ' ASN . 50.1 mm -58.67 -53.59 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 116.39 -0.368 . . . . 74.239999999999995 110.718 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.465 ' HB2' ' HG3' ' A' ' 41' ' ' PRO . 88.7 mt -54.92 -32.55 61.25 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.148 -0.478 . . . . 73.340000000000003 111.759 -178.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 34.6 ttt180 -69.29 -41.28 77.0 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.854 -0.339 . . . . 74.420000000000002 110.361 176.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.535 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 30.2 mt-10 -68.69 -35.53 77.31 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.299 -0.41 . . . . 71.040000000000006 110.353 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.482 ' OD1' HG22 ' A' ' 33' ' ' ILE . 4.3 m120 -73.48 -13.62 61.09 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.122 -0.49 . . . . 64.340000000000003 109.806 177.152 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.4 t70 68.4 36.4 3.02 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.202 -0.908 . . . . 62.140000000000001 110.982 -178.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -75.67 -22.92 56.26 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.848 -0.615 . . . . 73.409999999999997 109.522 172.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 60.31 82.66 0.22 Allowed Pre-proline 0 N--CA 1.463 0.191 0 CA-C-N 114.806 -1.088 . . . . 70.400000000000006 111.046 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.709 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 60.1 Cg_endo -87.83 178.24 3.28 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.878 2.385 . . . . 73.340000000000003 111.929 177.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.448 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.459 0 CA-C-O 120.744 0.307 . . . . 73.120000000000005 110.989 -177.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 mptt . . . . . 0 N--CA 1.446 -0.646 0 N-CA-C 107.737 -1.209 . . . . 74.150000000000006 107.737 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 35.5 tp -79.96 68.42 6.07 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.497 -0.927 . . . . 61.43 108.497 173.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.584 ' HB2' HG22 ' A' ' 59' ' ' THR . . . -84.3 97.86 9.68 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 114.892 -1.049 . . . . 51.420000000000002 110.616 -176.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -111.39 165.99 11.49 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.974 -0.557 . . . . 52.100000000000001 110.376 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -90.28 124.9 35.27 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.139 -0.482 . . . . 71.540000000000006 110.275 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 14.7 t -138.54 116.88 11.94 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.777 -0.453 . . . . 62.210000000000001 109.777 178.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 64.63 16.22 10.2 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.714 0.635 . . . . 63.340000000000003 112.714 176.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 107.69 -17.5 36.0 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.068 -1.063 . . . . 65.329999999999998 112.412 177.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -111.78 146.66 37.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.777 0.323 . . . . 72.510000000000005 110.433 177.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 45.2 mm -79.84 126.9 39.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.165 -0.47 . . . . 74.109999999999999 110.14 178.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.483 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 27.6 mmmt -107.33 117.3 33.71 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.113 -0.329 . . . . 74.109999999999999 110.113 -179.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.584 HG22 ' HB2' ' A' ' 50' ' ' ALA . 2.6 p -93.91 123.88 37.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.166 -0.47 . . . . 74.329999999999998 111.044 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.461 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 71.9 m-85 -131.2 135.2 47.19 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.303 -0.408 . . . . 72.329999999999998 111.21 178.436 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.7 p -126.55 -5.02 6.51 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.826 -0.624 . . . . 64.239999999999995 109.983 175.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -125.32 130.57 52.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.724 -0.671 . . . . 75.329999999999998 110.181 178.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.1 mp -73.72 -33.23 64.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.443 . . . . 74.549999999999997 111.665 -175.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -60.43 -46.04 91.47 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.32 0.581 . . . . 74.25 110.474 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.0 t -61.54 -46.89 88.01 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.717 -0.674 . . . . 53.409999999999997 110.533 177.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 48.3 tp -65.95 -36.61 83.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.015 -0.538 . . . . 74.510000000000005 111.436 -177.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -56.78 -41.5 77.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.079 0.466 . . . . 63.229999999999997 110.541 176.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.465 ' HB2' ' HZ2' ' A' ' 68' ' ' LYS . 10.4 mtmp? -69.94 -30.86 68.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.891 -0.595 . . . . 74.109999999999999 111.08 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.542 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 46.9 t80 -74.49 -45.75 43.93 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.94 -0.573 . . . . 74.400000000000006 110.647 -178.198 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.41 -27.53 67.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.295 -0.412 . . . . 74.230000000000004 111.364 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 43.8 t -67.29 -42.18 84.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.302 -0.408 . . . . 63.310000000000002 111.371 -178.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.542 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 13.9 pt20 -73.96 -25.04 59.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.123 0.487 . . . . 74.540000000000006 110.618 -176.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.611 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 71.1 mmtt -70.57 139.31 51.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.928 -0.578 . . . . 74.299999999999997 110.374 178.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 29.2 m -75.39 -39.87 58.59 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.993 0.425 . . . . 54.299999999999997 110.576 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.429 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 15.7 m -78.06 -50.49 11.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.212 -0.449 . . . . 64.239999999999995 111.136 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.611 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 83.4 mtp -67.78 -19.86 65.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 75.400000000000006 111.792 -174.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.433 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 4.6 ttmp? -58.79 -35.3 72.59 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.023 0.439 . . . . 72.510000000000005 110.769 177.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.402 ' O ' ' HE3' ' A' ' 81' ' ' LYS . 35.6 mt-10 -100.74 2.02 40.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.135 0.493 . . . . 74.120000000000005 110.333 -176.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.446 ' HB3' ' CG2' ' B' ' 133' ' ' ILE . 68.0 mt -89.0 -48.61 7.31 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.859 -0.609 . . . . 61.409999999999997 110.094 177.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.678 ' HB3' HD13 ' A' ' 84' ' ' LEU . 3.5 mm? -90.94 7.54 39.67 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.708 -0.678 . . . . 53.140000000000001 111.218 -176.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.402 ' HE3' ' O ' ' A' ' 78' ' ' GLU . 21.3 pttp -56.19 -24.48 42.0 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.532 -0.758 . . . . 63.240000000000002 112.112 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -81.06 -9.11 59.87 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 111.997 0.369 . . . . 62.140000000000001 111.997 -175.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 12.6 m -127.0 -33.42 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 C-N-CA 120.983 -0.287 . . . . 72.340000000000003 111.422 178.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.678 HD13 ' HB3' ' A' ' 80' ' ' LEU . 10.3 mp . . . . . 0 C--N 1.325 -0.47 0 CA-C-N 116.629 -0.26 . . . . 74.140000000000001 110.402 178.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 131' ' ' PHE . . . . . 0.459 ' HE1' HH11 ' B' ' 135' ' ' ARG . 53.0 t80 . . . . . 0 N--CA 1.456 -0.125 0 N-CA-C 110.126 -0.324 . . . . 65.030000000000001 110.126 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 132' ' ' ASN . . . . . 0.613 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 6.4 t30 -57.92 -48.92 78.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.934 -0.576 . . . . 75.310000000000002 111.439 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 133' ' ' ILE . . . . . 0.446 ' CG2' ' HB3' ' A' ' 79' ' ' LEU . 2.4 mp -61.49 -47.52 93.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 CA-C-O 121.056 0.455 . . . . 72.329999999999998 110.691 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 87.1 mt -62.65 -31.32 72.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.945 -0.57 . . . . 64.219999999999999 110.543 178.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.459 HH11 ' HE1' ' B' ' 131' ' ' PHE . 24.9 ttt180 -73.02 -42.07 63.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.159 -0.473 . . . . 70.099999999999994 110.762 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 136' ' ' GLU . . . . . 0.613 ' HG3' ' O ' ' B' ' 132' ' ' ASN . 41.2 mt-10 -60.07 -47.08 87.34 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.204 0.526 . . . . 75.319999999999993 110.8 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -86.83 -0.71 56.93 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.693 -0.685 . . . . 74.409999999999997 111.083 -177.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 25.6 t0 57.92 67.91 0.9 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.382 -0.826 . . . . 71.530000000000001 111.894 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -96.53 -3.91 42.3 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.193 -0.912 . . . . 72.140000000000001 109.032 169.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 140' ' ' GLU . . . . . 0.407 ' HG2' ' HE3' ' B' ' 142' ' ' LYS . 37.6 tt0 55.69 78.07 0.4 Allowed Pre-proline 0 C--O 1.232 0.161 0 CA-C-N 114.566 -1.197 . . . . 72.549999999999997 111.275 -176.186 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . 0.432 ' C ' ' HD2' ' B' ' 142' ' ' LYS . 92.8 Cg_endo -82.99 163.41 15.65 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 123.076 2.517 . . . . 73.549999999999997 111.432 176.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 142' ' ' LYS . . . . . 0.432 ' HD2' ' C ' ' B' ' 141' ' ' PRO . 0.8 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-O 121.096 0.474 . . . . 71.439999999999998 111.321 -175.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.511 -0.546 0 N-CA-C 108.544 -0.91 . . . . 64.319999999999993 108.544 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 5.4 mp -73.92 86.83 1.78 Allowed 'General case' 0 C--N 1.317 -0.816 0 O-C-N 123.244 0.34 . . . . 75.109999999999999 110.104 177.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.578 ' HA ' ' O ' ' B' ' 158' ' ' LYS . . . -91.58 97.61 11.15 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.414 -0.812 . . . . 75.519999999999996 109.561 174.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 151' ' ' PHE . . . . . 0.709 ' HB3' ' HA ' ' A' ' 41' ' ' PRO . 47.4 p90 -132.55 166.55 21.83 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.087 -0.506 . . . . 62.509999999999998 110.817 -176.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -94.23 114.03 26.06 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.133 -0.485 . . . . 73.450000000000003 110.053 178.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 153' ' ' CYS . . . . . 0.461 ' HB2' ' HE1' ' B' ' 151' ' ' PHE . 49.0 t -126.32 120.8 30.83 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.095 -0.502 . . . . 73.120000000000005 110.166 178.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 19.6 t70 70.48 6.0 5.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.875 -0.602 . . . . 55.439999999999998 111.789 170.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 111.19 -6.4 28.75 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.502 -0.856 . . . . 63.140000000000001 112.316 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 156' ' ' GLU . . . . . 0.523 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 12.6 pt-20 -120.91 145.74 47.36 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 110.023 -0.362 . . . . 74.310000000000002 110.023 177.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 42.5 mm -77.92 126.94 38.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 109.723 -0.473 . . . . 71.200000000000003 109.723 176.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 158' ' ' LYS . . . . . 0.578 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 29.1 mmmt -109.78 137.52 47.46 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.872 -0.418 . . . . 74.25 109.872 179.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.01 104.6 8.99 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 123.194 0.309 . . . . 73.340000000000003 110.791 178.443 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 160' ' ' PHE . . . . . 0.606 ' CD2' HD13 ' B' ' 166' ' ' LEU . 94.9 m-85 -117.11 122.62 44.62 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.782 -0.367 . . . . 72.439999999999998 111.017 178.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 10.5 p -92.81 -5.78 50.34 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.161 -0.472 . . . . 52.409999999999997 110.557 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -132.81 157.1 45.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.872 -0.604 . . . . 72.219999999999999 109.884 177.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -89.18 -16.84 30.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.274 -0.421 . . . . 63.43 111.055 -177.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 164' ' ' GLN . . . . . 0.413 ' O ' ' HG3' ' B' ' 168' ' ' LYS . 6.2 tp60 -67.94 -51.45 47.57 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.418 -0.355 . . . . 74.409999999999997 111.12 -176.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . 0.951 ' HA ' ' HE3' ' B' ' 168' ' ' LYS . 11.5 t -69.6 -34.15 73.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.852 0.358 . . . . 71.0 110.38 -178.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . 0.606 HD13 ' CD2' ' B' ' 160' ' ' PHE . 33.5 tp -68.02 -35.13 77.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.975 0.416 . . . . 75.120000000000005 110.515 177.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -62.41 -37.07 84.37 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.11 -0.495 . . . . 71.430000000000007 110.464 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 168' ' ' LYS . . . . . 0.951 ' HE3' ' HA ' ' B' ' 165' ' ' SER . 9.2 mtmp? -67.19 -42.87 83.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.866 -0.606 . . . . 73.510000000000005 110.295 175.406 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 169' ' ' PHE . . . . . 0.441 ' HA ' ' HG2' ' B' ' 172' ' ' GLN . 63.9 t80 -64.89 -44.28 90.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.5 -0.773 . . . . 75.340000000000003 110.755 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -59.1 -31.36 68.85 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.156 -0.475 . . . . 62.43 110.93 177.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 26.3 t -72.34 -41.84 66.04 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.822 -0.626 . . . . 75.510000000000005 111.003 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . 0.441 ' HG2' ' HA ' ' B' ' 169' ' ' PHE . 19.2 pt20 -77.34 -22.64 51.54 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.952 0.406 . . . . 70.340000000000003 110.781 -176.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 173' ' ' LYS . . . . . 0.875 ' HE2' ' HA ' ' B' ' 173' ' ' LYS . 9.1 mmpt? -75.75 142.68 42.32 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.813 -0.44 . . . . 72.519999999999996 109.813 173.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 19.9 m -80.25 -42.46 23.14 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.749 -0.463 . . . . 62.399999999999999 109.749 177.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 175' ' ' SER . . . . . 0.53 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 47.4 m -69.49 -50.44 45.25 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.413 -0.358 . . . . 73.420000000000002 110.863 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.713 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 68.0 mtp -63.11 -27.66 69.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.201 -0.454 . . . . 74.349999999999994 112.064 -174.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? -62.36 -28.66 69.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.008 0.432 . . . . 74.0 110.691 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -100.63 1.04 40.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.281 0.562 . . . . 75.209999999999994 110.616 -176.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 179' ' ' LEU . . . . . 0.69 HD12 ' HA ' ' B' ' 176' ' ' MET . 77.2 mt -95.32 -55.67 2.97 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.419 -0.81 . . . . 63.130000000000003 109.832 178.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 180' ' ' LEU . . . . . 0.411 HD22 ' HB2' ' B' ' 179' ' ' LEU . 3.2 mm? -78.98 -6.65 56.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.378 -0.828 . . . . 65.5 111.881 -176.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -55.36 -19.22 8.29 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.436 0.532 . . . . 64.219999999999999 112.436 -176.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -60.23 -36.82 78.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.967 0.413 . . . . 63.130000000000003 111.125 179.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 13.2 m -123.06 -17.32 4.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.314 -0.403 . . . . 64.409999999999997 111.743 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 184' ' ' LEU . . . . . . . . . . . . . 10.2 mp . . . . . 0 C--N 1.327 -0.397 0 N-CA-C 109.723 -0.473 . . . . 60.399999999999999 109.723 177.993 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 12.8 p90 . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 114.461 1.282 . . . . 74.200000000000003 114.461 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.513 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 11.8 t30 -58.12 -45.09 87.89 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 122.317 0.247 . . . . 70.120000000000005 111.578 -175.359 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.472 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 44.4 mm -60.16 -41.16 85.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.033 0.444 . . . . 65.230000000000004 111.399 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.568 HD12 HD23 ' B' ' 149' ' ' LEU . 88.3 mt -68.37 -27.57 66.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.189 -0.46 . . . . 75.319999999999993 110.691 -178.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -74.07 -34.67 64.11 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.123 -0.49 . . . . 71.140000000000001 109.95 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.513 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 5.8 mm-40 -71.52 -27.65 63.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.127 0.489 . . . . 73.049999999999997 110.736 178.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -101.55 4.37 40.97 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.15 -0.477 . . . . 73.430000000000007 111.04 -178.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 60.18 43.99 13.35 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.603 -0.726 . . . . 75.129999999999995 112.361 174.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.546 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 11.8 m-85 -77.74 -12.81 60.01 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.122 0.487 . . . . 74.209999999999994 109.995 171.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 58.9 73.85 0.66 Allowed Pre-proline 0 C--O 1.236 0.345 0 CA-C-N 114.99 -1.005 . . . . 71.409999999999997 110.859 -174.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -81.44 148.62 16.43 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.513 2.142 . . . . 53.439999999999998 111.304 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.3 mptt . . . . . 0 C--N 1.323 -0.555 0 CA-C-O 121.133 0.492 . . . . 72.340000000000003 110.856 -177.954 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.575 0 N-CA-C 109.762 -0.458 . . . . 71.329999999999998 109.762 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.714 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.5 mp -67.92 88.42 0.26 Allowed 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.507 -0.769 . . . . 74.349999999999994 110.384 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.698 ' H ' ' HB2' ' B' ' 142' ' ' LYS . . . -85.17 58.05 4.81 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.851 -0.426 . . . . 44.210000000000001 109.851 176.113 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.714 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 51.5 p90 -86.02 162.55 18.43 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.982 -0.554 . . . . 61.439999999999998 110.731 -177.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.402 ' HD3' HD13 ' A' ' 57' ' ' ILE . 14.1 tptm -98.12 118.91 35.79 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.324 -0.853 . . . . 64.299999999999997 110.109 -176.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 46.5 t -120.18 99.89 6.86 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.917 0.389 . . . . 74.329999999999998 110.691 178.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 66.84 6.37 4.56 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.413 -0.812 . . . . 73.430000000000007 112.968 171.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 133.26 -27.58 3.4 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.403 -0.903 . . . . 71.239999999999995 112.636 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -107.86 139.33 42.62 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.253 0.549 . . . . 61.43 110.868 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.402 HD13 ' HD3' ' A' ' 52' ' ' LYS . 45.9 mm -77.37 123.41 33.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.473 -0.785 . . . . 73.120000000000005 109.939 178.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.42 ' HE2' ' CE1' ' A' ' 69' ' ' PHE . 30.9 mmmt -107.81 90.65 3.36 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 121.084 -0.246 . . . . 74.540000000000006 110.722 -177.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.58 110.09 7.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.33 -0.395 . . . . 61.210000000000001 111.572 -178.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -120.92 123.41 42.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.345 -0.388 . . . . 75.099999999999994 110.447 174.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 7.0 t -100.71 -4.31 28.48 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.396 0.617 . . . . 71.200000000000003 109.357 179.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -142.84 159.4 42.3 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.533 -0.758 . . . . 73.109999999999999 110.007 177.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 46.6 tp -87.14 -20.58 26.83 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.272 -0.422 . . . . 72.340000000000003 110.452 -175.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -61.6 -51.33 68.97 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.901 -0.591 . . . . 74.319999999999993 110.484 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.7 t -66.27 -36.82 83.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.818 -0.628 . . . . 63.210000000000001 110.429 178.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.469 HD23 ' O ' ' A' ' 66' ' ' LEU . 6.2 tt -66.1 -37.77 86.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.724 -0.671 . . . . 73.340000000000003 110.428 -178.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.851 ' HG3' HD21 ' A' ' 84' ' ' LEU . 55.3 ttp180 -57.65 -38.71 75.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 73.030000000000001 110.967 -179.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -63.39 -38.36 90.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 75.439999999999998 110.979 177.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.42 ' CE1' ' HE2' ' A' ' 58' ' ' LYS . 54.0 t80 -68.41 -47.86 66.17 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.082 -0.508 . . . . 73.239999999999995 110.554 -178.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.442 ' HA ' ' HB2' ' A' ' 73' ' ' LYS . . . -62.56 -28.74 70.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.828 0.347 . . . . 54.100000000000001 111.349 177.483 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 34.6 t -67.43 -31.15 71.14 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.143 -0.48 . . . . 62.329999999999998 111.084 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -100.76 6.71 43.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.353 0.597 . . . . 73.0 109.98 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.442 ' HB2' ' HA ' ' A' ' 70' ' ' ALA . 21.3 mmmt -112.54 102.9 10.96 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.369 -0.832 . . . . 63.43 110.584 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.484 ' O ' ' HB3' ' A' ' 77' ' ' LYS . 14.8 p -54.51 -38.74 66.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.331 -0.395 . . . . 62.409999999999997 111.591 -178.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.536 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 47.3 t -66.37 -49.61 66.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.796 0.331 . . . . 74.0 110.919 178.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 80.9 mtp -71.76 -22.22 61.63 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.931 0.396 . . . . 73.430000000000007 110.728 -175.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.484 ' HB3' ' O ' ' A' ' 74' ' ' SER . 29.3 tttp -53.82 -34.64 59.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.661 -0.699 . . . . 75.019999999999996 110.707 172.376 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.521 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 32.8 mm-40 -101.7 3.82 40.05 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.75 -0.659 . . . . 74.319999999999993 110.419 -175.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.582 HD22 ' ND2' ' B' ' 137' ' ' ASN . 53.2 mt -101.06 -47.26 4.81 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.17 -0.923 . . . . 71.540000000000006 109.168 175.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.0 mt -91.86 2.25 56.64 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.716 -0.675 . . . . 45.43 111.024 -175.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.521 ' HD2' ' HA ' ' A' ' 78' ' ' GLU . 20.8 ptmt -54.41 -20.72 8.0 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.146 -0.479 . . . . 61.219999999999999 112.278 178.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -82.27 -37.62 25.6 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.05 0.453 . . . . 65.310000000000002 110.945 178.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 24.3 t -79.75 -40.2 20.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.066 -0.515 . . . . 71.540000000000006 110.308 -178.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.851 HD21 ' HG3' ' A' ' 67' ' ' ARG . 10.6 mp . . . . . 0 C--N 1.324 -0.509 0 CA-C-N 115.843 -0.617 . . . . 62.399999999999999 110.5 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 131' ' ' PHE . . . . . 0.612 ' HB3' HD21 ' A' ' 49' ' ' LEU . 26.0 p90 . . . . . 0 N--CA 1.481 1.116 0 N-CA-C 113.92 1.081 . . . . 74.010000000000005 113.92 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 132' ' ' ASN . . . . . 0.4 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 44.7 t30 -56.58 -55.12 37.88 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.85 0.357 . . . . 73.510000000000005 111.324 -177.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 133' ' ' ILE . . . . . 0.527 HG21 ' HB3' ' A' ' 79' ' ' LEU . 49.1 mm -58.11 -41.42 80.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.002 -0.544 . . . . 71.25 111.247 -178.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.409 HD12 HD23 ' A' ' 49' ' ' LEU . 84.5 mt -63.65 -36.97 85.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.02 -0.536 . . . . 74.25 110.906 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -72.42 -38.89 68.27 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.653 -0.249 . . . . 60.140000000000001 110.488 179.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 136' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 28.7 mm-40 -64.31 -43.14 95.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.241 -0.436 . . . . 42.409999999999997 111.282 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 137' ' ' ASN . . . . . 0.582 ' ND2' HD22 ' A' ' 79' ' ' LEU . 92.1 m-20 -92.21 7.61 41.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.161 -0.472 . . . . 73.439999999999998 111.227 -178.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 55.63 57.91 4.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.408 -0.815 . . . . 72.5 112.96 174.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -82.97 -10.1 58.96 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.595 -0.891 . . . . 70.430000000000007 108.595 165.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 59.6 71.8 0.87 Allowed Pre-proline 0 C--O 1.234 0.274 0 CA-C-N 114.204 -1.362 . . . . 75.420000000000002 110.828 -176.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . 0.5 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 89.1 Cg_endo -79.95 144.94 17.34 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.508 2.139 . . . . 75.109999999999999 111.591 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 142' ' ' LYS . . . . . 0.698 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 13.9 mptt . . . . . 0 C--N 1.32 -0.684 0 CA-C-O 121.036 0.446 . . . . 70.540000000000006 110.448 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . 0.453 ' HB3' ' HB2' ' B' ' 161' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.49 0 N-CA-C 109.758 -0.46 . . . . 74.209999999999994 109.758 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.767 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.5 mp -74.14 86.67 1.89 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.597 -0.729 . . . . 74.010000000000005 110.359 -178.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.501 ' HB2' HG23 ' B' ' 159' ' ' THR . . . -85.19 62.34 7.44 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.014 -0.539 . . . . 75.120000000000005 109.649 174.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 151' ' ' PHE . . . . . 0.767 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 49.6 p90 -92.09 164.01 13.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.015 -0.539 . . . . 74.209999999999994 110.737 -175.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -92.08 117.38 29.79 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.704 -0.68 . . . . 75.019999999999996 110.794 -178.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 153' ' ' CYS . . . . . 0.617 ' HB3' ' CG ' ' B' ' 158' ' ' LYS . 50.8 t -131.56 116.96 18.1 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.541 -0.3 . . . . 54.420000000000002 110.889 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 67.71 11.53 8.41 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.674 -0.694 . . . . 71.530000000000001 112.408 175.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 110.06 -16.24 30.37 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.407 -0.901 . . . . 65.150000000000006 112.572 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 156' ' ' GLU . . . . . 0.479 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 9.6 pt-20 -116.42 143.98 44.88 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.841 0.353 . . . . 73.239999999999995 110.41 177.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 43.5 mm -70.59 118.69 15.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.209 -0.451 . . . . 75.310000000000002 110.045 177.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 158' ' ' LYS . . . . . 0.617 ' CG ' ' HB3' ' B' ' 153' ' ' CYS . 31.5 mmmt -104.08 88.31 2.98 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.945 -0.391 . . . . 70.329999999999998 109.945 -179.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . 0.501 HG23 ' HB2' ' B' ' 150' ' ' ALA . 0.2 OUTLIER -75.63 110.19 9.83 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.892 -0.595 . . . . 70.430000000000007 111.461 -175.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -121.8 124.41 44.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.521 -0.308 . . . . 75.129999999999995 111.009 178.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . 0.453 ' HB2' ' HB3' ' B' ' 148' ' ' LYS . 9.5 t -106.38 0.61 25.05 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.038 -0.727 . . . . 61.329999999999998 109.038 176.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -121.28 124.18 44.0 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.499 -0.773 . . . . 50.240000000000002 110.339 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 55.2 tp -68.56 -32.77 72.93 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.149 -0.686 . . . . 63.130000000000003 109.149 175.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -59.62 -50.32 74.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.333 -0.849 . . . . 71.430000000000007 110.922 176.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 32.3 t -67.54 -39.6 85.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.203 -0.453 . . . . 72.200000000000003 110.432 -178.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . 0.425 HD23 ' O ' ' B' ' 166' ' ' LEU . 4.1 tt -65.71 -36.46 83.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.07 -0.514 . . . . 35.539999999999999 110.294 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . 0.559 ' HG3' HD11 ' B' ' 184' ' ' LEU . 43.3 ttp180 -62.78 -34.88 78.17 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.249 0.547 . . . . 72.010000000000005 110.062 179.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -66.66 -38.56 87.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.818 -0.628 . . . . 45.299999999999997 110.458 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 169' ' ' PHE . . . . . 0.518 ' CZ ' ' HE3' ' B' ' 173' ' ' LYS . 69.8 t80 -67.05 -46.38 74.54 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.424 -0.807 . . . . 72.439999999999998 110.661 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.61 -26.67 68.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.504 -0.316 . . . . 53.32 111.428 179.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 8.6 t -64.98 -27.84 69.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.241 -0.436 . . . . 63.399999999999999 110.59 -178.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -106.08 15.98 25.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.248 0.547 . . . . 74.439999999999998 110.33 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 173' ' ' LYS . . . . . 0.518 ' HE3' ' CZ ' ' B' ' 169' ' ' PHE . 64.1 mmtt -117.3 115.63 25.64 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.612 -0.722 . . . . 74.439999999999998 110.427 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.2 p -57.7 -41.44 81.68 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.909 0.385 . . . . 72.329999999999998 111.869 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 175' ' ' SER . . . . . 0.526 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 45.7 t -82.04 -47.08 13.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.827 0.346 . . . . 72.109999999999999 110.325 -178.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.462 ' HB2' ' CB ' ' B' ' 173' ' ' LYS . 70.9 mtp -67.47 -25.85 66.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.454 -0.339 . . . . 64.409999999999997 111.866 -174.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 177' ' ' LYS . . . . . 0.49 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 26.0 ttpp -62.11 -35.09 77.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.842 0.353 . . . . 54.240000000000002 110.558 176.152 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . 0.602 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 18.8 mm-40 -89.71 -12.11 40.39 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-O 121.661 0.743 . . . . 74.219999999999999 109.88 -175.134 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 179' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' B' ' 175' ' ' SER . 74.7 mt -82.08 -47.82 12.13 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.767 -1.106 . . . . 63.329999999999998 109.173 175.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 7.5 mt -94.27 0.92 55.95 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.764 -0.653 . . . . 72.420000000000002 111.451 -173.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 181' ' ' LYS . . . . . 0.602 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 17.8 ptmt -58.6 -8.44 1.26 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 112.083 0.401 . . . . 74.299999999999997 112.083 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -68.29 -37.01 80.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.021 0.438 . . . . 74.099999999999994 110.411 175.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 183' ' ' VAL . . . . . 0.462 HG23 HD12 ' B' ' 184' ' ' LEU . 31.2 m -104.47 -15.29 8.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.15 -0.477 . . . . 62.409999999999997 111.198 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 184' ' ' LEU . . . . . 0.559 HD11 ' HG3' ' B' ' 167' ' ' ARG . 11.1 mp . . . . . 0 C--N 1.325 -0.488 0 N-CA-C 109.676 -0.49 . . . . 54.350000000000001 109.676 175.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.583 ' HB2' ' HB3' ' A' ' 41' ' ' PRO . 11.6 p90 . . . . . 0 CA--C 1.523 -0.081 0 CA-C-O 121.319 0.581 . . . . 52.329999999999998 109.536 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.526 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 9.4 t30 -64.87 -54.61 28.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.22 -0.9 . . . . 74.319999999999993 111.548 -170.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.486 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 47.7 mm -57.32 -41.67 78.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 CA-C-O 121.03 0.443 . . . . 72.129999999999995 111.377 -176.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.849 HD12 HD21 ' B' ' 149' ' ' LEU . 80.0 mt -66.59 -37.38 84.79 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.0 -0.545 . . . . 75.319999999999993 110.646 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 35' ' ' ARG . 20.5 ttt85 -64.47 -40.56 95.93 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.202 -0.454 . . . . 74.120000000000005 110.687 178.233 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 4.6 mm-40 -72.0 -27.59 62.84 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.991 -0.549 . . . . 74.420000000000002 111.671 -177.019 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -100.9 4.29 42.54 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.877 0.37 . . . . 70.109999999999999 111.034 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 22.2 t70 61.66 69.68 0.63 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.406 -0.815 . . . . 61.340000000000003 111.487 177.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.566 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 7.6 m-85 -107.22 -7.39 16.8 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.231 -0.895 . . . . 65.049999999999997 109.882 172.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 68.51 93.73 0.05 OUTLIER Pre-proline 0 C--O 1.232 0.173 0 CA-C-N 114.81 -1.086 . . . . 64.049999999999997 111.128 -177.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.583 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 67.5 Cg_endo -75.29 166.27 29.19 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.774 2.316 . . . . 75.420000000000002 111.444 175.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.743 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 13.9 tptt . . . . . 0 C--N 1.327 -0.399 0 C-N-CA 119.596 -0.842 . . . . 75.400000000000006 112.63 -177.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.428 ' O ' ' HB3' ' B' ' 142' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.509 -0.622 0 N-CA-C 109.02 -0.733 . . . . 75.519999999999996 109.02 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.832 HD21 HD12 ' B' ' 134' ' ' LEU . 41.2 tp -75.25 87.96 2.51 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.282 0.563 . . . . 52.409999999999997 110.384 -175.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 1.003 ' HB2' HG23 ' A' ' 59' ' ' THR . . . -97.14 96.36 8.39 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.03 -0.986 . . . . 65.219999999999999 110.216 177.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.421 ' HB2' ' HB3' ' B' ' 139' ' ' PHE . 53.7 p90 -111.81 167.61 10.23 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.071 -0.513 . . . . 70.030000000000001 110.289 -179.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -97.03 122.91 40.54 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.304 -0.407 . . . . 61.219999999999999 111.031 -178.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 46.0 t -132.95 107.5 8.32 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.164 -0.471 . . . . 72.219999999999999 110.0 176.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 68.07 23.61 8.03 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.284 0.476 . . . . 74.450000000000003 112.284 174.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 104.25 -19.03 44.08 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.277 -0.963 . . . . 62.439999999999998 112.428 177.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.468 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 9.7 pt-20 -108.4 138.96 43.83 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.183 0.515 . . . . 74.25 110.723 179.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.0 mm -77.31 124.22 35.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.738 -0.665 . . . . 74.129999999999995 109.6 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.468 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 26.2 mmmt -103.78 90.57 3.68 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.816 -0.438 . . . . 63.229999999999997 109.816 -179.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 1.003 HG23 ' HB2' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -81.39 105.64 12.73 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.927 -0.579 . . . . 71.099999999999994 111.309 -177.784 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -110.48 133.11 53.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.304 -0.407 . . . . 72.099999999999994 110.805 178.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.3 p -79.63 -18.69 50.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.946 -0.57 . . . . 64.209999999999994 111.443 -178.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -152.95 172.71 16.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.167 -0.47 . . . . 53.340000000000003 110.588 -178.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -84.88 -12.59 53.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.111 -0.495 . . . . 75.530000000000001 111.612 -176.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -74.97 -42.66 57.16 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.975 -0.75 . . . . 71.439999999999998 108.975 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.584 ' HA ' ' HE2' ' A' ' 68' ' ' LYS . 15.0 m -65.99 -37.07 85.02 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.407 -0.815 . . . . 75.140000000000001 110.137 177.159 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.525 HD11 HD11 ' B' ' 134' ' ' LEU . 6.0 tt -68.19 -38.3 81.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.82 -0.627 . . . . 74.209999999999994 109.784 178.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.667 ' HG3' HD22 ' A' ' 84' ' ' LEU . 54.8 ttp180 -51.41 -38.76 55.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.076 -0.965 . . . . 75.239999999999995 111.02 -179.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.584 ' HE2' ' HA ' ' A' ' 65' ' ' SER . 49.8 mtmt -64.94 -51.36 62.27 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.72 -0.673 . . . . 72.099999999999994 110.785 178.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -64.52 -42.11 95.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.353 -0.839 . . . . 62.25 111.36 -175.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.19 -33.1 75.2 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.207 -0.451 . . . . 73.209999999999994 111.234 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.1 m -74.38 -22.73 59.05 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.673 0.273 . . . . 74.129999999999995 111.374 -178.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -98.83 5.98 47.12 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.283 0.563 . . . . 53.310000000000002 110.459 177.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.7 mmmt -108.0 109.41 20.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.421 -0.809 . . . . 71.319999999999993 109.334 172.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.0 p -51.18 -35.98 38.89 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.469 0.544 . . . . 75.349999999999994 112.469 -174.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 41.2 t -78.13 -56.35 4.54 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.674 0.274 . . . . 65.030000000000001 110.807 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 78.0 mtp -64.24 -21.38 66.56 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.871 0.367 . . . . 64.409999999999997 111.513 -174.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.406 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 88.5 tttt -59.6 -25.64 64.79 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.845 -0.616 . . . . 74.310000000000002 111.106 179.253 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.518 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 32.4 mt-10 -104.93 5.49 32.85 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.233 0.54 . . . . 74.019999999999996 110.629 -178.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.538 ' HB3' HG21 ' B' ' 133' ' ' ILE . 10.6 mp -91.55 -52.09 4.94 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.42 -0.809 . . . . 63.200000000000003 109.447 173.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -81.2 -10.48 59.61 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.511 -0.768 . . . . 61.340000000000003 111.256 -176.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.518 ' HD3' ' HA ' ' A' ' 78' ' ' GLU . 64.8 pttt -59.83 -18.46 44.09 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 111.975 0.361 . . . . 63.310000000000002 111.975 -176.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -66.2 -36.51 83.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.968 0.413 . . . . 70.329999999999998 110.636 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 29.2 m -110.12 4.34 8.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.239 0.543 . . . . 74.329999999999998 110.45 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.667 HD22 ' HG3' ' A' ' 67' ' ' ARG . 45.0 tp . . . . . 0 C--N 1.324 -0.518 0 CA-C-N 115.599 -0.728 . . . . 74.099999999999994 110.661 -175.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 10.7 p90 . . . . . 0 CA--C 1.534 0.339 0 N-CA-C 111.93 0.345 . . . . 63.219999999999999 111.93 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 132' ' ' ASN . . . . . 0.465 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 64.4 t30 -57.97 -53.73 54.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.028 0.442 . . . . 71.329999999999998 110.617 -176.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 133' ' ' ILE . . . . . 0.538 HG21 ' HB3' ' A' ' 79' ' ' LEU . 49.1 mm -60.55 -43.71 95.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.787 -0.642 . . . . 73.040000000000006 111.549 -177.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.832 HD12 HD21 ' A' ' 49' ' ' LEU . 80.8 mt -67.46 -24.3 65.6 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.263 -0.426 . . . . 75.049999999999997 111.266 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -73.63 -46.05 49.19 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.122 0.486 . . . . 61.299999999999997 110.062 177.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 136' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 26.7 mm-40 -65.45 -33.24 75.49 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.472 -0.785 . . . . 75.340000000000003 110.97 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -99.04 5.56 47.02 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.546 -0.297 . . . . 61.43 111.432 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 52.37 70.59 0.55 Allowed 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.55 0.944 . . . . 64.340000000000003 113.55 175.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 139' ' ' PHE . . . . . 0.447 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 28.1 m-85 -99.77 0.99 42.78 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.832 -0.622 . . . . 74.430000000000007 109.645 169.133 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 61.75 89.94 0.1 OUTLIER Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 114.842 -1.072 . . . . 74.129999999999995 111.472 -173.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . 0.417 ' HA ' ' CD1' ' A' ' 49' ' ' LEU . 22.4 Cg_exo -65.94 143.54 73.2 Favored 'Trans proline' 0 N--CA 1.463 -0.318 0 C-N-CA 122.632 2.221 . . . . 74.019999999999996 110.695 172.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 142' ' ' LYS . . . . . 0.708 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 17.2 tptt . . . . . 0 C--N 1.327 -0.406 0 C-N-CA 119.658 -0.817 . . . . 73.109999999999999 111.652 -176.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . 0.59 ' HB3' ' HA ' ' B' ' 161' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.499 0 N-CA-C 109.553 -0.536 . . . . 74.219999999999999 109.553 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.849 HD21 HD12 ' A' ' 34' ' ' LEU . 39.1 tp -76.03 98.18 4.24 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.243 -0.89 . . . . 73.430000000000007 110.743 -173.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.976 ' HB2' HG23 ' B' ' 159' ' ' THR . . . -102.25 102.45 12.85 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.112 -0.949 . . . . 62.210000000000001 110.213 177.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 151' ' ' PHE . . . . . 0.58 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 37.6 p90 -125.89 166.65 16.5 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.84 -0.618 . . . . 60.240000000000002 110.13 -178.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -87.04 115.52 24.48 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.183 0.516 . . . . 74.25 110.802 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 153' ' ' CYS . . . . . 0.493 ' HB3' ' CG ' ' B' ' 158' ' ' LYS . 45.7 t -134.13 122.86 23.48 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.845 -0.616 . . . . 75.329999999999998 110.183 177.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.1 t70 70.23 8.63 6.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.233 -0.894 . . . . 72.299999999999997 111.956 174.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 111.53 -9.11 28.32 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.267 -0.968 . . . . 22.239999999999998 112.959 176.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -124.24 160.99 26.73 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.673 -0.491 . . . . 75.230000000000004 109.673 175.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 47.2 mm -80.12 119.53 29.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.737 -0.468 . . . . 71.099999999999994 109.737 175.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 158' ' ' LYS . . . . . 0.493 ' CG ' ' HB3' ' B' ' 153' ' ' CYS . 30.7 mmmt -98.39 98.32 9.56 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.876 -0.416 . . . . 63.409999999999997 109.876 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . 0.976 HG23 ' HB2' ' B' ' 150' ' ' ALA . 0.2 OUTLIER -84.06 102.78 12.76 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.268 -0.424 . . . . 71.530000000000001 110.997 179.83 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -99.6 114.59 27.72 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.348 -0.387 . . . . 71.409999999999997 110.85 178.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . 0.59 ' HA ' ' HB3' ' B' ' 148' ' ' LYS . 5.3 p -76.69 -33.46 58.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.976 -0.557 . . . . 64.310000000000002 110.167 176.098 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -116.37 149.5 39.25 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.604 -0.726 . . . . 72.409999999999997 109.684 176.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -90.19 -9.21 48.96 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.13 0.49 . . . . 74.400000000000006 110.327 -178.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -63.93 -49.6 71.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.629 -0.714 . . . . 75.310000000000002 110.183 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 10.7 m -66.43 -36.1 81.96 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.88 -0.6 . . . . 72.010000000000005 110.753 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 3.9 tt -60.29 -43.36 96.34 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.069 0.461 . . . . 61.340000000000003 110.131 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 15.9 ttp180 -60.83 -23.38 65.05 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.373 -0.83 . . . . 64.420000000000002 110.899 -175.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -88.32 -43.24 11.68 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.184 0.516 . . . . 62.520000000000003 110.207 176.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 169' ' ' PHE . . . . . 0.43 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 59.1 t80 -62.81 -39.3 93.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.39 -0.823 . . . . 75.420000000000002 111.051 -178.032 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -67.1 -29.09 68.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.059 -0.519 . . . . 53.409999999999997 111.532 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 22.9 t -75.6 -32.61 60.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.758 0.314 . . . . 73.299999999999997 111.112 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -82.79 -16.09 49.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.907 0.385 . . . . 71.510000000000005 110.651 179.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 173' ' ' LYS . . . . . 0.409 ' HA ' ' HD2' ' B' ' 173' ' ' LYS . 25.7 mmmt -81.31 117.92 22.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.225 -0.443 . . . . 74.439999999999998 110.281 174.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.1 p -54.16 -44.84 71.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.129 -0.487 . . . . 73.319999999999993 111.89 -178.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 4.5 p -71.45 -50.73 28.82 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.957 -0.565 . . . . 74.439999999999998 111.658 -178.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 82.3 mtp -73.61 -16.77 61.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.321 -0.4 . . . . 51.399999999999999 112.077 -172.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 177' ' ' LYS . . . . . 0.441 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 47.4 tttp -62.8 -26.11 68.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.307 -0.406 . . . . 73.409999999999997 110.91 -178.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . 0.402 ' HA ' ' HD3' ' B' ' 181' ' ' LYS . 5.1 mm-40 -94.33 -8.19 39.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.434 0.635 . . . . 72.239999999999995 109.917 -176.295 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 179' ' ' LEU . . . . . 0.486 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 11.2 mp -87.64 -54.88 4.04 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.029 -0.987 . . . . 74.040000000000006 109.844 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -81.03 -14.25 58.06 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.207 -0.906 . . . . 73.040000000000006 112.19 -173.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 181' ' ' LYS . . . . . 0.446 ' HA ' ' O ' ' B' ' 184' ' ' LEU . 64.9 pttt -57.46 -19.2 22.63 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.347 0.499 . . . . 71.109999999999999 112.347 -176.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -58.51 -36.39 73.73 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.061 0.458 . . . . 65.109999999999999 110.783 177.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 26.9 m -119.32 11.77 6.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.223 0.535 . . . . 74.049999999999997 110.367 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 184' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' B' ' 181' ' ' LYS . 55.6 tp . . . . . 0 C--N 1.323 -0.548 0 CA-C-N 115.736 -0.666 . . . . 73.099999999999994 110.534 -175.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.406 ' HB3' HD11 ' B' ' 149' ' ' LEU . 22.1 p90 . . . . . 0 CA--C 1.534 0.347 0 CA-C-O 120.991 0.424 . . . . 74.049999999999997 111.185 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.525 ' O ' ' HB3' ' A' ' 35' ' ' ARG . 48.6 t30 -60.17 -51.13 70.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.703 -0.68 . . . . 70.549999999999997 111.368 -174.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.502 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 48.5 mm -58.78 -47.54 88.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.167 -0.469 . . . . 72.109999999999999 111.469 -177.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.1 mt -60.3 -35.45 75.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.007 0.432 . . . . 63.329999999999998 110.746 177.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.525 ' HB3' ' O ' ' A' ' 32' ' ' ASN . 23.4 ttt-85 -62.38 -49.94 73.53 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.637 -0.711 . . . . 73.340000000000003 110.374 176.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 15.9 mm-40 -66.67 -31.95 72.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.672 -0.695 . . . . 65.340000000000003 111.898 -176.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -98.04 3.62 49.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.771 0.319 . . . . 73.219999999999999 111.159 -177.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 38.2 t70 57.73 62.06 2.22 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.592 0.711 . . . . 73.109999999999999 111.929 175.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.417 ' HB3' ' HB2' ' B' ' 151' ' ' PHE . 23.4 m-85 -89.3 -3.33 58.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.816 -0.629 . . . . 75.510000000000005 110.534 170.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 61.06 67.28 1.47 Allowed Pre-proline 0 CA--C 1.534 0.333 0 CA-C-N 115.624 -0.716 . . . . 75.019999999999996 110.029 -173.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -80.65 168.88 17.4 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.535 2.157 . . . . 65.420000000000002 111.583 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.508 ' HE2' ' HB3' ' B' ' 150' ' ' ALA . 10.7 mptt . . . . . 0 C--N 1.321 -0.673 0 C-N-CA 120.431 -0.508 . . . . 74.239999999999995 110.866 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.575 0 CA-C-O 121.042 0.448 . . . . 73.129999999999995 110.073 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.668 ' HB3' ' HD1' ' A' ' 51' ' ' PHE . 10.6 mp -76.09 88.51 3.01 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.719 -0.673 . . . . 71.420000000000002 109.868 178.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.08 59.71 4.59 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.156 0.503 . . . . 65.099999999999994 109.683 175.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.668 ' HD1' ' HB3' ' A' ' 49' ' ' LEU . 52.5 p90 -90.5 166.96 12.94 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.993 -0.548 . . . . 64.329999999999998 110.203 -175.364 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -100.41 123.31 44.47 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 120.981 0.419 . . . . 73.439999999999998 110.697 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.645 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 52.9 t -125.77 112.32 15.92 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.726 -0.67 . . . . 71.140000000000001 109.577 176.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 68.04 21.27 8.84 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.862 -0.608 . . . . 72.219999999999999 111.39 177.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 107.8 -32.75 6.82 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.75 -0.738 . . . . 63.420000000000002 112.433 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.4 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 10.6 pt-20 -98.37 143.87 28.37 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.073 0.463 . . . . 64.120000000000005 110.8 -176.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.2 mm -74.5 118.32 20.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.027 -0.533 . . . . 74.310000000000002 110.289 178.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.412 ' HG2' ' HB3' ' A' ' 53' ' ' CYS . 29.9 mmmt -106.17 107.72 18.87 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.198 -0.667 . . . . 71.400000000000006 109.198 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.535 ' HA ' ' O ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -98.51 112.92 24.8 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.061 -0.518 . . . . 74.329999999999998 111.919 -171.178 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -128.56 139.18 52.43 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.246 -0.433 . . . . 73.340000000000003 110.2 177.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 65.4 p -104.21 -16.69 15.13 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.121 0.486 . . . . 62.210000000000001 110.1 176.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -127.16 150.14 49.64 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.813 -0.63 . . . . 71.219999999999999 111.237 -176.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.0 mt -67.92 -23.39 65.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.712 -0.677 . . . . 75.430000000000007 110.477 177.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -60.63 -48.8 80.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.093 0.473 . . . . 74.540000000000006 110.55 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 9.9 m -68.11 -41.92 81.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.892 -0.594 . . . . 61.130000000000003 110.705 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.4 tp -65.28 -36.11 83.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.941 -0.572 . . . . 74.150000000000006 110.648 -178.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.745 ' HG2' HD11 ' A' ' 84' ' ' LEU . 62.8 mtt180 -53.77 -49.51 68.08 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.222 -0.445 . . . . 73.150000000000006 111.806 178.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 40.7 mtmt -73.06 -28.9 62.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.994 -0.548 . . . . 54.420000000000002 111.353 -173.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.504 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 81.5 t80 -79.21 -43.48 23.77 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.869 0.366 . . . . 72.530000000000001 110.658 178.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.18 -32.28 73.89 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.416 -0.356 . . . . 72.340000000000003 111.61 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.0 p -75.88 -15.5 60.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.555 -0.293 . . . . 70.129999999999995 111.624 -178.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 19.4 pt20 -102.1 -2.12 30.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.183 0.516 . . . . 75.319999999999993 110.106 176.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.645 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 30.2 mmmt -98.49 120.01 38.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.842 -0.617 . . . . 74.450000000000003 110.36 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.2 p -58.85 -40.52 84.53 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.349 -0.387 . . . . 50.009999999999998 111.299 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.0 m -77.43 -31.89 54.23 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.033 -0.53 . . . . 52.350000000000001 111.74 -177.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.452 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 80.0 mtp -94.42 -10.93 30.92 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.862 0.319 . . . . 72.450000000000003 111.862 -174.344 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -59.28 -37.31 77.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.048 0.451 . . . . 72.549999999999997 111.421 -176.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.461 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 61.9 mm-40 -96.69 5.07 51.4 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.3 0.571 . . . . 61.439999999999998 110.548 -175.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.554 ' HB3' HG21 ' B' ' 133' ' ' ILE . 53.6 mt -95.63 -52.29 4.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.172 -0.922 . . . . 74.430000000000007 109.687 177.133 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.416 ' HB3' HD13 ' A' ' 84' ' ' LEU . 4.2 mm? -85.7 -4.81 59.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.529 -0.76 . . . . 71.030000000000001 111.808 -176.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.461 ' HD2' ' HA ' ' A' ' 78' ' ' GLU . 18.4 ptmt -54.68 -18.09 4.17 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.854 0.359 . . . . 74.400000000000006 111.63 177.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -69.12 -44.28 72.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.393 -0.367 . . . . 64.450000000000003 111.386 179.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.603 HG23 HD12 ' A' ' 84' ' ' LEU . 16.1 m -100.46 5.28 10.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-O 120.878 0.37 . . . . 65.109999999999999 111.865 -176.02 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.745 HD11 ' HG2' ' A' ' 67' ' ' ARG . 8.2 mp . . . . . 0 C--N 1.321 -0.669 0 N-CA-C 108.895 -0.78 . . . . 64.0 108.895 172.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 20.0 p90 . . . . . 0 N--CA 1.478 0.957 0 N-CA-C 113.881 1.067 . . . . 72.140000000000001 113.881 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 132' ' ' ASN . . . . . 0.499 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 52.0 t30 -55.12 -58.04 9.3 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.746 0.308 . . . . 65.299999999999997 111.632 -173.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 133' ' ' ILE . . . . . 0.554 HG21 ' HB3' ' A' ' 79' ' ' LEU . 49.5 mm -57.36 -42.54 80.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.183 0.516 . . . . 74.519999999999996 111.108 -178.128 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.556 HD12 HD23 ' A' ' 49' ' ' LEU . 86.2 mt -67.63 -26.52 66.28 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.052 -0.522 . . . . 52.100000000000001 111.35 -177.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 46.1 ttt180 -71.73 -46.44 58.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.998 0.428 . . . . 75.430000000000007 109.942 175.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 136' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 16.8 mm-40 -63.05 -27.08 69.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.51 -0.768 . . . . 75.450000000000003 111.358 -177.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -106.17 3.36 27.84 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.411 -0.359 . . . . 70.0 111.305 -177.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 32.9 t70 55.37 65.61 1.44 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.562 0.696 . . . . 55.039999999999999 111.887 177.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -94.03 6.3 48.97 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.827 -0.624 . . . . 71.209999999999994 111.025 172.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 58.44 66.26 2.67 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 116.004 -0.544 . . . . 65.409999999999997 110.485 -175.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . 0.407 ' C ' ' HD2' ' B' ' 142' ' ' LYS . 85.7 Cg_endo -86.76 156.82 8.89 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.772 2.314 . . . . 74.209999999999994 112.691 -176.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 142' ' ' LYS . . . . . 0.407 ' HD2' ' C ' ' B' ' 141' ' ' PRO . 12.7 mptt . . . . . 0 C--N 1.328 -0.347 0 CA-C-O 120.942 0.401 . . . . 62.32 110.95 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . 0.515 ' HD3' HG22 ' B' ' 159' ' ' THR . 0.1 OUTLIER . . . . . 0 CA--C 1.51 -0.573 0 N-CA-C 107.304 -1.369 . . . . 64.430000000000007 107.304 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.581 ' O ' ' HA ' ' B' ' 159' ' ' THR . 2.6 mm? -65.23 93.95 0.14 Allowed 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.49 -0.484 . . . . 75.120000000000005 110.719 -175.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.546 ' HA ' ' O ' ' B' ' 158' ' ' LYS . . . -103.27 75.92 1.39 Allowed 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.014 -0.994 . . . . 73.340000000000003 108.75 176.112 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 151' ' ' PHE . . . . . 0.55 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 46.2 p90 -110.64 164.5 12.67 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.274 -0.876 . . . . 74.439999999999998 110.575 -173.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -101.73 116.26 32.34 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.049 0.452 . . . . 73.340000000000003 111.011 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 153' ' ' CYS . . . . . 0.668 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 49.2 t -112.32 107.7 16.63 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.84 -0.618 . . . . 64.540000000000006 109.66 178.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 66.92 6.72 4.83 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 116.093 -0.503 . . . . 73.329999999999998 111.883 176.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 126.56 -29.98 4.35 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.724 -0.75 . . . . 51.25 112.442 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 156' ' ' GLU . . . . . 0.592 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 14.1 pt-20 -91.89 140.37 29.74 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 122.682 -0.304 . . . . 63.030000000000001 110.262 -178.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 44.9 mm -83.38 123.83 39.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.879 0.371 . . . . 63.439999999999998 110.103 177.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 158' ' ' LYS . . . . . 0.592 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 27.0 mmmt -106.35 148.06 28.5 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.149 -0.686 . . . . 61.310000000000002 109.149 179.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . 0.581 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.0 OUTLIER -130.46 124.87 33.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.049 0.452 . . . . 71.530000000000001 111.584 178.449 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 160' ' ' PHE . . . . . 0.412 ' CD2' HD13 ' B' ' 166' ' ' LEU . 90.1 m-85 -132.68 126.84 33.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.587 -0.733 . . . . 74.340000000000003 110.405 176.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.7 -23.1 62.41 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.976 -0.557 . . . . 71.409999999999997 111.495 -179.09 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -150.97 177.25 10.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.851 0.358 . . . . 53.450000000000003 110.471 175.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 76.3 mt -86.65 -7.56 58.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.881 -0.6 . . . . 65.310000000000002 111.736 -175.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 164' ' ' GLN . . . . . 0.501 ' OE1' ' HD3' ' B' ' 167' ' ' ARG . 5.7 tp-100 -78.59 -40.11 35.53 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.991 -0.744 . . . . 75.319999999999993 108.991 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 22.5 t -67.79 -39.24 84.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.435 -0.802 . . . . 73.120000000000005 110.014 175.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . 0.412 HD13 ' CD2' ' B' ' 160' ' ' PHE . 53.0 tp -68.06 -29.87 68.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.875 -0.602 . . . . 75.140000000000001 110.476 177.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . 0.501 ' HD3' ' OE1' ' B' ' 164' ' ' GLN . 58.5 ttt180 -60.46 -28.05 68.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.992 -0.549 . . . . 74.129999999999995 110.908 178.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -79.89 -26.37 40.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.142 -0.481 . . . . 60.119999999999997 111.175 177.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -88.3 -42.37 12.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.159 -0.473 . . . . 61.439999999999998 110.834 -176.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.64 -23.06 67.14 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.092 -0.504 . . . . 74.209999999999994 111.535 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 3.1 p -81.14 -26.28 36.24 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.409 -0.36 . . . . 44.340000000000003 111.826 -178.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -92.73 -14.63 27.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.041 0.448 . . . . 61.210000000000001 110.526 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 173' ' ' LYS . . . . . 0.668 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 29.4 mmmt -85.56 117.34 24.4 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.01 -0.541 . . . . 55.210000000000001 109.822 175.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 11.2 m -59.67 -35.97 75.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.883 0.373 . . . . 63.210000000000001 111.449 -175.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 7.0 p -76.51 -47.83 21.48 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.269 -0.423 . . . . 31.109999999999999 111.102 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.486 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 82.3 mtp -72.31 -18.79 61.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.828 0.347 . . . . 65.439999999999998 111.293 -176.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 177' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' B' ' 173' ' ' LYS . 84.0 tttt -58.75 -41.59 86.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.904 -0.589 . . . . 71.209999999999994 111.28 -177.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . 0.615 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 9.2 mm-40 -89.23 -6.76 56.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.601 0.715 . . . . 70.120000000000005 109.647 -174.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 179' ' ' LEU . . . . . 0.502 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 64.3 mt -82.77 -43.1 17.15 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.051 -0.977 . . . . 72.109999999999999 109.971 177.129 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 180' ' ' LEU . . . . . 0.649 ' HB3' HD13 ' B' ' 184' ' ' LEU . 4.3 mm? -95.89 -9.78 30.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.872 -0.604 . . . . 55.140000000000001 112.102 -174.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 181' ' ' LYS . . . . . 0.615 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 17.5 ptmt -56.5 -20.93 22.61 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.841 0.682 . . . . 30.039999999999999 112.841 -175.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -68.66 -40.16 80.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.989 0.423 . . . . 75.530000000000001 111.252 179.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 26.3 m -103.07 -15.58 7.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.081 -0.508 . . . . 75.019999999999996 111.537 -176.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 184' ' ' LEU . . . . . 0.649 HD13 ' HB3' ' B' ' 180' ' ' LEU . 9.9 mp . . . . . 0 C--N 1.325 -0.457 0 N-CA-C 109.654 -0.498 . . . . 61.130000000000003 109.654 175.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.604 ' HB3' HD11 ' B' ' 149' ' ' LEU . 26.1 p90 . . . . . 0 C--O 1.233 0.188 0 CA-C-O 120.76 0.314 . . . . 70.150000000000006 110.806 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.552 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 8.8 t30 -60.54 -46.1 91.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.063 -0.517 . . . . 70.310000000000002 110.156 178.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.518 HG21 ' HB3' ' B' ' 179' ' ' LEU . 45.2 mm -62.66 -35.98 73.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-O 121.22 0.534 . . . . 64.530000000000001 110.439 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 72.0 mt -64.36 -39.18 93.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.758 -0.655 . . . . 63.119999999999997 110.225 178.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 57.3 ttt85 -69.51 -40.95 76.66 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.099 -0.501 . . . . 73.25 110.858 178.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.552 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 5.5 mm-40 -64.48 -31.08 72.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.831 0.348 . . . . 72.109999999999999 111.406 -178.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -100.52 1.35 40.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.02 0.438 . . . . 43.439999999999998 110.824 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 58.79 58.15 3.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.128 -0.942 . . . . 63.130000000000003 112.259 177.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -84.18 -2.86 57.62 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.478 -0.783 . . . . 65.329999999999998 109.388 169.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 60.68 75.09 0.48 Allowed Pre-proline 0 C--O 1.234 0.252 0 CA-C-N 114.912 -1.04 . . . . 74.230000000000004 111.114 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -82.54 159.21 16.86 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.632 2.222 . . . . 74.439999999999998 111.214 176.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.748 ' HD3' ' HB3' ' B' ' 150' ' ' ALA . 3.6 mptp? . . . . . 0 C--N 1.325 -0.477 0 N-CA-C 112.418 0.525 . . . . 74.239999999999995 112.418 -177.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.488 ' O ' ' HB3' ' B' ' 142' ' ' LYS . 1.7 mptp? . . . . . 0 N--CA 1.446 -0.659 0 N-CA-C 108.471 -0.937 . . . . 75.430000000000007 108.471 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.568 HD21 ' HB3' ' B' ' 131' ' ' PHE . 21.0 tp -92.92 23.27 4.3 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 109.52 -0.548 . . . . 73.120000000000005 109.52 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.673 ' HB3' ' HD3' ' B' ' 142' ' ' LYS . . . -34.3 103.7 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 O-C-N 124.553 1.158 . . . . 64.150000000000006 112.895 -173.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.743 ' HB3' ' HA ' ' B' ' 141' ' ' PRO . 46.8 p90 -132.09 172.04 12.87 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.086 -0.961 . . . . 61.229999999999997 109.969 -178.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -101.46 115.11 29.77 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.277 0.56 . . . . 72.239999999999995 110.871 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.523 ' O ' ' HG2' ' A' ' 56' ' ' GLU . 41.9 t -112.31 99.84 8.33 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.432 -0.804 . . . . 61.049999999999997 110.454 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.6 t70 64.61 15.34 9.63 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.449 0.642 . . . . 73.420000000000002 110.817 176.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.17 -35.41 3.11 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.788 -0.72 . . . . 65.319999999999993 112.801 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.771 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 13.4 pt-20 -88.72 133.31 34.26 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.712 0.292 . . . . 75.120000000000005 110.902 -176.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.401 ' HA ' ' O ' ' A' ' 51' ' ' PHE . 47.9 mm -80.91 120.37 32.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 109.24 -0.652 . . . . 74.530000000000001 109.24 176.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.771 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 28.9 mmmt -111.2 112.27 23.93 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.932 0.396 . . . . 75.200000000000003 111.509 -173.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.468 HG22 ' HB2' ' A' ' 50' ' ' ALA . 1.0 OUTLIER -88.88 104.09 16.61 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.964 -0.562 . . . . 63.299999999999997 110.488 172.818 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.503 ' CD2' HD13 ' A' ' 66' ' ' LEU . 21.4 m-85 -120.32 142.74 48.84 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.054 -0.521 . . . . 75.230000000000004 110.953 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 32.9 p -137.05 -14.26 1.57 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.149 -0.932 . . . . 60.25 109.667 173.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.46 ' HB2' ' OG ' ' A' ' 65' ' ' SER . 9.3 m-20 -98.97 157.71 16.14 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.651 -0.704 . . . . 71.420000000000002 109.265 177.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.5 mp -92.72 -39.5 11.22 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.919 -0.4 . . . . 73.030000000000001 109.919 177.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -55.03 -43.83 74.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.895 -0.593 . . . . 74.299999999999997 111.408 178.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.46 ' OG ' ' HB2' ' A' ' 62' ' ' ASP . 16.9 p -65.42 -52.01 56.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.849 0.357 . . . . 63.109999999999999 110.891 -179.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.503 HD13 ' CD2' ' A' ' 60' ' ' PHE . 63.1 tp -63.47 -34.14 77.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.04 -0.527 . . . . 60.340000000000003 110.705 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.456 ' HG3' HD21 ' A' ' 84' ' ' LEU . 20.3 ttt180 -60.81 -40.16 91.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.786 -0.643 . . . . 74.439999999999998 110.297 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.405 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 46.1 mtmt -71.97 -45.11 62.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.99 -0.55 . . . . 74.219999999999999 110.737 174.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -58.89 -49.76 76.57 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.795 -0.639 . . . . 75.450000000000003 110.949 -175.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.404 ' CB ' HD12 ' A' ' 80' ' ' LEU . . . -57.57 -38.18 74.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.876 0.37 . . . . 63.520000000000003 111.501 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 42.9 m -70.77 -30.52 67.03 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.27 -0.423 . . . . 72.450000000000003 111.462 -177.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 13.1 pt20 -97.12 12.14 33.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.209 0.528 . . . . 74.219999999999999 110.662 178.214 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.445 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 26.2 mmmt -119.07 114.84 23.12 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.83 -0.623 . . . . 72.329999999999998 110.086 175.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.5 m -58.59 -33.42 69.96 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.247 0.546 . . . . 73.430000000000007 110.545 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 12.1 m -78.54 -23.64 46.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.884 -0.598 . . . . 73.329999999999998 111.974 -176.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.447 ' HG3' ' SG ' ' A' ' 53' ' ' CYS . 46.6 mtp -104.94 -18.28 14.24 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.792 0.664 . . . . 61.100000000000001 112.792 -176.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.559 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 81.8 tttt -72.92 -17.37 61.5 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.264 0.554 . . . . 73.329999999999998 110.208 -176.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.572 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 56.5 mm-40 -102.66 4.11 37.86 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.512 -0.767 . . . . 65.329999999999998 109.665 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.597 ' HB3' HG21 ' B' ' 133' ' ' ILE . 71.8 mt -100.61 -44.48 5.83 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.15 -0.932 . . . . 72.019999999999996 109.657 175.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.404 HD12 ' CB ' ' A' ' 70' ' ' ALA . 7.9 mt -97.09 0.02 47.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.862 -0.608 . . . . 74.010000000000005 110.691 -175.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.572 ' HD3' ' HA ' ' A' ' 78' ' ' GLU . 64.4 pttt -56.61 -22.69 35.69 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.195 -0.457 . . . . 74.120000000000005 111.781 178.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -75.73 -56.58 4.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.914 0.387 . . . . 73.450000000000003 110.879 178.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 29.8 m -80.64 -20.47 11.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.076 -0.511 . . . . 73.030000000000001 112.184 -172.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.456 HD21 ' HG3' ' A' ' 67' ' ' ARG . 10.7 mp . . . . . 0 C--N 1.326 -0.449 0 N-CA-C 109.222 -0.658 . . . . 62.240000000000002 109.222 172.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 131' ' ' PHE . . . . . 0.568 ' HB3' HD21 ' A' ' 49' ' ' LEU . 33.5 p90 . . . . . 0 C--O 1.23 0.076 0 N-CA-C 111.841 0.311 . . . . 74.140000000000001 111.841 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -63.77 -37.42 87.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.277 0.56 . . . . 71.209999999999994 109.979 175.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 133' ' ' ILE . . . . . 0.597 HG21 ' HB3' ' A' ' 79' ' ' LEU . 22.7 mm -64.33 -34.06 66.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.266 -0.879 . . . . 74.409999999999997 110.751 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 77.1 mt -66.92 -34.9 78.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.789 -0.641 . . . . 73.420000000000002 111.228 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -71.85 -41.27 68.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.909 0.385 . . . . 62.43 110.343 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -59.92 -46.77 88.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.954 -0.566 . . . . 73.319999999999993 111.172 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -92.53 3.18 56.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.139 -0.482 . . . . 74.409999999999997 111.349 -176.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 53.42 71.14 0.52 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.906 0.706 . . . . 63.130000000000003 112.906 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -89.65 -6.21 56.38 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.798 -0.637 . . . . 74.420000000000002 110.331 171.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 58.68 74.96 0.56 Allowed Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 115.486 -0.779 . . . . 24.52 110.81 178.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . 0.743 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 5.0 Cg_exo -74.77 -179.57 5.04 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.36 2.707 . . . . 73.430000000000007 111.801 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 142' ' ' LYS . . . . . 0.673 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 11.5 tptp . . . . . 0 C--N 1.33 -0.282 0 C-N-CA 119.899 -0.72 . . . . 64.109999999999999 110.812 -178.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.5 0 N-CA-C 107.921 -1.14 . . . . 71.140000000000001 107.921 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.738 ' HB3' ' HD1' ' B' ' 151' ' ' PHE . 3.7 mm? -51.32 -51.45 54.29 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.212 0.32 . . . . 74.030000000000001 111.742 -175.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.748 ' HB3' ' HD3' ' A' ' 42' ' ' LYS . . . 47.32 36.67 4.99 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 123.976 0.797 . . . . 72.530000000000001 111.673 176.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 151' ' ' PHE . . . . . 0.738 ' HD1' ' HB3' ' B' ' 149' ' ' LEU . 28.5 p90 -87.66 167.68 13.67 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.867 -0.606 . . . . 73.099999999999994 109.992 -177.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -96.87 121.34 38.63 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.174 -0.466 . . . . 73.209999999999994 110.294 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 153' ' ' CYS . . . . . 0.45 ' HB2' ' CE2' ' B' ' 151' ' ' PHE . 48.7 t -122.06 113.2 19.2 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.795 -0.639 . . . . 74.519999999999996 109.635 176.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.1 t70 68.63 16.46 9.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.613 -0.721 . . . . 63.32 111.127 174.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 116.71 -32.25 5.59 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.568 -0.825 . . . . 42.310000000000002 112.827 178.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 156' ' ' GLU . . . . . 0.487 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 13.4 pt-20 -97.87 157.68 15.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.831 0.348 . . . . 75.349999999999994 110.67 -177.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.9 mm -92.23 123.55 44.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.388 -0.369 . . . . 73.129999999999995 110.389 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 158' ' ' LYS . . . . . 0.487 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 26.5 mmmt -106.59 103.82 13.36 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.987 0.422 . . . . 74.129999999999995 110.89 -177.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.17 96.25 10.48 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.084 0.468 . . . . 63.32 111.687 -179.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -110.34 123.82 50.54 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.962 -0.563 . . . . 73.409999999999997 110.046 174.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 16.2 m -93.8 -26.4 16.97 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.216 -0.661 . . . . 72.040000000000006 109.216 174.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -102.77 153.64 19.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.282 -0.872 . . . . 74.310000000000002 109.48 177.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -87.73 -20.09 26.7 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.744 0.307 . . . . 64.450000000000003 110.809 -176.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -64.11 -47.6 79.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.322 -0.399 . . . . 73.319999999999993 110.805 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 15.7 m -65.9 -35.46 80.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.549 -0.296 . . . . 53.43 110.97 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 65.3 tp -66.44 -43.4 85.72 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.02 0.438 . . . . 74.310000000000002 110.136 177.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . 0.49 ' HG3' ' CD2' ' B' ' 184' ' ' LEU . 68.4 ttt180 -62.12 -41.5 98.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.868 -0.606 . . . . 64.239999999999995 110.471 178.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -66.48 -41.65 88.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.996 -0.547 . . . . 61.420000000000002 110.887 177.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 169' ' ' PHE . . . . . 0.412 ' O ' ' HG2' ' B' ' 172' ' ' GLN . 69.6 t80 -62.69 -46.3 88.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 74.049999999999997 110.666 -179.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 170' ' ' ALA . . . . . 0.42 ' CB ' HD12 ' B' ' 180' ' ' LEU . . . -61.48 -30.42 70.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.29 -0.413 . . . . 74.400000000000006 111.518 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 20.4 m -82.75 -12.3 57.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.775 0.322 . . . . 72.010000000000005 111.652 -175.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 14.0 pt20 -106.77 -1.99 22.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.436 0.636 . . . . 75.439999999999998 109.454 175.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -110.25 103.4 12.07 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.073 -0.967 . . . . 55.299999999999997 109.525 177.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 19.9 m -56.87 -32.11 65.5 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.9 0.381 . . . . 72.340000000000003 110.984 -177.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 6.2 m -66.11 -40.98 91.13 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.047 -0.524 . . . . 42.240000000000002 111.045 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 76.5 mtp -88.28 -21.15 24.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.392 -0.367 . . . . 44.299999999999997 111.077 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 177' ' ' LYS . . . . . 0.502 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 85.6 tttt -65.68 -23.09 66.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.308 0.575 . . . . 72.099999999999994 110.269 -179.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -95.59 -8.62 34.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.509 -0.769 . . . . 71.200000000000003 109.881 -178.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 179' ' ' LEU . . . . . 0.518 ' HB3' HG21 ' A' ' 33' ' ' ILE . 89.8 mt -94.04 -52.0 4.6 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 114.853 -1.067 . . . . 71.25 109.482 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 180' ' ' LEU . . . . . 0.42 HD12 ' CB ' ' B' ' 170' ' ' ALA . 6.0 mt -87.75 -12.45 45.16 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.791 -0.641 . . . . 63.109999999999999 112.368 -171.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 181' ' ' LYS . . . . . 0.502 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 64.2 pttt -62.15 -12.01 17.48 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.44 -0.504 . . . . 63.310000000000002 111.786 -178.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -70.03 -40.44 75.17 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.101 0.477 . . . . 74.010000000000005 110.445 175.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 25.9 m -104.65 -13.23 9.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.939 -0.573 . . . . 64.319999999999993 111.094 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 184' ' ' LEU . . . . . 0.49 ' CD2' ' HG3' ' B' ' 167' ' ' ARG . 9.1 mp . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 115.92 -0.582 . . . . 71.230000000000004 109.774 175.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.46 ' HB3' HD22 ' B' ' 149' ' ' LEU . 18.4 p90 . . . . . 0 N--CA 1.484 1.24 0 N-CA-C 114.653 1.353 . . . . 74.230000000000004 114.653 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -57.33 -46.42 83.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.035 0.445 . . . . 54.039999999999999 111.023 -178.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.527 HG22 HD21 ' A' ' 37' ' ' ASN . 48.8 mm -64.56 -43.53 96.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.937 -0.574 . . . . 75.439999999999998 110.887 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.762 HD12 HD21 ' B' ' 149' ' ' LEU . 85.5 mt -65.25 -17.94 64.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 74.430000000000007 111.617 -178.078 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -79.93 -34.38 38.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.113 0.482 . . . . 74.310000000000002 110.115 175.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -71.88 -46.17 58.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.753 -0.658 . . . . 64.120000000000005 111.293 -176.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.527 HD21 HG22 ' A' ' 33' ' ' ILE . 11.9 p30 -91.15 -8.0 49.93 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.866 -0.606 . . . . 74.049999999999997 110.753 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.1 t0 55.39 73.33 0.43 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.174 -0.921 . . . . 70.25 112.077 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -86.02 12.91 8.46 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.129 -0.942 . . . . 75.409999999999997 110.241 170.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.566 ' O ' ' HA ' ' B' ' 151' ' ' PHE . 1.1 tm-20 66.54 73.28 0.39 Allowed Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 115.62 -0.718 . . . . 72.420000000000002 110.215 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -76.88 161.31 33.34 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 123.352 2.702 . . . . 71.510000000000005 111.959 -178.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.553 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 10.8 tptt . . . . . 0 N--CA 1.463 0.194 0 C-N-CA 120.195 -0.602 . . . . 72.310000000000002 112.438 -176.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.411 ' O ' ' HB3' ' B' ' 142' ' ' LYS . 0.2 OUTLIER . . . . . 0 CA--C 1.506 -0.738 0 N-CA-C 109.505 -0.554 . . . . 74.430000000000007 109.505 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.999 HD21 HD12 ' B' ' 134' ' ' LEU . 47.2 tp -79.54 80.4 5.92 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 109.383 -0.599 . . . . 74.439999999999998 109.383 175.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.761 ' H ' ' HB2' ' B' ' 142' ' ' LYS . . . -88.4 77.06 8.2 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.514 -0.766 . . . . 63.140000000000001 110.146 178.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.575 ' HD1' ' HG ' ' A' ' 49' ' ' LEU . 43.7 p90 -93.77 168.76 10.79 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.638 -0.71 . . . . 73.340000000000003 110.919 -174.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.47 ' HE3' ' CD1' ' A' ' 57' ' ' ILE . 4.5 tppp? -96.78 114.08 25.68 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.999 -0.546 . . . . 63.420000000000002 110.368 -178.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.482 ' SG ' ' HE1' ' A' ' 69' ' ' PHE . 48.7 t -121.57 112.57 18.64 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.141 -0.481 . . . . 52.130000000000003 110.66 179.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.5 t70 68.88 0.98 2.94 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.298 -0.865 . . . . 74.540000000000006 112.456 171.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 127.98 -13.62 6.37 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.182 -1.009 . . . . 43.310000000000002 112.91 178.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.605 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 11.9 pt-20 -118.09 144.78 45.35 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.072 0.463 . . . . 75.219999999999999 110.272 177.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.47 ' CD1' ' HE3' ' A' ' 52' ' ' LYS . 41.0 mm -75.16 126.07 35.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.866 -0.607 . . . . 72.519999999999996 109.767 177.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.605 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 30.9 mmmt -114.17 117.51 31.4 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.187 -0.301 . . . . 75.239999999999995 110.187 -178.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.56 105.54 16.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.111 0.481 . . . . 70.140000000000001 111.458 178.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.444 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 25.5 m-85 -123.29 151.42 42.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.034 -0.53 . . . . 74.299999999999997 111.424 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.4 t -158.89 19.06 0.2 Allowed 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.075 -1.083 . . . . 54.43 108.075 173.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -129.88 117.05 19.55 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 114.809 -1.087 . . . . 75.310000000000002 109.373 -173.162 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.482 HD11 HD13 ' A' ' 84' ' ' LEU . 51.6 tp -65.38 -37.57 87.39 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.633 0.254 . . . . 74.230000000000004 110.535 179.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 44.5 tt0 -59.47 -50.39 74.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.09 0.471 . . . . 72.340000000000003 111.019 177.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.4 m -66.51 -42.09 87.85 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.101 -0.5 . . . . 71.129999999999995 110.881 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 36.4 tp -65.48 -33.17 75.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.271 -0.422 . . . . 63.009999999999998 110.714 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.576 ' HA ' HD21 ' A' ' 84' ' ' LEU . 54.3 ttp180 -57.95 -40.38 80.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.328 -0.396 . . . . 74.120000000000005 110.659 177.023 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -69.88 -40.61 75.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.081 -0.509 . . . . 74.299999999999997 111.228 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.575 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 33.9 t80 -74.66 -45.19 46.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 71.430000000000007 111.068 -176.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.48 -28.36 67.79 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.753 0.311 . . . . 74.340000000000003 111.028 -177.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 31.6 t -63.92 -29.32 70.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.137 -0.483 . . . . 32.310000000000002 111.18 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.575 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 13.5 pt20 -95.9 0.95 52.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.167 0.508 . . . . 60.340000000000003 110.199 -179.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.48 ' HD3' ' HA ' ' A' ' 73' ' ' LYS . 43.3 mmtt -102.74 111.38 23.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.944 -0.571 . . . . 71.340000000000003 111.067 -178.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.8 m -53.99 -35.53 61.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.019 -0.537 . . . . 61.229999999999997 111.228 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.2 p -81.8 -56.88 3.7 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.236 0.541 . . . . 74.099999999999994 111.28 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.517 ' HA ' HD12 ' A' ' 79' ' ' LEU . 74.9 mtp -66.23 -24.0 66.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.674 -0.694 . . . . 73.120000000000005 112.312 -173.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.415 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 45.4 tttm -61.9 -33.99 75.22 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.858 0.361 . . . . 65.129999999999995 110.989 179.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -87.76 -14.06 40.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.572 0.701 . . . . 63.340000000000003 109.517 -174.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.517 HD12 ' HA ' ' A' ' 76' ' ' MET . 84.8 mt -82.26 -48.19 11.52 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.746 -1.116 . . . . 71.439999999999998 109.302 175.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.445 ' O ' ' HB3' ' A' ' 84' ' ' LEU . 4.3 mm? -79.31 -24.3 42.92 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.145 -0.934 . . . . 60.43 112.077 -177.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.415 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 64.2 pttt -57.85 -16.84 13.06 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.486 0.55 . . . . 51.43 112.486 -174.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -81.1 -45.43 16.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.856 0.36 . . . . 70.230000000000004 111.178 -177.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 11.5 m -106.99 -2.19 9.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.225 0.536 . . . . 64.420000000000002 111.169 -174.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.576 HD21 ' HA ' ' A' ' 67' ' ' ARG . 40.6 tp . . . . . 0 C--N 1.32 -0.71 0 CA-C-N 115.716 -0.675 . . . . 70.409999999999997 109.82 -176.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 131' ' ' PHE . . . . . 0.656 ' HD1' HD22 ' A' ' 49' ' ' LEU . 57.2 m-85 . . . . . 0 N--CA 1.471 0.609 0 N-CA-C 112.13 0.419 . . . . 71.25 112.13 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -55.11 -36.75 66.03 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.352 0.501 . . . . 72.129999999999995 112.352 -176.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 133' ' ' ILE . . . . . 0.467 HG21 ' HB3' ' A' ' 79' ' ' LEU . 40.6 mm -58.0 -50.7 77.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.922 0.391 . . . . 55.439999999999998 110.797 177.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.999 HD12 HD21 ' A' ' 49' ' ' LEU . 40.3 mt -69.35 -9.07 51.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.037 -0.528 . . . . 72.519999999999996 111.558 -178.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -82.34 -30.1 30.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.848 0.356 . . . . 71.120000000000005 110.109 176.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -73.62 -53.87 9.47 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.269 0.556 . . . . 60.240000000000002 110.324 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 137' ' ' ASN . . . . . 0.543 ' OD1' ' HA ' ' B' ' 134' ' ' LEU . 16.1 p30 -80.48 -14.04 58.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.233 -0.894 . . . . 74.329999999999998 111.606 -177.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 11.5 t70 55.85 70.91 0.59 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.754 0.787 . . . . 62.25 110.403 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 139' ' ' PHE . . . . . 0.494 ' O ' ' HB2' ' B' ' 140' ' ' GLU . 1.8 m-85 -86.15 26.63 1.0 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.181 -0.918 . . . . 73.319999999999993 110.462 178.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 140' ' ' GLU . . . . . 0.528 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 12.4 mm-40 70.36 61.34 0.5 Allowed Pre-proline 0 N--CA 1.464 0.258 0 O-C-N 123.951 0.782 . . . . 72.040000000000006 110.529 -177.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . 0.434 ' HD3' ' N ' ' B' ' 140' ' ' GLU . 6.5 Cg_exo -72.8 139.77 31.07 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.722 2.281 . . . . 52.149999999999999 112.073 -175.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 142' ' ' LYS . . . . . 0.761 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 13.6 mptt . . . . . 0 C--N 1.327 -0.409 0 CA-C-O 120.952 0.406 . . . . 75.209999999999994 111.328 -178.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . 0.441 ' O ' ' HB3' ' A' ' 42' ' ' LYS . 1.3 mptt . . . . . 0 CA--C 1.508 -0.67 0 N-CA-C 108.662 -0.866 . . . . 62.119999999999997 108.662 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.762 HD21 HD12 ' A' ' 34' ' ' LEU . 65.9 tp -80.26 84.86 5.85 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.636 0.731 . . . . 72.519999999999996 109.147 174.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.553 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -94.76 115.72 27.86 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 114.811 -1.086 . . . . 43.340000000000003 109.082 176.666 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 151' ' ' PHE . . . . . 0.566 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 44.8 p90 -130.78 164.78 24.39 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.084 -0.507 . . . . 73.420000000000002 110.716 -179.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -87.52 123.2 32.17 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.131 -0.486 . . . . 73.420000000000002 110.012 179.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 153' ' ' CYS . . . . . 0.591 ' SG ' ' HE3' ' B' ' 173' ' ' LYS . 38.1 t -133.69 104.58 6.4 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.342 -0.39 . . . . 73.409999999999997 110.546 178.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 15.0 t70 70.21 14.02 7.65 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.259 -0.882 . . . . 73.25 111.948 172.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 124.54 -29.72 4.9 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.424 -0.893 . . . . 71.540000000000006 112.953 176.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 156' ' ' GLU . . . . . 0.446 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 15.4 pt-20 -106.68 150.85 25.83 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 122.553 -0.38 . . . . 74.530000000000001 110.644 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 44.6 mm -84.77 127.34 39.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.555 -0.535 . . . . 74.120000000000005 109.555 177.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 158' ' ' LYS . . . . . 0.533 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 29.2 mmmt -107.52 112.05 24.63 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.498 -0.319 . . . . 75.019999999999996 110.557 -177.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . 0.526 HG22 ' HB2' ' B' ' 150' ' ' ALA . 0.8 OUTLIER -86.35 103.54 15.02 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.921 0.391 . . . . 74.319999999999993 110.988 176.777 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 160' ' ' PHE . . . . . 0.446 ' HD2' HD13 ' B' ' 166' ' ' LEU . 20.4 m-30 -120.66 116.56 25.54 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.173 -0.467 . . . . 73.329999999999998 111.197 178.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 8.0 t -109.64 10.53 24.91 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.354 -0.98 . . . . 74.099999999999994 108.354 171.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -122.09 121.62 37.35 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 114.863 -1.062 . . . . 71.239999999999995 110.104 -177.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 63.0 tp -65.96 -35.48 80.71 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.925 -0.398 . . . . 63.539999999999999 109.925 177.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -62.29 -42.29 99.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.941 -0.572 . . . . 74.219999999999999 110.813 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 43.6 m -67.15 -43.5 82.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.215 -0.448 . . . . 75.109999999999999 110.645 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . 0.446 HD13 ' HD2' ' B' ' 160' ' ' PHE . 64.5 tp -65.35 -38.0 88.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.253 -0.431 . . . . 73.329999999999998 110.532 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . 0.423 ' HG3' ' HG ' ' B' ' 184' ' ' LEU . 36.6 ttp180 -58.37 -41.08 83.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.341 -0.391 . . . . 51.43 110.55 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 168' ' ' LYS . . . . . 0.402 ' HB2' ' HE3' ' B' ' 168' ' ' LYS . 40.0 mtmt -65.19 -51.97 57.76 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.01 -0.541 . . . . 74.129999999999995 110.886 177.078 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 169' ' ' PHE . . . . . 0.408 ' CE1' ' HE2' ' B' ' 173' ' ' LYS . 22.4 t80 -65.97 -44.8 83.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.296 -0.865 . . . . 71.219999999999999 111.266 -171.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.57 -30.52 71.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.374 -0.375 . . . . 62.329999999999998 111.511 -179.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 25.6 t -77.67 -20.47 53.67 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.495 -0.321 . . . . 52.229999999999997 111.111 -177.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -100.07 1.68 42.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.247 0.546 . . . . 62.439999999999998 110.618 178.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 173' ' ' LYS . . . . . 0.591 ' HE3' ' SG ' ' B' ' 153' ' ' CYS . 60.8 mmtt -102.18 118.11 36.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.57 -0.741 . . . . 71.400000000000006 109.58 173.131 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 4.2 p -59.01 -43.12 91.5 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.14 0.495 . . . . 40.219999999999999 111.007 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 4.5 m -69.6 -32.87 71.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.815 -0.63 . . . . 60.439999999999998 111.687 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.511 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 77.1 mtp -96.82 -10.85 25.76 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.698 0.258 . . . . 63.420000000000002 111.698 -172.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -56.58 -40.85 75.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.25 -0.432 . . . . 74.329999999999998 111.723 -177.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . 0.603 ' HA ' ' HD3' ' B' ' 181' ' ' LYS . 31.9 mt-10 -94.51 -0.31 54.74 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.262 0.553 . . . . 71.519999999999996 110.622 -173.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 179' ' ' LEU . . . . . 0.497 HD22 HD22 ' A' ' 37' ' ' ASN . 83.8 mt -83.21 -51.01 7.85 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.465 -0.789 . . . . 74.239999999999995 109.496 176.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 180' ' ' LEU . . . . . 0.625 ' HB3' HD13 ' B' ' 184' ' ' LEU . 3.7 mm? -92.01 1.54 57.13 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.775 -0.648 . . . . 72.120000000000005 111.481 -175.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 181' ' ' LYS . . . . . 0.603 ' HD3' ' HA ' ' B' ' 178' ' ' GLU . 63.8 pttt -65.19 -2.35 2.88 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.714 0.635 . . . . 73.209999999999994 112.714 -176.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -79.48 -31.0 42.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.357 0.599 . . . . 63.210000000000001 109.939 174.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 5.3 p -107.23 -21.25 5.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.46 -0.791 . . . . 61.43 110.006 177.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 184' ' ' LEU . . . . . 0.625 HD13 ' HB3' ' B' ' 180' ' ' LEU . 10.1 mp . . . . . 0 C--N 1.327 -0.41 0 CA-C-N 115.998 -0.547 . . . . 63.420000000000002 109.927 174.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.573 ' HB3' HD11 ' B' ' 149' ' ' LEU . 13.0 p90 . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.543 0.211 . . . . 75.120000000000005 111.475 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.616 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 9.2 t30 -59.3 -61.13 2.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.323 -0.399 . . . . 70.25 111.217 -174.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.551 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 1.7 mp -53.45 -41.59 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.44 -0.345 . . . . 65.109999999999999 111.508 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.1 mt -60.06 -40.49 89.66 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.13 -0.487 . . . . 73.319999999999993 111.27 178.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -67.83 -43.39 79.68 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 116.605 -0.27 . . . . 74.209999999999994 110.799 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.616 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 4.8 mm-40 -63.5 -38.93 93.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 62.420000000000002 111.005 -177.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -92.23 1.17 57.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 64.209999999999994 111.032 -178.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 56.77 53.45 8.28 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.608 -0.724 . . . . 72.099999999999994 112.371 177.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -81.37 -11.34 59.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.856 -0.611 . . . . 63.439999999999998 109.629 171.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 60.25 81.85 0.24 Allowed Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 114.506 -1.225 . . . . 72.349999999999994 111.734 176.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.576 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 20.9 Cg_exo -66.27 164.28 28.72 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.719 2.279 . . . . 74.299999999999997 110.969 175.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 1.129 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.478 0 C-N-CA 119.595 -0.842 . . . . 64.0 110.476 -176.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.387 0 N-CA-C 109.396 -0.594 . . . . 75.540000000000006 109.396 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.689 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 11.0 mp -72.61 92.35 1.51 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.339 -0.391 . . . . 74.239999999999995 110.293 178.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.631 ' HA ' ' O ' ' A' ' 58' ' ' LYS . . . -87.56 70.25 9.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.966 -0.561 . . . . 53.520000000000003 109.834 175.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.689 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 45.3 p90 -100.92 169.29 9.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.622 -0.717 . . . . 72.239999999999995 110.527 -177.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -105.65 121.72 44.57 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.477 -0.328 . . . . 73.150000000000006 111.391 -176.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.559 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 48.5 t -110.18 103.62 12.34 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.109 -0.496 . . . . 63.340000000000003 109.891 175.136 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 65.01 12.81 8.21 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.676 0.621 . . . . 73.239999999999995 112.676 174.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.45 -28.94 4.9 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.402 -0.904 . . . . 63.130000000000003 112.482 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.424 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 12.0 pt-20 -95.54 131.92 41.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.015 0.436 . . . . 74.209999999999994 110.721 -179.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 50.0 mm -75.26 129.64 36.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.103 -0.499 . . . . 71.239999999999995 110.375 177.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.631 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 28.0 mmmt -113.05 155.36 25.0 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.078 -0.712 . . . . 61.219999999999999 109.078 178.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.4 p -128.45 108.82 10.86 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.001 0.429 . . . . 74.540000000000006 110.889 175.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.468 ' CD2' HD13 ' A' ' 66' ' ' LEU . 87.2 m-85 -121.17 123.69 42.9 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.94 -0.573 . . . . 64.099999999999994 111.27 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.7 p -116.82 -17.27 10.51 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.396 -0.82 . . . . 74.310000000000002 109.527 174.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -106.97 127.3 53.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.472 -0.786 . . . . 70.340000000000003 110.526 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.5 tt -65.35 -44.06 88.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.996 -0.547 . . . . 72.420000000000002 110.328 -176.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.548 ' O ' ' HG3' ' A' ' 68' ' ' LYS . 47.9 tp60 -58.55 -41.48 85.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.095 -0.502 . . . . 75.099999999999994 110.84 -177.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.7 m -62.91 -45.76 90.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.12 -0.491 . . . . 74.310000000000002 111.011 178.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.468 HD13 ' CD2' ' A' ' 60' ' ' PHE . 55.2 tp -70.35 -31.8 69.24 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 75.430000000000007 110.888 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.432 ' HG2' ' HG ' ' A' ' 84' ' ' LEU . 3.4 tmm_? -62.79 -29.22 70.54 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.173 -0.467 . . . . 72.310000000000002 110.378 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.548 ' HG3' ' O ' ' A' ' 64' ' ' GLN . 91.5 mttt -70.02 -46.16 65.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.352 0.596 . . . . 61.140000000000001 110.599 176.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -67.28 -48.8 66.6 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.186 -0.915 . . . . 73.530000000000001 110.956 -176.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.1 -26.69 67.58 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.17 -0.468 . . . . 72.219999999999999 111.636 -177.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 35.9 t -75.97 -23.53 55.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.559 -0.291 . . . . 63.149999999999999 111.472 -178.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -102.82 2.01 34.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.328 0.585 . . . . 74.340000000000003 110.299 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.559 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 28.2 mmmt -103.5 101.12 11.0 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.216 -0.902 . . . . 73.340000000000003 109.751 175.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.4 p -55.83 -33.32 64.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.04 0.448 . . . . 71.129999999999995 111.07 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.455 ' O ' HD13 ' A' ' 79' ' ' LEU . 3.0 m -62.34 -45.64 92.3 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.727 -0.669 . . . . 72.530000000000001 110.937 177.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 82.0 mtp -90.95 -13.51 33.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.159 -0.473 . . . . 74.120000000000005 111.482 -174.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.638 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 33.6 ttpt -75.24 -9.05 58.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.778 0.323 . . . . 62.049999999999997 110.709 -176.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -99.06 -5.06 31.0 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.904 0.859 . . . . 73.540000000000006 109.492 174.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.714 ' HB3' HG21 ' B' ' 133' ' ' ILE . 10.7 mp -97.62 -55.92 2.67 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.442 -1.254 . . . . 74.340000000000003 109.42 176.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.811 ' HB3' HD13 ' A' ' 84' ' ' LEU . 3.8 mm? -81.19 -7.79 59.63 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 114.806 -1.088 . . . . 74.420000000000002 112.111 -176.254 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.638 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 64.8 pttt -55.05 -20.22 9.03 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.812 0.339 . . . . 75.400000000000006 111.729 178.012 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -69.24 -33.69 73.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.348 -0.387 . . . . 74.219999999999999 111.219 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 27.0 m -115.9 -8.3 12.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.018 0.377 . . . . 54.140000000000001 112.018 -175.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.811 HD13 ' HB3' ' A' ' 80' ' ' LEU . 8.3 mp . . . . . 0 C--N 1.326 -0.413 0 CA-C-N 116.464 -0.334 . . . . 61.240000000000002 110.823 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 29.7 p90 . . . . . 0 N--CA 1.463 0.178 0 CA-C-O 120.716 0.293 . . . . 73.439999999999998 111.569 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 132' ' ' ASN . . . . . 0.439 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 30.0 t30 -58.13 -54.55 45.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.855 -0.612 . . . . 70.400000000000006 111.079 -179.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 133' ' ' ILE . . . . . 0.714 HG21 ' HB3' ' A' ' 79' ' ' LEU . 4.1 mp -62.0 -40.57 87.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.138 0.494 . . . . 73.409999999999997 110.651 -177.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 89.9 mt -64.27 -31.38 72.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.928 -0.578 . . . . 64.340000000000003 111.142 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 54.2 ttt-85 -70.52 -45.02 66.36 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.113 0.482 . . . . 72.010000000000005 110.359 177.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 136' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 14.6 mm-40 -66.25 -33.08 74.94 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.587 -0.733 . . . . 73.120000000000005 111.58 -176.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -100.22 7.99 44.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.707 0.289 . . . . 74.430000000000007 111.22 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 56.16 68.16 0.9 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.718 -0.673 . . . . 73.140000000000001 112.639 175.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 139' ' ' PHE . . . . . 0.432 ' O ' ' HB2' ' A' ' 51' ' ' PHE . 11.4 m-85 -97.96 1.86 48.4 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.996 -0.547 . . . . 75.150000000000006 110.377 173.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 66.81 71.57 0.44 Allowed Pre-proline 0 CA--C 1.534 0.362 0 O-C-N 123.886 0.741 . . . . 74.5 110.696 -178.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -74.18 160.3 42.7 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.648 2.232 . . . . 61.119999999999997 111.689 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 11.4 mptt . . . . . 0 C--N 1.325 -0.494 0 N-CA-C 112.151 0.426 . . . . 71.310000000000002 112.151 -176.109 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? . . . . . 0 CA--C 1.519 -0.241 0 CA-C-O 121.206 0.527 . . . . 54.439999999999998 110.648 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.573 HD11 ' HB3' ' A' ' 31' ' ' PHE . 23.5 tp -98.2 15.11 25.43 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.402 -0.817 . . . . 74.439999999999998 109.02 172.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.706 ' HB2' HG22 ' B' ' 159' ' ' THR . . . -34.61 104.11 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 O-C-N 124.317 1.011 . . . . 65.140000000000001 113.242 -173.29 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 151' ' ' PHE . . . . . 0.576 ' HB3' ' HA ' ' A' ' 41' ' ' PRO . 50.5 p90 -119.04 174.23 6.43 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 114.921 -1.036 . . . . 73.549999999999997 109.543 -177.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -100.56 123.45 44.79 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.146 0.498 . . . . 70.409999999999997 111.578 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 153' ' ' CYS . . . . . 0.553 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 49.8 t -124.8 116.59 22.53 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.399 -0.819 . . . . 74.5 109.229 174.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 63.29 17.58 10.36 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.462 -0.335 . . . . 72.040000000000006 111.469 178.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 110.44 -29.59 8.96 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.641 -0.79 . . . . 73.200000000000003 112.714 178.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 156' ' ' GLU . . . . . 0.637 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 12.7 pt-20 -93.79 146.66 23.71 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.051 0.453 . . . . 64.150000000000006 110.677 -177.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.7 mm -85.06 120.17 35.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.227 -0.442 . . . . 61.409999999999997 110.162 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 158' ' ' LYS . . . . . 0.637 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 28.4 mmmt -102.54 120.03 39.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.458 -0.337 . . . . 74.310000000000002 110.267 -178.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . 0.706 HG22 ' HB2' ' B' ' 150' ' ' ALA . 2.5 p -95.69 110.52 22.64 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.118 -0.492 . . . . 61.420000000000002 112.164 -176.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 160' ' ' PHE . . . . . 0.588 ' CD2' HD13 ' B' ' 166' ' ' LEU . 61.5 m-85 -132.65 151.94 51.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.709 -0.678 . . . . 73.040000000000006 110.192 176.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 13.2 p -134.03 14.11 3.92 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.049 -0.523 . . . . 71.400000000000006 110.006 176.154 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -146.96 144.59 29.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.757 -0.656 . . . . 74.019999999999996 110.598 -176.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . 0.447 HD13 ' O ' ' B' ' 163' ' ' LEU . 2.6 tm? -78.19 -34.28 49.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.456 . . . . 75.519999999999996 110.679 -175.304 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -67.17 -46.77 73.0 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.688 0.28 . . . . 74.030000000000001 110.496 -178.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 41.8 m -61.42 -39.12 89.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.359 -0.382 . . . . 62.520000000000003 110.86 177.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . 0.588 HD13 ' CD2' ' B' ' 160' ' ' PHE . 62.5 tp -71.47 -31.83 67.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.423 -0.353 . . . . 71.340000000000003 110.858 179.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 21.5 ttm180 -57.5 -39.35 76.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.356 -0.384 . . . . 74.310000000000002 110.543 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -60.11 -51.95 67.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.942 -0.572 . . . . 75.219999999999999 110.591 177.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 169' ' ' PHE . . . . . 0.434 ' CZ ' ' HE2' ' B' ' 158' ' ' LYS . 73.9 t80 -66.16 -43.6 86.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.261 -0.881 . . . . 74.319999999999993 111.074 -176.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -59.9 -40.89 90.3 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.121 -0.491 . . . . 63.149999999999999 111.977 -177.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 12.8 t -78.54 -21.32 48.95 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.759 0.281 . . . . 73.030000000000001 111.759 -174.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -93.96 -13.53 26.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.193 0.521 . . . . 72.109999999999999 110.617 179.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 173' ' ' LYS . . . . . 0.553 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 27.7 mmmt -88.59 117.16 27.35 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.042 -0.526 . . . . 75.109999999999999 110.28 176.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 1.5 m -51.42 -46.26 62.89 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 123.449 0.468 . . . . 62.020000000000003 110.96 -179.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 5.4 m -67.26 -43.87 80.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.897 -0.592 . . . . 63.520000000000003 111.556 -179.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.429 ' HA ' HD12 ' B' ' 179' ' ' LEU . 73.5 mtp -80.09 -22.39 42.27 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.779 0.323 . . . . 73.519999999999996 111.712 -174.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 177' ' ' LYS . . . . . 0.455 ' HE2' ' HB3' ' B' ' 177' ' ' LYS . 33.8 ttpt -58.37 -38.94 78.28 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.02 -0.536 . . . . 75.450000000000003 110.851 -177.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -86.1 -3.23 58.91 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.644 0.735 . . . . 63.450000000000003 110.063 -174.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 179' ' ' LEU . . . . . 0.551 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 78.1 mt -94.48 -42.13 9.01 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 114.89 -1.05 . . . . 74.239999999999995 109.667 179.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 180' ' ' LEU . . . . . 0.631 ' HB3' HD13 ' B' ' 184' ' ' LEU . 4.0 mm? -96.38 -9.84 29.04 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.608 -0.724 . . . . 54.219999999999999 111.929 -176.29 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 181' ' ' LYS . . . . . 0.44 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 65.5 pttt -55.52 -17.61 5.7 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.838 0.681 . . . . 51.100000000000001 112.838 -177.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -70.9 -38.53 73.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.859 0.361 . . . . 43.229999999999997 110.687 179.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 31.5 m -107.67 -10.35 10.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.259 -0.428 . . . . 54.43 111.365 -176.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 184' ' ' LEU . . . . . 0.631 HD13 ' HB3' ' B' ' 180' ' ' LEU . 9.3 mp . . . . . 0 C--N 1.327 -0.406 0 CA-C-N 116.272 -0.422 . . . . 64.239999999999995 110.316 177.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.47 ' HB2' ' HB3' ' A' ' 41' ' ' PRO . 22.6 p90 . . . . . 0 N--CA 1.475 0.785 0 N-CA-C 113.918 1.081 . . . . 62.219999999999999 113.918 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.486 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 9.4 t30 -66.35 -53.09 40.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.878 0.37 . . . . 71.109999999999999 110.307 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.564 HG21 ' HB3' ' B' ' 179' ' ' LEU . 45.8 mm -58.07 -43.7 85.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.87 -0.604 . . . . 63.149999999999999 110.616 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.657 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 64.7 mt -60.3 -42.06 94.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.695 -0.684 . . . . 73.349999999999994 111.252 179.358 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -64.61 -42.43 95.54 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.408 -0.36 . . . . 75.400000000000006 110.185 -179.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 38.8 mm-40 -65.75 -32.81 74.56 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.257 -0.429 . . . . 72.540000000000006 111.32 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -99.67 7.16 45.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.947 0.403 . . . . 54.350000000000001 111.064 -178.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 56.65 54.63 7.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.433 -0.803 . . . . 75.400000000000006 112.278 177.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.657 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 7.9 m-85 -84.45 -7.94 59.12 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.13 -0.693 . . . . 73.200000000000003 109.13 168.271 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 64.15 88.14 0.12 Allowed Pre-proline 0 N--CA 1.455 -0.18 0 CA-C-N 114.633 -1.167 . . . . 72.120000000000005 111.685 179.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.47 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 51.1 Cg_endo -70.28 148.36 61.51 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.56 2.174 . . . . 75.420000000000002 111.362 175.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.633 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 3.6 tptp . . . . . 0 C--N 1.325 -0.46 0 C-N-CA 119.848 -0.741 . . . . 74.409999999999997 110.846 -179.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.586 ' O ' ' HB3' ' B' ' 142' ' ' LYS . 3.8 mptt . . . . . 0 CA--C 1.508 -0.645 0 N-CA-C 109.099 -0.704 . . . . 73.340000000000003 109.099 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.786 HD21 HD12 ' B' ' 134' ' ' LEU . 46.2 tp -111.26 78.87 1.15 Allowed 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 109.225 -0.657 . . . . 74.200000000000003 109.225 169.501 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.867 ' H ' ' HB2' ' B' ' 142' ' ' LYS . . . -90.95 83.33 5.64 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.196 -0.911 . . . . 74.209999999999994 109.506 176.051 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.538 ' HD1' ' HG ' ' A' ' 49' ' ' LEU . 31.2 p90 -103.53 170.94 7.64 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.427 -0.806 . . . . 65.530000000000001 109.732 -178.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -98.24 127.51 44.22 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 120.324 -0.55 . . . . 71.329999999999998 110.177 177.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.5 ' SG ' ' HE2' ' A' ' 69' ' ' PHE . 29.8 t -133.5 108.81 8.86 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.895 -0.593 . . . . 72.040000000000006 109.567 175.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 70.82 27.06 3.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.321 -0.854 . . . . 52.32 110.627 176.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 103.68 -36.48 4.32 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.482 -0.866 . . . . 71.340000000000003 112.771 177.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.469 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 10.7 pt-20 -91.77 148.95 21.86 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.211 0.529 . . . . 75.230000000000004 110.673 -178.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 50.7 mm -86.16 127.27 40.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.481 -0.781 . . . . 65.030000000000001 109.652 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.68 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 29.2 mmmt -112.58 128.26 56.31 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.421 -0.354 . . . . 55.32 110.331 -176.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.33 109.37 21.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.007 0.432 . . . . 70.239999999999995 111.189 179.15 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.68 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 35.5 m-85 -118.82 148.4 42.9 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.129 -0.487 . . . . 73.530000000000001 110.472 178.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 11.7 p -138.17 6.58 2.6 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.184 -0.462 . . . . 43.229999999999997 110.939 176.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -142.43 144.01 32.88 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.879 -0.415 . . . . 73.409999999999997 109.879 179.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.472 HD13 ' O ' ' A' ' 63' ' ' LEU . 1.4 tm? -72.11 -32.33 66.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.25 -0.432 . . . . 72.219999999999999 110.244 -179.355 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.43 ' NE2' HH21 ' A' ' 67' ' ' ARG . 7.0 tp60 -64.8 -44.98 88.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.97 0.414 . . . . 50.310000000000002 110.355 -178.066 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.4 m -64.69 -38.32 90.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.789 -0.641 . . . . 62.020000000000003 110.181 178.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.484 ' HA ' ' CE2' ' A' ' 60' ' ' PHE . 47.3 tp -70.83 -36.17 72.78 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.764 -0.653 . . . . 73.430000000000007 111.178 -177.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.43 HH21 ' NE2' ' A' ' 64' ' ' GLN . 56.8 ttp85 -54.48 -45.62 73.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.09 0.471 . . . . 72.420000000000002 111.2 178.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 39.0 mtmt -66.23 -38.6 88.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.983 -0.553 . . . . 72.239999999999995 111.076 -176.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.5 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 55.8 t80 -74.44 -39.32 62.64 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.239 0.542 . . . . 73.230000000000004 110.443 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.69 -23.89 66.18 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.013 -0.539 . . . . 73.400000000000006 111.449 179.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.1 t -74.94 -38.84 61.66 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.522 -0.308 . . . . 73.129999999999995 111.128 -179.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 20.6 pt20 -74.8 -28.2 60.62 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.006 0.431 . . . . 55.130000000000003 110.237 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.435 ' HB3' ' HE3' ' A' ' 73' ' ' LYS . 25.8 mmmt -79.23 109.9 13.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.942 -0.572 . . . . 73.109999999999999 110.68 176.192 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.5 p -61.53 -29.75 70.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.376 -0.374 . . . . 71.209999999999994 111.737 -176.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.7 p -76.4 -45.57 31.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.951 0.405 . . . . 63.219999999999999 110.973 178.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 81.2 mtp -71.42 -26.32 62.7 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.34 -0.391 . . . . 51.439999999999998 110.634 -178.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.536 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 26.1 ttpp -56.44 -29.3 61.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.906 -0.588 . . . . 74.540000000000006 111.081 177.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -96.36 -4.69 41.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.292 0.568 . . . . 73.140000000000001 110.641 -176.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.596 ' HB3' ' CG2' ' B' ' 133' ' ' ILE . 84.3 mt -91.97 -46.95 7.55 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.314 -0.857 . . . . 64.219999999999999 109.421 177.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.78 -11.6 53.12 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.318 -0.856 . . . . 53.240000000000002 111.693 -177.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.536 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 62.6 pttt -60.17 -18.59 49.04 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.372 0.508 . . . . 72.409999999999997 112.372 -177.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.53 -44.53 86.58 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.128 0.489 . . . . 61.450000000000003 110.399 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 23.1 m -98.46 -11.1 8.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.83 -0.623 . . . . 71.540000000000006 111.107 -177.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.9 mt . . . . . 0 C--N 1.325 -0.497 0 N-CA-C 109.334 -0.617 . . . . 72.430000000000007 109.334 174.134 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 131' ' ' PHE . . . . . 0.51 ' HB3' HD22 ' A' ' 49' ' ' LEU . 22.1 p90 . . . . . 0 N--CA 1.477 0.922 0 N-CA-C 113.426 0.898 . . . . 54.520000000000003 113.426 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 132' ' ' ASN . . . . . 0.472 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 8.9 t30 -69.98 -44.31 69.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.522 0.201 . . . . 72.239999999999995 110.844 -177.296 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 133' ' ' ILE . . . . . 0.596 ' CG2' ' HB3' ' A' ' 79' ' ' LEU . 50.3 mm -58.24 -43.54 86.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.395 0.617 . . . . 64.310000000000002 110.414 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.786 HD12 HD21 ' A' ' 49' ' ' LEU . 61.1 mt -67.4 -29.98 69.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.616 -0.72 . . . . 53.240000000000002 110.711 178.194 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -71.82 -41.56 68.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.988 -0.551 . . . . 74.510000000000005 110.1 178.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 136' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 11.1 mm-40 -66.7 -37.17 84.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.922 -0.581 . . . . 74.239999999999995 111.461 179.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -96.42 -0.64 48.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.468 -0.333 . . . . 74.129999999999995 111.36 -176.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 38.4 t70 58.34 69.24 0.75 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.648 0.737 . . . . 65.420000000000002 112.043 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 139' ' ' PHE . . . . . 0.564 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 3.2 m-85 -97.54 7.34 46.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.529 -0.759 . . . . 70.25 109.501 170.745 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 140' ' ' GLU . . . . . 0.413 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 33.7 tt0 62.14 79.15 0.28 Allowed Pre-proline 0 C--N 1.332 -0.177 0 CA-C-N 114.61 -1.177 . . . . 74.549999999999997 111.046 -176.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.51 156.34 66.53 Favored 'Trans proline' 0 N--CA 1.464 -0.242 0 C-N-CA 122.388 2.059 . . . . 74.049999999999997 110.33 173.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 142' ' ' LYS . . . . . 0.867 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 23.3 tptt . . . . . 0 C--N 1.327 -0.385 0 C-N-CA 119.296 -0.962 . . . . 73.319999999999993 110.548 -178.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.509 -0.618 0 N-CA-C 109.341 -0.614 . . . . 63.409999999999997 109.341 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.65 ' HG ' ' HD1' ' B' ' 151' ' ' PHE . 56.5 tp -75.11 83.52 2.32 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.263 0.554 . . . . 70.230000000000004 109.678 177.314 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.633 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -91.5 76.9 5.8 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.289 -0.869 . . . . 60.109999999999999 109.863 177.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 151' ' ' PHE . . . . . 0.65 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 42.3 p90 -94.01 167.87 11.32 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.52 -0.764 . . . . 73.310000000000002 110.323 -176.122 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -99.58 113.89 26.59 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 121.248 0.547 . . . . 61.240000000000002 110.66 179.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 153' ' ' CYS . . . . . 0.59 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 44.1 t -110.22 102.47 11.14 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.507 -0.769 . . . . 74.310000000000002 110.098 179.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 15.0 t70 68.91 17.93 8.59 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 115.545 -0.752 . . . . 73.010000000000005 111.234 175.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 122.26 -34.73 3.72 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.204 -0.998 . . . . 63.409999999999997 112.882 177.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -94.61 150.16 20.51 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.624 0.249 . . . . 64.109999999999999 110.611 -178.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.9 mm -84.23 131.39 34.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 109.899 -0.408 . . . . 74.049999999999997 109.899 175.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 158' ' ' LYS . . . . . 0.606 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 31.8 mmmt -120.98 129.81 53.57 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.032 -0.358 . . . . 74.349999999999994 110.032 178.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.83 107.14 17.88 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.102 0.477 . . . . 63.299999999999997 111.85 -176.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 160' ' ' PHE . . . . . 0.606 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 42.6 m-85 -120.47 135.54 55.03 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.18 -0.463 . . . . 75.319999999999993 110.78 178.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 31.4 p -120.7 10.12 10.92 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.103 0.478 . . . . 53.140000000000001 110.461 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -144.2 138.76 28.29 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.829 -0.623 . . . . 73.420000000000002 110.543 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . 0.409 HD22 ' HA ' ' B' ' 163' ' ' LEU . 1.8 tm? -74.77 -39.31 61.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.864 -0.607 . . . . 63.509999999999998 110.275 -176.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -60.8 -45.67 93.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.086 0.469 . . . . 61.32 110.64 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . 0.578 ' HA ' ' HE2' ' B' ' 168' ' ' LYS . 23.8 m -60.71 -38.21 84.29 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.815 -0.629 . . . . 73.230000000000004 110.63 176.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 53.3 tp -70.55 -32.08 69.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.093 -0.503 . . . . 70.109999999999999 111.091 -178.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -59.45 -38.27 80.29 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.666 0.27 . . . . 71.329999999999998 110.504 177.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 168' ' ' LYS . . . . . 0.578 ' HE2' ' HA ' ' B' ' 165' ' ' SER . 56.9 mtmt -61.6 -46.58 89.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.274 0.559 . . . . 63.140000000000001 110.588 177.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 169' ' ' PHE . . . . . 0.518 ' O ' ' HG2' ' B' ' 172' ' ' GLN . 66.9 t80 -66.67 -43.41 84.57 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.406 -0.816 . . . . 72.530000000000001 110.327 -179.465 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -60.8 -36.13 78.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.002 -0.545 . . . . 74.430000000000007 111.2 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 45.3 m -74.62 -22.25 59.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.487 -0.324 . . . . 65.439999999999998 111.849 -176.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . 0.518 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 13.7 pt20 -95.54 -7.73 37.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.091 0.472 . . . . 70.549999999999997 110.454 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 173' ' ' LYS . . . . . 0.59 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 30.1 mmmt -96.86 119.56 35.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.858 -0.61 . . . . 72.540000000000006 110.138 179.18 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 24.1 m -56.51 -37.59 70.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.99 0.424 . . . . 64.239999999999995 110.805 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 11.2 p -76.02 -49.83 16.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.678 -0.692 . . . . 73.519999999999996 111.521 -178.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.519 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 81.1 mtp -74.57 -22.3 59.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.092 -0.504 . . . . 74.340000000000003 111.996 -173.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -62.63 -25.91 68.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.136 0.493 . . . . 63.409999999999997 111.014 -178.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -103.27 8.31 38.33 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.612 0.72 . . . . 74.450000000000003 110.544 -177.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 179' ' ' LEU . . . . . 0.564 ' HB3' HG21 ' A' ' 33' ' ' ILE . 97.3 mt -103.31 -49.36 3.74 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.049 -0.978 . . . . 74.439999999999998 110.28 176.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 180' ' ' LEU . . . . . 0.528 ' HB3' HD12 ' B' ' 184' ' ' LEU . 4.0 mm? -85.05 -17.91 35.97 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.671 -0.695 . . . . 72.140000000000001 112.312 -174.1 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 59.2 pttt -64.26 -20.55 66.13 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.69 0.281 . . . . 73.340000000000003 111.665 -174.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -67.92 -47.99 67.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.977 0.418 . . . . 74.120000000000005 110.548 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 183' ' ' VAL . . . . . 0.439 HG23 ' HG ' ' B' ' 184' ' ' LEU . 31.4 m -91.82 -21.58 6.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.955 -0.566 . . . . 71.340000000000003 111.279 -177.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 184' ' ' LEU . . . . . 0.528 HD12 ' HB3' ' B' ' 180' ' ' LEU . 87.7 mt . . . . . 0 C--N 1.322 -0.6 0 N-CA-C 109.147 -0.686 . . . . 62.420000000000002 109.147 176.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.604 ' HB3' HD13 ' B' ' 149' ' ' LEU . 36.0 p90 . . . . . 0 N--CA 1.482 1.175 0 N-CA-C 114.549 1.314 . . . . 75.329999999999998 114.549 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -67.28 -57.17 7.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.839 0.352 . . . . 75.010000000000005 111.618 -175.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.498 HG21 ' HB3' ' B' ' 179' ' ' LEU . 48.7 mm -62.38 -37.81 79.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.367 0.603 . . . . 73.030000000000001 111.136 -177.245 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.4 mt -59.2 -33.15 70.62 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.332 -0.849 . . . . 64.510000000000005 111.551 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 51.4 ttt180 -68.56 -46.87 68.33 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.07 0.462 . . . . 71.219999999999999 110.406 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -69.04 -27.68 65.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.396 -0.82 . . . . 75.439999999999998 111.645 -173.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -106.61 6.83 30.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.548 -0.296 . . . . 71.340000000000003 111.19 -177.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.2 t70 58.55 69.89 0.69 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 115.494 -0.776 . . . . 75.530000000000001 111.919 175.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -98.76 3.13 47.48 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.697 -0.683 . . . . 74.420000000000002 111.037 172.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 58.02 71.37 1.06 Allowed Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 115.943 -0.571 . . . . 73.409999999999997 110.783 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -87.31 166.7 7.92 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.616 2.211 . . . . 61.520000000000003 112.505 -178.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.779 ' HB2' ' HA ' ' B' ' 149' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.333 -0.394 . . . . 73.209999999999994 110.413 177.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.448 ' HD2' ' O ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.445 -0.702 0 N-CA-C 109.59 -0.522 . . . . 53.140000000000001 109.59 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.79 ' HA ' ' HB2' ' B' ' 142' ' ' LYS . 0.2 OUTLIER -75.71 90.96 2.87 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 120.492 -0.483 . . . . 75.409999999999997 109.815 178.21 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.16 90.58 1.58 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.506 -0.77 . . . . 62.210000000000001 109.348 173.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.437 ' HA ' ' O ' ' B' ' 140' ' ' GLU . 53.9 p90 -107.16 166.84 10.33 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.525 -0.761 . . . . 63.229999999999997 110.514 -177.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.82 ' HE2' ' HA2' ' A' ' 55' ' ' GLY . 82.3 tttt -105.93 113.0 26.28 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.628 -0.715 . . . . 72.030000000000001 109.928 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.619 ' SG ' ' HE3' ' A' ' 73' ' ' LYS . 53.6 t -100.13 93.54 5.77 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.9 -0.591 . . . . 62.32 110.032 -179.248 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.9 t70 70.91 -9.09 0.87 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.664 0.745 . . . . 74.519999999999996 111.609 176.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.82 ' HA2' ' HE2' ' A' ' 52' ' ' LYS . . . 150.39 -27.25 1.09 Allowed Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.677 -0.692 . . . . 64.010000000000005 112.276 -178.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 53' ' ' CYS . 11.7 pt-20 -91.88 130.06 37.72 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.743 0.306 . . . . 75.530000000000001 110.695 -179.055 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.6 mm -80.9 122.38 36.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.682 -0.488 . . . . 74.209999999999994 109.682 177.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.598 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 30.6 mmmt -120.62 131.08 54.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.449 -0.342 . . . . 73.019999999999996 110.444 -177.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.1 p -101.09 113.73 27.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.068 0.461 . . . . 73.5 111.311 177.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.598 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 22.6 m-85 -120.85 139.48 53.11 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.892 -0.595 . . . . 71.340000000000003 110.825 178.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.4 t -120.85 -24.24 5.71 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.833 -0.803 . . . . 60.439999999999998 108.833 176.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -101.38 137.3 39.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.261 -0.881 . . . . 51.210000000000001 109.658 179.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.7 mt -83.25 -31.55 26.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.958 0.408 . . . . 64.140000000000001 110.701 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -69.39 -36.84 77.18 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.467 -0.333 . . . . 74.329999999999998 110.312 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.1 m -70.61 -32.71 70.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.032 0.444 . . . . 65.400000000000006 110.331 176.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.482 ' HA ' ' CE2' ' A' ' 60' ' ' PHE . 3.5 tm? -67.82 -42.16 81.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.719 -0.673 . . . . 62.409999999999997 109.721 177.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -33.6 70.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.466 -0.788 . . . . 74.530000000000001 110.128 -179.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -65.43 -47.84 74.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.651 -0.704 . . . . 70.439999999999998 111.057 176.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -63.35 -40.28 96.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.666 -0.697 . . . . 65.120000000000005 110.886 -175.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.8 -22.88 66.0 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.486 -0.325 . . . . 63.530000000000001 111.155 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.1 m -76.05 -20.73 57.5 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.302 -0.408 . . . . 73.540000000000006 111.673 -178.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -100.01 3.19 44.07 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.197 0.522 . . . . 75.409999999999997 110.724 178.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.619 ' HE3' ' SG ' ' A' ' 53' ' ' CYS . 70.6 mmtt -108.5 109.68 21.0 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.665 -0.698 . . . . 64.540000000000006 110.184 178.358 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.9 m -58.35 -32.41 68.51 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.823 0.344 . . . . 75.109999999999999 111.131 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.446 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 8.1 m -76.36 -37.96 56.52 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.304 -0.407 . . . . 71.409999999999997 111.251 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.578 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 77.4 mtp -86.35 -22.33 26.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.881 0.372 . . . . 71.040000000000006 111.566 -175.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -62.25 -30.0 70.8 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.994 -0.548 . . . . 62.439999999999998 111.981 -175.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -103.92 3.47 33.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.552 0.691 . . . . 72.329999999999998 110.319 -178.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 75' ' ' SER . 63.9 mt -86.52 -51.35 6.23 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.352 -0.84 . . . . 73.230000000000004 108.761 170.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.85 -7.66 56.98 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.88 -1.055 . . . . 73.0 111.393 -177.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.464 ' HB2' ' HE3' ' A' ' 81' ' ' LYS . 19.0 ptmt -57.85 -19.12 26.7 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.115 0.413 . . . . 71.329999999999998 112.115 -177.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -74.12 -43.77 56.31 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.998 -0.281 . . . . 62.009999999999998 110.773 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 32.7 m -91.41 -20.16 6.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.084 0.469 . . . . 63.450000000000003 110.909 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 40.9 mt . . . . . 0 C--N 1.326 -0.453 0 N-CA-C 108.991 -0.744 . . . . 75.230000000000004 108.991 175.438 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 131' ' ' PHE . . . . . 0.672 ' HB3' HD13 ' A' ' 49' ' ' LEU . 24.6 p90 . . . . . 0 N--CA 1.479 0.998 0 N-CA-C 114.086 1.143 . . . . 63.450000000000003 114.086 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -68.31 -61.55 1.79 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.95 0.405 . . . . 71.209999999999994 110.854 -178.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 133' ' ' ILE . . . . . . . . . . . . . 49.0 mm -60.06 -38.44 76.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.902 -0.59 . . . . 74.319999999999993 111.044 -177.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 70.0 mt -56.46 -37.41 70.26 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.545 -0.752 . . . . 73.519999999999996 111.158 177.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -69.45 -42.72 74.56 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.3 -0.409 . . . . 62.439999999999998 110.906 -178.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -69.93 -29.45 66.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.916 -0.584 . . . . 61.240000000000002 111.533 -175.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -98.47 -0.14 44.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.035 0.445 . . . . 60.43 110.677 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 26.4 t70 61.84 64.01 1.06 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.05 -0.977 . . . . 74.530000000000001 111.515 177.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -91.36 2.97 56.01 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.283 -0.871 . . . . 75.540000000000006 110.372 171.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 140' ' ' GLU . . . . . 0.437 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 14.7 tp10 61.71 63.41 2.23 Favored Pre-proline 0 CA--C 1.538 0.49 0 CA-C-N 115.948 -0.569 . . . . 75.150000000000006 111.397 178.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.4 163.47 34.41 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.262 1.975 . . . . 71.230000000000004 111.204 177.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 142' ' ' LYS . . . . . 0.823 ' HA ' ' HE3' ' B' ' 142' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.528 0 C-N-CA 120.81 -0.356 . . . . 75.239999999999995 111.372 -176.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . 0.495 ' CG ' HG22 ' B' ' 159' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.399 0 N-CA-C 110.22 -0.289 . . . . 74.420000000000002 110.22 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.779 ' HA ' ' HB2' ' A' ' 42' ' ' LYS . 0.5 OUTLIER -78.29 86.2 4.4 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 109.285 -0.635 . . . . 72.519999999999996 109.285 174.525 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -78.56 91.28 4.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.242 -0.89 . . . . 55.240000000000002 109.295 175.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 151' ' ' PHE . . . . . 0.445 ' CE2' ' HB2' ' B' ' 153' ' ' CYS . 52.6 p90 -108.57 164.7 12.12 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.08 -0.509 . . . . 72.109999999999999 110.736 -175.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 152' ' ' LYS . . . . . 0.738 ' HE2' ' HA2' ' B' ' 155' ' ' GLY . 78.0 tttt -92.9 104.92 17.12 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.762 -0.654 . . . . 71.129999999999995 110.015 179.232 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 153' ' ' CYS . . . . . 0.796 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 36.8 t -93.45 92.26 7.54 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.352 -0.84 . . . . 71.219999999999999 110.607 -174.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 16.8 t70 66.44 6.89 4.62 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.762 -0.654 . . . . 74.530000000000001 111.294 174.391 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 155' ' ' GLY . . . . . 0.738 ' HA2' ' HE2' ' B' ' 152' ' ' LYS . . . 138.53 -32.65 2.29 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.966 -0.635 . . . . 73.530000000000001 112.348 -179.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 156' ' ' GLU . . . . . 0.492 ' OE1' ' HD3' ' B' ' 158' ' ' LYS . 16.0 pt-20 -98.06 135.18 40.11 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.502 0.191 . . . . 71.030000000000001 110.665 -177.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 46.7 mm -77.48 120.14 27.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.54 -0.541 . . . . 64.140000000000001 109.54 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 158' ' ' LYS . . . . . 0.524 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 32.3 mmmt -117.17 123.58 47.04 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.81 0.338 . . . . 63.0 110.621 -177.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . 0.495 HG22 ' CG ' ' B' ' 148' ' ' LYS . 0.3 OUTLIER -93.94 107.67 19.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.095 -0.502 . . . . 73.5 111.005 178.567 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 160' ' ' PHE . . . . . 0.524 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 57.3 m-85 -115.13 123.79 49.85 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.329 0.585 . . . . 74.420000000000002 111.482 179.126 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 23.3 t -120.79 10.75 11.01 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 107.665 -1.235 . . . . 71.230000000000004 107.665 171.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -129.7 110.39 11.74 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.36 -1.291 . . . . 63.240000000000002 109.476 -177.322 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -69.52 -32.96 72.11 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.486 -0.324 . . . . 71.120000000000005 111.087 -176.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -68.44 -45.8 71.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.847 0.356 . . . . 73.420000000000002 110.458 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 49.8 m -64.27 -30.78 71.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.215 -0.448 . . . . 55.420000000000002 110.485 176.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . 0.441 ' HA ' ' CE2' ' B' ' 160' ' ' PHE . 61.5 tp -68.1 -39.98 82.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.489 . . . . 64.120000000000005 110.69 177.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -59.55 -38.68 81.72 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.251 -0.431 . . . . 75.25 110.648 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -58.66 -54.84 42.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.294 0.569 . . . . 75.439999999999998 110.575 176.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 169' ' ' PHE . . . . . 0.605 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 57.0 t80 -66.56 -44.86 81.17 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.944 -1.025 . . . . 74.439999999999998 111.584 -172.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.4 -29.49 70.53 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 111.948 0.351 . . . . 73.200000000000003 111.948 -178.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 3.7 t -80.65 -23.55 39.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.754 0.312 . . . . 63.219999999999999 110.96 -175.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -95.27 -15.81 22.91 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.82 0.343 . . . . 71.030000000000001 111.102 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 173' ' ' LYS . . . . . 0.796 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 25.6 mmmt -78.41 116.25 18.68 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.522 -0.547 . . . . 73.239999999999995 109.522 173.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 22.0 t -59.51 -33.87 71.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.356 -0.384 . . . . 54.310000000000002 111.412 -174.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 175' ' ' SER . . . . . 0.43 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 5.1 p -78.97 -40.98 30.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.768 0.318 . . . . 71.420000000000002 111.291 179.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.556 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 70.3 mtp -75.21 -27.29 59.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.566 -0.288 . . . . 71.540000000000006 111.667 -177.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 45.8 tttm -52.79 -40.26 63.05 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.284 -0.416 . . . . 74.120000000000005 111.625 -178.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -92.33 -2.99 56.04 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.561 0.695 . . . . 64.230000000000004 110.051 -173.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 179' ' ' LEU . . . . . 0.498 ' HB3' HG21 ' A' ' 33' ' ' ILE . 60.1 mt -88.7 -47.72 8.04 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.014 -0.994 . . . . 41.439999999999998 108.92 173.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 180' ' ' LEU . . . . . 0.465 HD13 HG13 ' A' ' 33' ' ' ILE . 4.1 mm? -86.62 -7.94 57.9 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.881 -1.054 . . . . 72.340000000000003 111.689 -176.096 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 181' ' ' LYS . . . . . 0.42 ' HE3' ' HB2' ' B' ' 181' ' ' LYS . 18.1 ptmt -53.21 -23.16 7.95 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.499 0.555 . . . . 72.319999999999993 112.499 -178.866 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -72.41 -40.85 66.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.239 0.543 . . . . 64.310000000000002 110.174 177.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 47.5 t -82.14 -35.71 13.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.77 0.795 . . . . 72.140000000000001 109.934 178.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 184' ' ' LEU . . . . . . . . . . . . . 30.8 mt . . . . . 0 C--N 1.316 -0.85 0 CA-C-N 115.104 -0.953 . . . . 72.430000000000007 109.47 -178.667 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 11.2 p90 . . . . . 0 C--O 1.232 0.181 0 N-CA-C 112.338 0.495 . . . . 73.120000000000005 112.338 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -73.3 -52.27 14.54 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.999 -0.28 . . . . 74.25 111.073 -175.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.537 HG21 ' HB3' ' B' ' 179' ' ' LEU . 43.3 mm -55.56 -45.33 78.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.22 0.533 . . . . 43.310000000000002 111.338 -178.457 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.032 HD12 HD21 ' B' ' 149' ' ' LEU . 66.2 mt -66.78 -26.87 67.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.809 -0.632 . . . . 42.329999999999998 111.414 -176.332 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.472 ' HB2' ' HG3' ' A' ' 41' ' ' PRO . 1.0 OUTLIER -68.77 -40.34 79.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.785 0.326 . . . . 64.420000000000002 110.39 176.994 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -76.56 -23.82 53.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.106 0.479 . . . . 71.230000000000004 110.8 -177.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -100.54 4.3 43.43 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.017 -0.538 . . . . 71.519999999999996 110.906 -179.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.7 t70 56.11 58.59 4.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.507 -0.77 . . . . 74.209999999999994 111.85 177.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.615 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 5.8 m-85 -96.69 7.15 47.23 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.797 -0.638 . . . . 71.200000000000003 109.578 172.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.458 ' O ' ' HA ' ' B' ' 151' ' ' PHE . 30.7 tt0 61.55 80.03 0.26 Allowed Pre-proline 0 C--N 1.333 -0.117 0 CA-C-N 114.829 -1.078 . . . . 73.219999999999999 110.942 -178.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.472 ' HG3' ' HB2' ' A' ' 35' ' ' ARG . 69.3 Cg_endo -75.31 152.36 39.24 Favored 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.583 2.189 . . . . 73.310000000000002 111.966 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.651 ' H ' HD12 ' B' ' 149' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.428 0 C-N-CA 120.785 -0.366 . . . . 74.019999999999996 110.675 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.512 0 N-CA-C 108.421 -0.955 . . . . 75.219999999999999 108.421 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.683 HD11 ' HB3' ' B' ' 141' ' ' PRO . 12.5 tp -74.93 86.49 2.28 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.012 0.434 . . . . 75.239999999999995 109.961 -176.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.541 ' HB2' HG22 ' A' ' 59' ' ' THR . . . -88.17 103.85 16.15 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.488 -0.778 . . . . 63.32 110.255 177.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -125.7 169.89 12.09 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.101 -0.5 . . . . 64.530000000000001 110.088 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.435 ' HE3' HD11 ' A' ' 57' ' ' ILE . 32.2 ttmt -101.71 116.62 33.13 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.333 -0.394 . . . . 75.349999999999994 110.758 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.619 ' O ' ' HG2' ' A' ' 56' ' ' GLU . 52.7 t -116.18 104.12 11.21 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.937 -0.574 . . . . 33.32 110.365 179.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.8 t70 70.24 4.33 4.82 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.854 0.835 . . . . 61.149999999999999 110.805 175.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.12 -31.43 4.27 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.542 -0.753 . . . . 75.299999999999997 112.017 -179.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.619 ' HG2' ' O ' ' A' ' 53' ' ' CYS . 11.7 pt-20 -84.24 131.16 34.77 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.014 0.435 . . . . 74.209999999999994 110.082 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.435 HD11 ' HE3' ' A' ' 52' ' ' LYS . 41.1 mm -82.21 114.81 23.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.486 -0.561 . . . . 74.319999999999993 109.486 178.206 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.427 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 32.1 mmmt -109.63 129.72 55.57 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.23 -0.441 . . . . 73.140000000000001 111.187 -174.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.541 HG22 ' HB2' ' A' ' 50' ' ' ALA . 2.5 p -103.07 118.16 36.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.095 -0.502 . . . . 73.230000000000004 110.593 176.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.463 ' CD2' HD13 ' A' ' 66' ' ' LEU . 49.7 m-85 -129.72 121.36 26.75 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.206 0.527 . . . . 75.439999999999998 110.669 177.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.0 p -95.34 1.81 54.48 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.841 -0.618 . . . . 73.239999999999995 110.599 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -155.2 166.88 32.21 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.543 -0.753 . . . . 74.400000000000006 110.158 -178.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.525 HD13 ' O ' ' A' ' 63' ' ' LEU . 2.8 tm? -87.6 -21.22 25.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.167 -0.469 . . . . 74.299999999999997 109.898 -177.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -62.88 -47.66 82.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.088 -0.506 . . . . 71.519999999999996 110.946 -177.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' A' ' 68' ' ' LYS . 12.2 t -71.31 -34.26 70.43 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.372 -0.376 . . . . 71.239999999999995 110.196 178.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.463 HD13 ' CD2' ' A' ' 60' ' ' PHE . 57.1 tp -68.45 -34.53 76.12 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 120.996 -0.281 . . . . 72.239999999999995 110.457 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.567 ' HG3' HD13 ' A' ' 84' ' ' LEU . 50.8 ttt180 -56.17 -46.33 79.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.231 0.539 . . . . 74.310000000000002 109.914 173.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 65' ' ' SER . 15.8 mmmt -57.57 -36.16 71.32 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.058 -0.974 . . . . 64.530000000000001 111.299 177.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.484 ' CE2' ' HE3' ' A' ' 73' ' ' LYS . 58.5 t80 -84.87 -44.19 13.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.742 -0.663 . . . . 74.109999999999999 111.511 -175.519 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.12 -22.21 63.98 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.46 -0.336 . . . . 64.5 111.364 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 14.2 t -74.71 -17.9 60.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.316 -0.402 . . . . 74.400000000000006 111.286 -178.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 13.0 pt20 -101.79 -8.94 21.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.229 0.538 . . . . 74.129999999999995 110.185 176.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.534 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 70.0 mmtt -94.0 104.34 16.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.704 -0.68 . . . . 73.400000000000006 109.631 176.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.5 m -53.42 -32.58 50.36 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.879 0.371 . . . . 75.120000000000005 111.713 -178.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 26.9 m -76.94 -45.13 28.82 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.813 0.339 . . . . 71.109999999999999 111.297 179.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.534 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 61.4 mtp -78.38 -17.09 56.93 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.901 0.382 . . . . 54.329999999999998 111.422 -175.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.475 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 12.9 tmtt? -63.97 -24.15 67.61 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.944 -0.571 . . . . 63.219999999999999 110.593 177.205 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.564 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 28.3 mm-40 -98.24 6.62 47.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.295 0.569 . . . . 52.350000000000001 110.287 -178.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.761 ' HB3' HG21 ' B' ' 133' ' ' ILE . 43.2 mt -100.59 -46.99 5.02 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.226 -0.897 . . . . 65.239999999999995 110.233 178.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -94.92 -0.39 53.99 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.939 -0.573 . . . . 54.030000000000001 111.052 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.564 ' HD2' ' HA ' ' A' ' 78' ' ' GLU . 20.5 ptmt -51.2 -21.31 1.96 Allowed 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.364 0.876 . . . . 75.5 113.364 -178.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -76.25 -46.67 27.03 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.801 0.334 . . . . 72.439999999999998 111.476 -178.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 29.2 m -89.19 -12.58 9.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.263 -0.426 . . . . 74.239999999999995 111.221 -175.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.567 HD13 ' HG3' ' A' ' 67' ' ' ARG . 80.3 mt . . . . . 0 C--N 1.319 -0.734 0 CA-C-N 116.076 -0.511 . . . . 64.450000000000003 109.622 178.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 34.9 p90 . . . . . 0 CA--C 1.524 -0.054 0 N-CA-C 111.791 0.293 . . . . 72.299999999999997 111.791 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 132' ' ' ASN . . . . . 0.408 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 31.7 t30 -64.25 -58.64 5.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.524 -0.307 . . . . 43.43 111.178 -177.053 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 133' ' ' ILE . . . . . 0.761 HG21 ' HB3' ' A' ' 79' ' ' LEU . 27.3 mm -61.05 -38.95 80.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-O 121.194 0.521 . . . . 42.240000000000002 110.828 -176.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.613 ' HA ' ' HD2' ' B' ' 139' ' ' PHE . 51.6 mt -65.4 -33.28 75.59 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.67 -0.695 . . . . 73.239999999999995 111.235 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 42.2 ttt-85 -65.36 -48.23 73.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.146 0.498 . . . . 61.140000000000001 110.154 175.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 136' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 6.6 mm-40 -61.2 -42.03 97.87 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.149 -0.932 . . . . 72.140000000000001 111.616 -177.009 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -86.46 0.12 54.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.304 -0.407 . . . . 65.510000000000005 110.997 -179.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 15.6 t70 56.66 62.79 2.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.298 -0.864 . . . . 74.540000000000006 112.016 177.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 139' ' ' PHE . . . . . 0.613 ' HD2' ' HA ' ' B' ' 134' ' ' LEU . 75.3 m-85 -91.3 -4.5 55.82 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.06 -0.518 . . . . 73.420000000000002 110.394 169.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 60.1 84.67 0.2 Allowed Pre-proline 0 CA--C 1.529 0.157 0 CA-C-N 115.316 -0.857 . . . . 65.219999999999999 110.859 -176.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . 0.683 ' HB3' HD11 ' A' ' 49' ' ' LEU . 17.6 Cg_exo -67.03 161.96 40.33 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 123.179 2.586 . . . . 72.120000000000005 112.092 177.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 142' ' ' LYS . . . . . 0.474 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 23.4 tptt . . . . . 0 C--N 1.329 -0.311 0 C-N-CA 120.819 -0.352 . . . . 73.230000000000004 110.133 179.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.512 -0.511 0 N-CA-C 109.374 -0.602 . . . . 74.510000000000005 109.374 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 1.032 HD21 HD12 ' A' ' 34' ' ' LEU . 66.4 tp -77.32 92.57 3.92 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.519 -0.764 . . . . 71.310000000000002 110.811 -174.631 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.633 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -95.01 85.75 4.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.677 -0.692 . . . . 71.519999999999996 109.788 175.062 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 151' ' ' PHE . . . . . 0.592 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 45.4 p90 -102.54 171.95 7.14 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.876 -0.602 . . . . 75.310000000000002 110.349 -177.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -103.2 119.56 39.09 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.103 0.478 . . . . 75.140000000000001 110.625 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 153' ' ' CYS . . . . . 0.432 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 23.0 t -113.15 101.22 9.23 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.802 -0.636 . . . . 72.150000000000006 109.618 177.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 65.69 14.69 9.67 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.605 -0.725 . . . . 62.350000000000001 112.115 176.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 128.89 -32.82 3.21 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.103 -1.046 . . . . 70.010000000000005 112.84 177.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -100.2 142.13 32.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.145 0.498 . . . . 71.450000000000003 110.918 -177.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . 0.43 ' HA ' ' O ' ' B' ' 151' ' ' PHE . 49.1 mm -80.3 124.96 38.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.809 -0.632 . . . . 53.43 110.278 178.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 158' ' ' LYS . . . . . 0.448 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 26.7 mmmt -114.34 132.47 56.18 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.888 -0.412 . . . . 61.229999999999997 109.888 179.155 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.4 109.93 21.85 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.902 0.382 . . . . 72.140000000000001 111.667 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 160' ' ' PHE . . . . . 0.448 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 33.9 m-85 -119.8 128.99 54.22 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.047 -0.524 . . . . 73.340000000000003 110.438 177.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 2.9 p -100.85 -16.56 17.21 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.125 -0.489 . . . . 54.140000000000001 111.764 -178.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -139.37 164.44 29.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.924 0.392 . . . . 63.340000000000003 110.786 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . 0.458 HD13 ' O ' ' B' ' 163' ' ' LEU . 3.0 tm? -86.45 -25.29 25.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.763 -0.653 . . . . 73.420000000000002 110.251 -176.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 51.3 tt0 -60.85 -46.76 89.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.011 0.434 . . . . 64.549999999999997 110.86 -177.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 14.2 m -68.63 -34.43 75.73 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.845 -0.616 . . . . 74.219999999999999 110.373 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 42.8 tp -71.45 -26.95 62.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.915 -0.584 . . . . 72.209999999999994 110.615 -178.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -56.2 -43.35 78.41 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.664 -0.244 . . . . 70.329999999999998 110.681 177.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 28.0 mtmt -67.36 -43.15 82.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.033 0.444 . . . . 74.540000000000006 110.234 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 169' ' ' PHE . . . . . 0.582 ' O ' ' HG2' ' B' ' 173' ' ' LYS . 70.8 t80 -64.16 -45.9 86.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.516 -0.765 . . . . 72.340000000000003 110.54 -177.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -71.63 -28.62 63.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.101 -0.5 . . . . 61.450000000000003 111.286 -178.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 22.9 t -67.89 -32.89 73.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.622 -0.263 . . . . 63.240000000000002 111.127 -177.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -84.45 -16.04 43.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.872 0.368 . . . . 70.099999999999994 110.403 178.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 173' ' ' LYS . . . . . 0.582 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 31.6 mmmt -83.22 145.72 28.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.151 -0.477 . . . . 75.299999999999997 110.129 178.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 12.7 m -83.67 -44.79 14.14 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.284 0.564 . . . . 53.130000000000003 109.557 176.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 3.2 m -72.54 -40.29 66.86 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.52 -0.764 . . . . 63.229999999999997 111.504 -177.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.446 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 81.6 mtp -85.2 -17.85 35.86 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.391 0.515 . . . . 75.25 112.391 -172.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 177' ' ' LYS . . . . . 0.537 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 88.0 tttt -63.93 -31.06 72.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.979 0.419 . . . . 44.32 110.795 -178.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . 0.871 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 51.7 mm-40 -90.08 -0.3 57.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.521 0.677 . . . . 65.420000000000002 110.419 -175.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 179' ' ' LEU . . . . . 0.537 ' HB3' HG21 ' A' ' 33' ' ' ILE . 52.8 mt -94.78 -49.71 5.47 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.024 -0.989 . . . . 64.040000000000006 109.806 -179.244 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 180' ' ' LEU . . . . . 0.61 ' O ' ' HG ' ' B' ' 184' ' ' LEU . 3.4 mm? -88.89 -14.93 35.64 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.531 -0.759 . . . . 72.010000000000005 111.858 -176.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 181' ' ' LYS . . . . . 0.871 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 20.4 ptmt -53.89 -23.96 14.46 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 111.959 0.355 . . . . 73.510000000000005 111.959 -178.113 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -65.66 -23.75 66.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.022 -0.535 . . . . 71.530000000000001 111.942 -174.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 19.3 m -124.88 3.34 4.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 112.201 0.445 . . . . 64.310000000000002 112.201 -178.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 184' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' B' ' 180' ' ' LEU . 81.9 mt . . . . . 0 C--N 1.326 -0.452 0 C-N-CA 121.21 -0.196 . . . . 74.129999999999995 110.874 -179.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 33.8 p90 . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.86 0.362 . . . . 70.010000000000005 110.601 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -61.03 -50.96 71.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.893 -0.594 . . . . 71.239999999999995 110.962 -175.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.488 HG21 ' HB3' ' B' ' 179' ' ' LEU . 28.4 mm -60.59 -39.98 83.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.905 -0.589 . . . . 74.540000000000006 111.411 -178.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.48 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 86.4 mt -68.29 -22.49 64.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.863 -0.608 . . . . 71.510000000000005 110.982 -176.574 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 46.4 ttt-85 -73.32 -42.6 62.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.09 -0.505 . . . . 73.439999999999998 109.914 175.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -72.05 -23.43 61.37 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.925 -0.579 . . . . 64.239999999999995 111.04 -177.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -103.89 6.17 36.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.382 -0.372 . . . . 62.219999999999999 110.731 179.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 52.06 62.27 2.79 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.387 -0.824 . . . . 71.239999999999995 112.816 176.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.484 ' HB3' ' HB2' ' B' ' 151' ' ' PHE . 12.4 m-85 -94.36 -4.8 47.86 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.74 -0.664 . . . . 72.310000000000002 109.794 173.251 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 58.82 74.69 0.58 Allowed Pre-proline 0 C--O 1.232 0.183 0 CA-C-N 115.25 -0.886 . . . . 63.020000000000003 110.195 -174.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -78.58 142.42 18.29 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 123.006 2.471 . . . . 44.109999999999999 112.334 -176.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.702 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 1.4 mptm? . . . . . 0 C--N 1.322 -0.609 0 CA-C-N 116.072 -0.513 . . . . 75.340000000000003 110.061 177.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.564 ' HD3' HG22 ' A' ' 59' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.45 -0.436 0 N-CA-C 109.225 -0.657 . . . . 63.350000000000001 109.225 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.689 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 11.2 mp -70.43 86.57 0.62 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.469 -0.332 . . . . 61.299999999999997 110.491 -178.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.587 ' HA ' ' O ' ' A' ' 58' ' ' LYS . . . -84.98 63.08 7.9 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.629 -0.714 . . . . 54.539999999999999 110.047 175.459 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.689 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 51.8 p90 -95.33 171.57 8.63 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.485 -0.78 . . . . 74.030000000000001 110.077 -177.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -102.51 133.56 47.27 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.324 -0.398 . . . . 74.519999999999996 111.25 -178.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 42.3 t -135.8 114.69 12.11 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.695 -0.684 . . . . 74.5 109.453 175.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 70.34 13.95 7.52 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.143 0.577 . . . . 73.430000000000007 111.308 177.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 110.21 -32.32 6.76 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.682 -0.77 . . . . 74.400000000000006 112.186 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -89.01 156.1 19.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.006 0.432 . . . . 54.340000000000003 110.271 -179.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.1 mm -91.94 124.54 44.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 116.007 -0.542 . . . . 75.549999999999997 110.425 -179.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.587 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 27.4 mmmt -100.82 155.2 18.06 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.872 -0.788 . . . . 73.329999999999998 108.872 177.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.564 HG22 ' HD3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -133.45 102.18 5.43 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.177 0.513 . . . . 61.119999999999997 111.426 177.088 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.544 ' CD2' HD13 ' A' ' 66' ' ' LEU . 84.6 m-85 -108.35 119.83 40.63 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.804 -0.634 . . . . 74.450000000000003 110.448 177.327 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 32.6 t -97.06 -13.57 22.15 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.761 -0.654 . . . . 63.32 110.005 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -130.21 154.54 47.45 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.715 -0.675 . . . . 71.099999999999994 110.296 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.403 HD23 ' O ' ' A' ' 63' ' ' LEU . 10.4 tt -83.23 -24.36 32.37 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.409 -0.589 . . . . 73.430000000000007 109.409 -178.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -54.18 -52.72 60.29 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.443 -0.798 . . . . 60.020000000000003 111.013 -178.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.8 m -69.75 -44.13 70.84 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.96 -0.564 . . . . 72.430000000000007 111.346 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.544 HD13 ' CD2' ' A' ' 60' ' ' PHE . 54.6 tp -65.74 -35.87 81.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.429 -0.35 . . . . 63.100000000000001 111.379 -174.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.428 ' HE ' ' HB3' ' A' ' 67' ' ' ARG . 17.7 ttp180 -58.11 -41.85 84.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.957 0.408 . . . . 73.299999999999997 110.342 176.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -72.4 -32.0 66.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.967 -0.561 . . . . 70.450000000000003 110.688 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.486 ' HA ' HE21 ' A' ' 72' ' ' GLN . 31.6 t80 -65.31 -44.86 86.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.907 -0.588 . . . . 74.109999999999999 109.907 177.392 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.73 -24.57 61.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.192 -0.458 . . . . 53.109999999999999 111.399 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.761 ' HA ' ' HE2' ' A' ' 77' ' ' LYS . 70.4 m -73.42 -18.78 61.1 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.599 -0.273 . . . . 65.450000000000003 111.294 -179.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.486 HE21 ' HA ' ' A' ' 69' ' ' PHE . 29.7 pt20 -106.52 4.1 27.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.367 0.604 . . . . 75.200000000000003 110.194 176.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 56.3 mmtt -105.11 107.58 18.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.599 -0.728 . . . . 71.349999999999994 110.183 177.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.3 t -56.89 -33.0 66.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.976 0.417 . . . . 65.219999999999999 110.598 -178.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.8 p -80.87 -52.12 7.83 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.123 -0.49 . . . . 74.409999999999997 111.293 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.618 ' HA ' HD13 ' A' ' 79' ' ' LEU . 72.9 mtp -67.76 -12.77 61.25 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.843 0.354 . . . . 64.150000000000006 111.578 -177.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.761 ' HE2' ' HA ' ' A' ' 71' ' ' SER . 16.7 mmtt -61.83 -25.96 67.83 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.072 -0.513 . . . . 62.229999999999997 110.513 174.181 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.448 ' O ' ' HE2' ' A' ' 81' ' ' LYS . 3.6 mm-40 -94.95 -5.31 45.02 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.411 0.625 . . . . 74.310000000000002 110.131 -178.581 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.618 HD13 ' HA ' ' A' ' 76' ' ' MET . 8.5 mp -92.43 -56.84 2.89 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.265 -0.88 . . . . 74.430000000000007 110.094 178.1 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.821 ' HB3' HD13 ' A' ' 84' ' ' LEU . 3.7 mm? -83.22 -4.47 58.44 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.023 -0.535 . . . . 62.0 111.752 -174.133 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.539 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 64.9 pttt -56.46 -18.5 11.57 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.611 0.597 . . . . 74.409999999999997 112.611 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -76.25 -26.03 55.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.76 0.314 . . . . 74.25 111.55 -177.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 7.5 p -116.14 -28.51 2.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.84 0.352 . . . . 71.140000000000001 111.375 -177.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.821 HD13 ' HB3' ' A' ' 80' ' ' LEU . 8.8 mp . . . . . 0 C--N 1.328 -0.342 0 N-CA-C 109.76 -0.459 . . . . 64.129999999999995 109.76 177.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 45.5 p90 . . . . . 0 N--CA 1.454 -0.248 0 CA-C-O 120.967 0.413 . . . . 65.109999999999999 110.016 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 132' ' ' ASN . . . . . 0.54 ' O ' ' HB3' ' B' ' 135' ' ' ARG . 8.1 t30 -67.47 -35.43 79.17 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.115 -0.493 . . . . 72.420000000000002 110.137 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 133' ' ' ILE . . . . . 0.442 HG21 ' HB3' ' A' ' 79' ' ' LEU . 46.4 mm -64.32 -41.03 91.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.204 0.526 . . . . 75.450000000000003 110.231 175.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.419 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 91.4 mt -70.42 -22.06 62.76 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.926 -0.579 . . . . 73.040000000000006 110.363 177.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.54 ' HB3' ' O ' ' B' ' 132' ' ' ASN . 22.6 ttt180 -68.71 -51.54 40.42 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.679 -0.489 . . . . 74.310000000000002 109.679 171.447 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 136' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 69.7 mm-40 -55.36 -48.74 73.8 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.248 -0.887 . . . . 75.540000000000006 111.508 -179.744 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -87.82 0.64 55.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.47 . . . . 72.450000000000003 111.174 -177.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 33.2 t70 52.14 63.46 2.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.643 0.735 . . . . 74.510000000000005 111.95 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 139' ' ' PHE . . . . . 0.419 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 4.0 m-85 -93.16 0.81 57.28 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.485 -0.779 . . . . 74.120000000000005 109.835 174.081 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 74.3 81.97 0.14 Allowed Pre-proline 0 N--CA 1.465 0.294 0 O-C-N 124.328 1.017 . . . . 73.540000000000006 110.679 -176.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -85.27 127.81 3.45 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 122.521 2.147 . . . . 65.099999999999994 112.904 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 115.885 -0.598 . . . . 75.310000000000002 110.017 174.914 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.513 -0.446 0 N-CA-C 108.543 -0.91 . . . . 73.310000000000002 108.543 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.646 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.8 mp -70.0 91.48 0.68 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.268 -0.424 . . . . 71.420000000000002 109.934 -178.376 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.702 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -93.02 61.05 3.39 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.656 -0.498 . . . . 71.530000000000001 109.656 175.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 151' ' ' PHE . . . . . 0.646 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 50.5 p90 -88.93 165.7 14.42 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.661 -0.699 . . . . 73.430000000000007 110.711 -176.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 152' ' ' LYS . . . . . 0.583 ' HE2' ' HA2' ' B' ' 155' ' ' GLY . 57.9 tttt -98.03 115.87 29.09 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.079 -0.51 . . . . 74.120000000000005 110.172 -178.082 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 153' ' ' CYS . . . . . . . . . . . . . 53.6 t -117.68 103.38 9.97 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.236 -0.438 . . . . 60.329999999999998 110.147 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 65.89 29.14 10.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.444 -0.798 . . . . 74.010000000000005 111.374 175.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 155' ' ' GLY . . . . . 0.583 ' HA2' ' HE2' ' B' ' 152' ' ' LYS . . . 108.5 -33.35 6.28 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.525 -0.845 . . . . 31.120000000000001 112.987 176.495 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 156' ' ' GLU . . . . . 0.571 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 10.1 pt-20 -99.6 140.3 34.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.911 0.386 . . . . 65.209999999999994 110.92 -178.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 50.9 mm -76.63 120.56 27.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.045 -0.525 . . . . 75.540000000000006 110.173 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 158' ' ' LYS . . . . . 0.571 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 29.9 mmmt -110.54 110.05 20.62 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.827 -0.435 . . . . 74.219999999999999 109.827 -177.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . 0.466 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.5 OUTLIER -87.82 126.77 35.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.086 0.47 . . . . 55.119999999999997 111.954 -178.75 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -130.27 124.78 33.19 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.783 -0.644 . . . . 74.209999999999994 110.592 177.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 34.3 t -112.51 -5.94 14.0 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.789 -0.642 . . . . 62.240000000000002 109.899 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -137.8 163.37 31.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.031 -0.531 . . . . 65.140000000000001 109.997 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 91.5 mt -97.92 1.41 48.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.424 -0.353 . . . . 63.140000000000001 111.583 -176.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -82.47 -53.08 6.27 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.371 -0.604 . . . . 72.329999999999998 109.371 178.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 15.1 m -62.96 -38.89 92.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.74 -0.663 . . . . 54.43 110.039 176.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 53.2 tp -67.66 -35.85 79.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.621 -0.718 . . . . 63.520000000000003 110.951 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 54.4 ttp180 -61.09 -46.04 92.28 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.989 0.423 . . . . 73.540000000000006 109.944 178.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -63.38 -41.31 98.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.632 -0.713 . . . . 64.0 110.611 178.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 169' ' ' PHE . . . . . 0.754 ' HA ' HE21 ' B' ' 172' ' ' GLN . 51.7 t80 -65.32 -46.64 79.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.7 -0.682 . . . . 72.120000000000005 110.985 -178.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -66.23 -28.38 68.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.361 -0.381 . . . . 61.119999999999997 111.373 -178.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 40.2 m -75.28 -34.06 61.3 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.52 -0.309 . . . . 72.129999999999995 111.305 -178.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . 0.754 HE21 ' HA ' ' B' ' 169' ' ' PHE . 29.6 pt20 -81.97 -25.56 34.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.247 0.546 . . . . 74.120000000000005 110.229 178.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 58.0 mmtt -81.25 109.11 15.46 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.587 -0.733 . . . . 71.450000000000003 110.762 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 11.8 t -67.2 -24.36 65.84 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.074 -0.713 . . . . 72.109999999999999 109.074 176.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 4.8 m -82.68 -12.26 57.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.411 -0.813 . . . . 73.420000000000002 111.617 -179.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.426 ' O ' ' HB2' ' B' ' 179' ' ' LEU . 79.1 mtp -121.77 -10.05 8.77 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.924 0.392 . . . . 71.049999999999997 111.441 -179.203 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 177' ' ' LYS . . . . . 0.403 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 89.0 tttt -64.81 -34.99 79.65 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.083 -0.508 . . . . 72.409999999999997 111.056 -177.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -84.43 -6.67 59.4 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 122.001 0.905 . . . . 65.540000000000006 109.494 -176.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 179' ' ' LEU . . . . . 0.488 ' HB3' HG21 ' A' ' 33' ' ' ILE . 11.0 mp -90.33 -56.29 3.27 Favored 'General case' 0 N--CA 1.438 -1.06 0 CA-C-N 114.054 -1.43 . . . . 73.540000000000006 109.801 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.01 -10.64 56.78 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.782 -0.644 . . . . 63.229999999999997 112.242 -173.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 181' ' ' LYS . . . . . 0.439 ' HA ' ' HB2' ' B' ' 184' ' ' LEU . 64.0 pttt -64.8 -5.92 6.97 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.405 -0.518 . . . . 73.019999999999996 111.493 178.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -74.75 -30.99 61.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.201 -0.454 . . . . 62.130000000000003 110.434 175.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 10.7 p -104.58 -18.87 6.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 52.329999999999998 110.764 -178.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 184' ' ' LEU . . . . . 0.439 ' HB2' ' HA ' ' B' ' 181' ' ' LYS . 9.1 mp . . . . . 0 C--N 1.33 -0.258 0 N-CA-C 109.898 -0.408 . . . . 74.430000000000007 109.898 176.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.438 ' HB3' HD11 ' B' ' 149' ' ' LEU . 53.1 p90 . . . . . 0 CA--C 1.52 -0.189 0 CA-C-O 120.713 0.292 . . . . 74.420000000000002 110.99 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.554 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 8.7 t30 -62.96 -57.23 11.45 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.211 -0.449 . . . . 60.130000000000003 111.478 -172.348 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.586 HG21 ' HB3' ' B' ' 179' ' ' LEU . 4.2 mp -65.35 -37.2 79.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.142 0.496 . . . . 71.109999999999999 110.985 -176.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.0 mt -63.92 -32.37 73.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.978 -0.555 . . . . 64.120000000000005 110.527 178.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -77.08 -29.16 54.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.745 -0.661 . . . . 72.400000000000006 110.417 178.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 95.6 mt-10 -70.21 -47.98 59.08 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.073 -0.512 . . . . 74.549999999999997 110.952 177.567 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -92.13 6.09 47.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.067 -0.515 . . . . 70.430000000000007 111.536 -175.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 57.2 60.67 2.84 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 113.089 0.774 . . . . 71.120000000000005 113.089 177.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -86.32 -1.1 57.21 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.883 -0.784 . . . . 75.400000000000006 108.883 167.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 60.43 78.15 0.34 Allowed Pre-proline 0 C--O 1.235 0.291 0 CA-C-N 114.333 -1.303 . . . . 64.219999999999999 110.946 -179.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -79.14 161.77 26.14 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.639 2.226 . . . . 72.019999999999996 111.529 177.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.7 mptt . . . . . 0 C--N 1.322 -0.626 0 CA-C-O 121.146 0.498 . . . . 72.030000000000001 111.63 -179.174 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.505 -0.765 0 N-CA-C 108.947 -0.76 . . . . 62.100000000000001 108.947 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.779 HD11 ' HB3' ' B' ' 131' ' ' PHE . 9.6 tp -66.01 -33.25 75.37 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.973 -0.751 . . . . 75.319999999999993 108.973 175.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.548 ' HB3' ' HG2' ' B' ' 142' ' ' LYS . . . 43.09 43.43 3.76 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 124.484 1.115 . . . . 75.099999999999994 112.639 169.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 41.6 p90 -84.55 165.08 18.33 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.061 -0.518 . . . . 51.420000000000002 110.544 -176.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -101.17 115.26 30.08 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.048 -0.524 . . . . 74.219999999999999 110.561 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.608 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 42.5 t -108.37 102.3 11.42 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.782 -0.644 . . . . 73.400000000000006 109.844 178.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.4 t70 68.2 8.39 6.53 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.878 -0.601 . . . . 72.200000000000003 111.435 174.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 129.52 -32.06 3.28 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.476 -0.869 . . . . 75.140000000000001 112.654 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.763 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 11.6 pt-20 -92.71 141.65 28.23 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.783 0.325 . . . . 74.109999999999999 110.602 -178.644 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.4 mm -85.88 120.71 36.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.708 -0.478 . . . . 72.319999999999993 109.708 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.763 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 26.7 mmmt -108.4 119.22 38.88 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.032 0.444 . . . . 73.129999999999995 110.634 -177.567 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.4 p -95.5 108.58 20.82 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.34 0.591 . . . . 65.25 111.838 -179.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -129.71 145.98 51.5 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.4 -0.818 . . . . 74.340000000000003 109.616 176.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.6 m -131.24 14.51 5.11 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.031 0.443 . . . . 71.099999999999994 110.576 178.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -152.3 173.14 15.4 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.991 -0.55 . . . . 71.340000000000003 109.631 177.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.1 mt -90.53 -25.68 20.12 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.264 0.468 . . . . 72.510000000000005 112.264 -174.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 51.0 tp60 -73.23 -43.55 61.02 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.651 0.262 . . . . 71.239999999999995 110.786 -173.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.0 p -68.09 -40.85 82.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.231 -0.44 . . . . 71.430000000000007 110.672 179.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.482 HD23 ' O ' ' A' ' 66' ' ' LEU . 6.3 tt -67.35 -36.65 81.82 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.05 -0.523 . . . . 72.5 109.969 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.642 ' HG3' HD13 ' A' ' 84' ' ' LEU . 66.7 ttt180 -58.21 -34.51 70.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.953 -0.567 . . . . 73.329999999999998 110.618 -179.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -59.27 -51.81 68.35 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.909 -0.587 . . . . 74.439999999999998 110.59 175.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -70.8 -45.94 63.73 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.024 -0.989 . . . . 72.519999999999996 111.195 -174.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.59 -31.22 71.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.298 -0.41 . . . . 62.200000000000003 111.859 -178.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.7 t -72.79 -40.88 65.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.706 0.289 . . . . 65.319999999999993 110.933 -178.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -82.85 -12.77 57.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.012 0.434 . . . . 74.439999999999998 111.226 -176.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.608 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 31.0 mmmt -80.78 143.37 32.92 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.244 -0.434 . . . . 74.25 110.141 174.216 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 5.5 m -77.18 -46.43 23.38 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.085 0.469 . . . . 61.299999999999997 109.949 178.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 14.0 p -70.15 -50.23 42.59 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.756 -0.657 . . . . 74.25 111.413 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.55 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 68.2 mtp -66.36 -20.13 65.99 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.409 -0.359 . . . . 74.450000000000003 111.571 -175.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 4.5 ttmp? -61.23 -31.76 71.55 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.017 0.437 . . . . 61.240000000000002 110.492 177.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -97.36 1.42 49.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.452 0.644 . . . . 50.310000000000002 110.585 -177.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.476 ' HB3' HG21 ' B' ' 133' ' ' ILE . 81.4 mt -98.12 -47.59 5.43 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.377 -0.828 . . . . 64.430000000000007 109.433 177.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.577 ' HB3' HD12 ' A' ' 84' ' ' LEU . 4.2 mm? -85.5 -8.57 58.27 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.492 -0.776 . . . . 65.129999999999995 111.463 -177.035 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -56.84 -20.63 23.82 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.868 0.366 . . . . 54.509999999999998 111.284 176.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -72.73 -45.54 58.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.192 -0.458 . . . . 74.109999999999999 111.46 -176.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 27.1 m -105.67 -22.6 4.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 112.494 0.553 . . . . 74.5 112.494 -174.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.642 HD13 ' HG3' ' A' ' 67' ' ' ARG . 94.2 mt . . . . . 0 C--N 1.324 -0.537 0 C-N-CA 120.753 -0.379 . . . . 70.319999999999993 110.107 -179.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 131' ' ' PHE . . . . . 0.779 ' HB3' HD11 ' A' ' 49' ' ' LEU . 53.8 p90 . . . . . 0 CA--C 1.52 -0.176 0 CA-C-O 120.743 0.306 . . . . 74.450000000000003 110.823 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 132' ' ' ASN . . . . . 0.409 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 7.5 t30 -62.79 -50.63 70.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.018 -0.537 . . . . 73.329999999999998 111.151 -173.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 133' ' ' ILE . . . . . 0.476 HG21 ' HB3' ' A' ' 79' ' ' LEU . 3.4 mp -68.39 -41.52 83.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.176 0.512 . . . . 73.219999999999999 110.456 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.409 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 88.8 mt -62.95 -29.22 70.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.739 -0.664 . . . . 43.229999999999997 111.172 -178.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -72.02 -40.11 68.7 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.197 -0.456 . . . . 70.430000000000007 110.692 179.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 136' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 9.6 mm-40 -72.8 -32.09 65.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.13 -0.486 . . . . 70.439999999999998 110.79 -178.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -95.48 3.72 53.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.005 -0.543 . . . . 72.510000000000005 111.072 -179.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 53.19 58.14 5.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.435 -0.802 . . . . 74.409999999999997 112.8 177.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 139' ' ' PHE . . . . . 0.409 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 3.4 m-85 -89.31 -1.07 57.92 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.282 0.563 . . . . 63.020000000000003 109.604 170.472 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 63.58 84.05 0.19 Allowed Pre-proline 0 C--O 1.233 0.225 0 CA-C-N 114.508 -1.224 . . . . 74.430000000000007 111.534 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . 0.488 ' HB3' ' HB2' ' B' ' 131' ' ' PHE . 60.0 Cg_endo -75.19 132.83 15.6 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.463 2.109 . . . . 52.32 110.604 172.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 142' ' ' LYS . . . . . 0.548 ' HG2' ' HB3' ' A' ' 50' ' ' ALA . 0.2 OUTLIER . . . . . 0 C--N 1.324 -0.533 0 N-CA-C 112.605 0.595 . . . . 74.329999999999998 112.605 -173.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . 0.416 ' HE3' ' HB2' ' B' ' 150' ' ' ALA . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.489 0 N-CA-C 109.896 -0.409 . . . . 71.25 109.896 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.628 ' HB3' ' HD1' ' B' ' 151' ' ' PHE . 4.2 mm? -53.44 -46.15 69.74 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 123.48 0.488 . . . . 72.140000000000001 109.963 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.416 ' HB2' ' HE3' ' B' ' 148' ' ' LYS . . . 48.14 36.35 6.48 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 124.118 0.886 . . . . 22.129999999999999 111.871 174.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 151' ' ' PHE . . . . . 0.628 ' HD1' ' HB3' ' B' ' 149' ' ' LEU . 42.3 p90 -82.59 169.68 16.02 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.099 -0.5 . . . . 72.310000000000002 109.952 -178.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 28.4 ttmt -106.39 125.34 50.87 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.214 -0.448 . . . . 65.340000000000003 110.581 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 153' ' ' CYS . . . . . . . . . . . . . 35.4 t -124.96 105.2 9.03 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.279 -0.637 . . . . 60.539999999999999 109.279 177.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 34.7 t70 67.19 28.6 8.09 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.529 0.68 . . . . 62.009999999999998 110.81 176.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 107.12 -35.76 4.83 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.552 -0.832 . . . . 73.209999999999994 112.877 175.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 156' ' ' GLU . . . . . 0.401 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 10.7 pt-20 -92.87 145.26 24.52 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.047 0.451 . . . . 54.32 110.762 -177.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 50.0 mm -84.74 125.13 40.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.755 -0.657 . . . . 54.240000000000002 110.06 -179.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 158' ' ' LYS . . . . . 0.401 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 28.6 mmmt -106.17 110.77 23.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.141 0.496 . . . . 72.310000000000002 110.063 -178.579 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -98.34 107.49 19.97 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.924 -0.58 . . . . 72.109999999999999 112.119 -175.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -131.53 151.97 51.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.54 -0.755 . . . . 75.439999999999998 109.928 176.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 64.3 m -131.29 5.63 4.45 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.346 0.594 . . . . 63.149999999999999 109.89 173.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -125.4 145.13 50.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.541 -0.754 . . . . 64.310000000000002 109.894 -179.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.58 -35.11 70.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.098 0.475 . . . . 51.109999999999999 109.776 178.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 164' ' ' GLN . . . . . 0.473 ' O ' ' HG2' ' B' ' 168' ' ' LYS . 50.5 tp60 -66.72 -42.73 85.86 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.934 -0.575 . . . . 72.140000000000001 111.414 -176.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 10.3 p -69.6 -39.22 77.38 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.846 0.355 . . . . 64.129999999999995 110.925 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 54.0 tp -65.53 -36.24 83.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.964 0.412 . . . . 72.420000000000002 109.973 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . 0.429 ' HB3' ' O ' ' B' ' 164' ' ' GLN . 61.4 ttt180 -57.29 -39.84 76.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.711 -0.677 . . . . 74.400000000000006 110.57 174.176 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 168' ' ' LYS . . . . . 0.491 ' HB3' ' NZ ' ' B' ' 168' ' ' LYS . 2.8 mmmp? -60.39 -39.24 86.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.717 -0.674 . . . . 62.350000000000001 110.91 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -77.66 -45.02 26.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.081 -0.509 . . . . 64.209999999999994 110.799 -178.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 170' ' ' ALA . . . . . 0.755 ' HB2' HD12 ' B' ' 180' ' ' LEU . . . -59.19 -38.1 79.02 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.115 -0.493 . . . . 75.430000000000007 111.666 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 8.7 t -65.55 -31.68 72.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.092 -0.504 . . . . 72.319999999999993 111.157 -176.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -94.17 4.62 53.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.988 0.423 . . . . 71.439999999999998 110.718 -179.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -105.55 140.84 38.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.23 -0.441 . . . . 74.549999999999997 110.477 177.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.4 p -67.26 -54.92 16.47 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.994 -0.548 . . . . 71.219999999999999 111.166 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 175' ' ' SER . . . . . 0.444 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 25.0 p -76.55 -46.99 24.06 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.829 -0.623 . . . . 71.430000000000007 111.653 -174.548 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 69.8 mtp -66.49 -21.59 66.18 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.127 0.417 . . . . 74.230000000000004 112.127 -174.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 177' ' ' LYS . . . . . 0.417 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 4.2 ttmp? -64.94 -29.26 70.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.21 0.528 . . . . 63.119999999999997 109.828 176.132 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -94.7 -13.77 25.45 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 115.578 -0.737 . . . . 62.539999999999999 110.084 -176.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 179' ' ' LEU . . . . . 0.586 ' HB3' HG21 ' A' ' 33' ' ' ILE . 81.6 mt -86.71 -47.94 8.7 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.389 -0.823 . . . . 60.450000000000003 109.823 178.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 180' ' ' LEU . . . . . 0.755 HD12 ' HB2' ' B' ' 170' ' ' ALA . 8.9 mt -89.81 -2.17 58.16 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.759 -0.655 . . . . 64.450000000000003 111.339 -173.212 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 181' ' ' LYS . . . . . 0.417 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 64.1 pttt -64.92 -9.07 18.41 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.298 0.571 . . . . 74.420000000000002 110.518 173.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -61.71 -33.88 74.81 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.571 -0.741 . . . . 55.25 109.914 175.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 14.3 p -113.15 -29.4 2.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 115.845 -0.616 . . . . 62.5 110.99 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 184' ' ' LEU . . . . . . . . . . . . . 91.8 mt . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 116.431 -0.35 . . . . 75.030000000000001 110.975 -176.796 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 13.4 p90 . . . . . 0 C--O 1.233 0.186 0 CA-C-O 121.145 0.497 . . . . 70.219999999999999 110.292 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -65.38 -43.04 92.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.548 -0.751 . . . . 72.519999999999996 111.074 -176.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.839 HG21 ' HB3' ' B' ' 179' ' ' LEU . 38.5 mm -60.41 -40.27 83.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-O 121.478 0.656 . . . . 72.400000000000006 110.594 177.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.705 HD12 HD21 ' B' ' 149' ' ' LEU . 82.9 mt -69.23 -25.84 64.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.489 -0.778 . . . . 73.099999999999994 110.71 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 54.1 ttt180 -67.47 -47.49 69.95 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.117 -0.492 . . . . 71.549999999999997 110.085 175.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -64.11 -39.3 93.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.499 -0.773 . . . . 63.140000000000001 111.777 -177.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -97.43 8.37 44.74 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.348 -0.387 . . . . 52.299999999999997 111.036 -175.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 14.3 t70 53.32 64.38 1.87 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.213 -0.903 . . . . 70.400000000000006 111.949 177.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.667 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 16.8 m-85 -92.82 -6.24 49.29 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.307 -0.627 . . . . 73.099999999999994 109.307 167.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 69.43 88.43 0.1 Allowed Pre-proline 0 CA--C 1.53 0.182 0 CA-C-N 114.789 -1.096 . . . . 71.200000000000003 111.233 -178.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.443 ' HA ' HD11 ' B' ' 149' ' ' LEU . 16.8 Cg_exo -67.23 135.03 35.63 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.633 2.222 . . . . 71.420000000000002 110.505 174.119 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.657 ' H ' HD12 ' B' ' 149' ' ' LEU . 33.4 tptt . . . . . 0 C--N 1.329 -0.322 0 C-N-CA 120.284 -0.566 . . . . 53.130000000000003 111.565 -171.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.451 -0.396 0 N-CA-C 109.637 -0.505 . . . . 61.200000000000003 109.637 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.735 ' HB3' ' HD1' ' A' ' 51' ' ' PHE . 7.1 mp -57.74 -44.77 86.29 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.334 0.494 . . . . 72.450000000000003 112.334 -173.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.858 ' HB3' ' HD2' ' B' ' 142' ' ' LYS . . . 39.49 49.48 1.94 Allowed 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.806 0.691 . . . . 74.340000000000003 111.85 -179.422 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.735 ' HD1' ' HB3' ' A' ' 49' ' ' LEU . 48.4 p90 -88.48 167.92 13.05 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.889 -0.596 . . . . 74.420000000000002 110.415 -175.467 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.411 ' HE3' ' HB2' ' A' ' 52' ' ' LYS . 29.3 ttmt -99.68 115.0 28.46 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.223 0.535 . . . . 74.519999999999996 110.809 -178.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.553 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 34.9 t -110.47 95.23 5.44 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.668 -0.696 . . . . 74.340000000000003 110.018 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 69.08 12.45 8.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.998 -1.001 . . . . 43.549999999999997 112.3 176.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 138.78 -40.87 1.41 Allowed Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.523 -0.846 . . . . 44.210000000000001 112.675 176.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.485 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 9.8 pt-20 -96.42 150.91 20.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.106 0.479 . . . . 73.019999999999996 111.157 -175.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.6 mm -83.44 120.57 34.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.585 -0.734 . . . . 45.399999999999999 110.533 178.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.555 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 29.1 mmmt -106.25 106.92 17.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.02 -0.536 . . . . 73.150000000000006 110.124 -179.574 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -81.44 98.49 8.26 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.952 0.406 . . . . 74.140000000000001 111.256 178.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.555 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 41.3 m-85 -117.74 138.26 52.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.228 -0.442 . . . . 73.329999999999998 110.953 179.455 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 4.3 p -136.78 3.96 2.76 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.565 -0.743 . . . . 53.310000000000002 109.979 175.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.464 ' OD2' ' HB3' ' A' ' 64' ' ' GLN . 29.9 t70 -125.18 122.44 37.07 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.416 -0.811 . . . . 65.310000000000002 109.965 -178.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.1 tt -66.98 -42.82 84.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 72.430000000000007 110.032 -176.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.464 ' HB3' ' OD2' ' A' ' 62' ' ' ASP . 6.8 tt0 -51.77 -50.69 60.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.815 -0.629 . . . . 74.230000000000004 111.376 -179.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 10.5 m -69.21 -38.02 78.36 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.855 -0.611 . . . . 60.229999999999997 110.934 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.5 tp -68.79 -38.68 80.16 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.234 -0.439 . . . . 62.200000000000003 111.001 -178.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -57.28 -43.15 82.85 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.076 -0.511 . . . . 73.040000000000006 111.135 179.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -63.48 -40.43 97.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 72.420000000000002 110.429 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.506 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 81.3 t80 -67.55 -42.41 82.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.757 -0.656 . . . . 75.430000000000007 110.598 179.124 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.98 -32.52 73.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.998 -0.547 . . . . 72.319999999999993 111.293 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.4 m -71.61 -31.81 67.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.401 -0.363 . . . . 63.140000000000001 111.377 -179.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.506 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 20.6 pt20 -85.21 -9.5 57.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.229 0.538 . . . . 54.130000000000003 110.394 179.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.553 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 28.3 mmmt -93.42 111.24 22.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.713 -0.676 . . . . 73.299999999999997 109.651 174.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.6 m -55.55 -37.11 67.56 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.669 0.271 . . . . 74.310000000000002 111.137 -178.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.548 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 21.6 m -75.33 -42.92 53.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.569 -0.287 . . . . 71.430000000000007 111.325 -178.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.464 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 80.8 mtp -77.87 -24.16 48.6 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.659 0.266 . . . . 72.219999999999999 111.614 -174.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -60.13 -36.7 78.08 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.853 0.359 . . . . 73.409999999999997 111.31 -179.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -84.42 -16.11 43.81 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.953 0.883 . . . . 72.310000000000002 109.473 -174.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 75' ' ' SER . 59.6 mt -81.1 -51.78 8.09 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 114.312 -1.313 . . . . 54.399999999999999 109.697 178.366 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 80' ' ' LEU . 4.2 mm? -78.49 -30.45 47.24 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.374 -0.83 . . . . 72.200000000000003 112.638 -174.001 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -64.53 -10.18 24.09 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 118.367 0.531 . . . . 72.040000000000006 112.003 -173.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -75.55 -39.66 57.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.912 0.387 . . . . 73.310000000000002 110.98 -177.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 27.7 m -114.59 -5.92 11.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.091 -0.504 . . . . 70.319999999999993 110.92 -178.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 67.9 tp . . . . . 0 C--N 1.321 -0.649 0 CA-C-N 115.777 -0.647 . . . . 75.340000000000003 109.841 -178.849 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 48.3 p90 . . . . . 0 N--CA 1.456 -0.164 0 N-CA-C 111.775 0.287 . . . . 65.239999999999995 111.775 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 132' ' ' ASN . . . . . 0.544 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 63.7 t30 -59.75 -50.25 74.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.096 0.474 . . . . 72.140000000000001 110.201 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 133' ' ' ILE . . . . . 0.545 ' CG2' ' HB3' ' A' ' 79' ' ' LEU . 46.8 mm -59.38 -48.19 87.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.679 -0.691 . . . . 73.239999999999995 110.966 -179.033 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 80.9 mt -57.86 -36.58 72.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.022 -0.535 . . . . 73.140000000000001 111.263 177.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 36.9 ttt180 -67.17 -44.21 80.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.231 -0.44 . . . . 75.340000000000003 110.532 179.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 136' ' ' GLU . . . . . 0.544 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 10.6 mm-40 -68.3 -39.67 81.98 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.923 -0.581 . . . . 73.420000000000002 111.562 -178.046 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 52.4 m-80 -90.0 5.16 47.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.996 0.427 . . . . 74.519999999999996 110.695 -179.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 11.8 t70 56.53 57.03 5.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.112 -0.949 . . . . 74.400000000000006 112.19 173.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -90.61 8.9 31.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.791 -0.64 . . . . 72.049999999999997 109.996 173.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 60.61 80.93 0.25 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 114.926 -1.034 . . . . 73.420000000000002 111.488 -176.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -71.15 156.12 60.02 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 121.732 1.622 . . . . 61.329999999999998 109.831 171.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 142' ' ' LYS . . . . . 0.858 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.551 0 C-N-CA 120.239 -0.585 . . . . 70.230000000000004 111.739 -176.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.59 0 N-CA-C 108.14 -1.059 . . . . 74.209999999999994 108.14 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.705 HD21 HD12 ' A' ' 34' ' ' LEU . 63.0 tp -73.68 85.79 1.64 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.101 -0.5 . . . . 75.209999999999994 110.173 -176.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -90.71 86.51 6.37 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.366 -0.833 . . . . 73.219999999999999 110.485 178.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 151' ' ' PHE . . . . . 0.599 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 51.6 p90 -103.24 171.23 7.49 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.934 -0.575 . . . . 65.430000000000007 109.785 178.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -106.5 125.76 51.41 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.088 0.47 . . . . 54.240000000000002 111.009 -179.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 153' ' ' CYS . . . . . 0.43 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 48.6 t -122.09 104.29 9.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.74 -0.663 . . . . 72.230000000000004 109.746 176.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 65.38 26.48 12.0 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.809 -0.632 . . . . 65.129999999999995 111.504 176.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 114.94 -35.95 4.15 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.719 -0.753 . . . . 53.210000000000001 113.148 176.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -92.64 145.13 24.66 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.971 0.415 . . . . 73.239999999999995 110.909 -176.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.2 mm -83.0 131.31 34.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.893 -0.594 . . . . 64.450000000000003 109.669 175.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 158' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -117.05 100.7 7.92 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.319 -0.401 . . . . 55.549999999999997 110.468 -177.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.09 103.45 10.91 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.127 0.489 . . . . 44.310000000000002 111.318 178.313 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -116.6 113.87 23.31 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.962 -0.563 . . . . 74.310000000000002 110.84 177.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 14.5 m -103.79 -0.14 29.66 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.454 0.645 . . . . 60.299999999999997 109.753 174.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 162' ' ' ASP . . . . . 0.418 ' OD2' ' HB3' ' B' ' 164' ' ' GLN . 0.3 OUTLIER -133.65 141.78 47.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.3 -0.864 . . . . 73.140000000000001 110.612 -175.936 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 44.8 tp -71.6 -34.33 69.8 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.952 -0.567 . . . . 74.340000000000003 111.341 -177.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 164' ' ' GLN . . . . . 0.467 ' O ' ' HG3' ' B' ' 168' ' ' LYS . 6.4 tt0 -60.09 -49.19 78.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.071 0.462 . . . . 73.109999999999999 110.238 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 20.9 m -58.43 -42.5 87.43 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.559 -0.746 . . . . 63.420000000000002 111.21 178.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 67.4 tp -68.66 -40.34 80.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.451 -0.341 . . . . 64.319999999999993 110.756 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . 1.098 ' HG3' HD21 ' B' ' 184' ' ' LEU . 15.1 ttp180 -61.11 -44.64 97.03 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.357 -0.383 . . . . 74.140000000000001 110.38 -178.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 168' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' B' ' 164' ' ' GLN . 48.9 mtmt -60.32 -29.77 69.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.978 -0.555 . . . . 71.140000000000001 111.317 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -84.7 -50.19 7.84 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.337 -0.392 . . . . 54.229999999999997 110.762 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.53 -32.82 74.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.084 -0.507 . . . . 70.420000000000002 111.968 -176.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 17.6 t -69.6 -19.0 63.66 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.886 0.328 . . . . 71.549999999999997 111.886 -176.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -104.88 2.34 29.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.912 0.387 . . . . 74.420000000000002 110.485 177.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 173' ' ' LYS . . . . . 0.43 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 29.6 mmmt -103.04 111.48 23.84 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.767 -0.651 . . . . 72.519999999999996 110.056 179.003 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 69.5 m -55.41 -34.38 64.34 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.8 0.333 . . . . 75.120000000000005 111.775 -178.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 175' ' ' SER . . . . . 0.46 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 6.8 m -77.03 -46.49 23.56 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.899 0.38 . . . . 75.129999999999995 110.975 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.401 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 73.9 mtp -78.31 -21.97 48.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.588 -0.278 . . . . 74.019999999999996 111.471 -173.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 177' ' ' LYS . . . . . 0.473 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 79.2 tttt -58.65 -37.46 76.01 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.164 0.507 . . . . 74.099999999999994 110.393 178.283 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -85.36 -13.95 47.9 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.6 0.714 . . . . 72.120000000000005 109.916 -175.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 179' ' ' LEU . . . . . 0.839 ' HB3' HG21 ' A' ' 33' ' ' ILE . 59.3 mt -84.28 -50.03 8.23 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 114.674 -1.148 . . . . 75.140000000000001 110.351 -179.296 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -88.84 -20.09 25.08 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.594 0.59 . . . . 71.030000000000001 112.594 -173.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 181' ' ' LYS . . . . . 0.473 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 62.7 pttt -59.95 -18.41 45.09 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.2 0.445 . . . . 64.310000000000002 112.2 -174.287 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -55.76 -49.42 73.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.004 0.43 . . . . 64.329999999999998 110.879 -177.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 18.4 m -109.71 3.66 9.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.768 -0.651 . . . . 42.43 110.48 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 184' ' ' LEU . . . . . 1.098 HD21 ' HG3' ' B' ' 167' ' ' ARG . 46.1 tp . . . . . 0 N--CA 1.447 -0.614 0 CA-C-N 115.956 -0.565 . . . . 73.299999999999997 110.352 -175.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 44.3 p90 . . . . . 0 N--CA 1.474 0.735 0 N-CA-C 112.887 0.699 . . . . 73.450000000000003 112.887 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -61.72 -53.33 57.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 64.239999999999995 111.108 -174.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.509 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 48.9 mm -59.3 -43.65 90.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.924 -0.58 . . . . 73.450000000000003 110.832 -177.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 86.5 mt -63.26 -35.13 79.33 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.759 -0.655 . . . . 74.409999999999997 111.012 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.439 HH11 ' HD3' ' A' ' 35' ' ' ARG . 35.0 ttt180 -70.58 -46.6 63.17 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.92 0.391 . . . . 64.349999999999994 110.322 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -59.21 -46.4 88.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.903 -0.59 . . . . 61.340000000000003 111.308 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -86.89 1.34 52.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.983 -0.553 . . . . 73.150000000000006 111.227 -177.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.6 t70 60.64 71.26 0.57 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.33 -0.85 . . . . 74.0 112.455 175.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -96.41 -6.8 36.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.508 -0.769 . . . . 74.430000000000007 110.105 167.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 57.84 73.69 0.72 Allowed Pre-proline 0 CA--C 1.53 0.199 0 CA-C-N 115.263 -0.881 . . . . 62.140000000000001 110.582 -176.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -78.44 150.35 25.05 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 122.918 2.412 . . . . 73.530000000000001 112.629 -177.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.554 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 5.5 mptp? . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 115.859 -0.61 . . . . 74.120000000000005 109.681 177.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.485 ' HB3' ' OG ' ' A' ' 61' ' ' SER . 0.1 OUTLIER . . . . . 0 CA--C 1.51 -0.568 0 N-CA-C 110.092 -0.336 . . . . 73.140000000000001 110.092 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.562 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.0 mp -69.64 82.06 0.42 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.155 -0.475 . . . . 52.240000000000002 109.957 175.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.454 ' H ' ' HB2' ' B' ' 142' ' ' LYS . . . -82.56 67.38 8.59 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.259 0.552 . . . . 74.310000000000002 110.365 178.14 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.562 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 49.2 p90 -97.85 164.51 12.35 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.883 -0.599 . . . . 75.140000000000001 110.672 -177.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.411 ' HD2' ' C ' ' A' ' 55' ' ' GLY . 11.2 tppt? -88.41 123.97 33.49 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.636 -0.711 . . . . 73.299999999999997 110.57 -178.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 17.6 t -141.72 119.84 12.12 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.326 -0.397 . . . . 63.149999999999999 109.954 176.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 69.99 13.9 7.87 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.711 -0.677 . . . . 73.540000000000006 112.194 177.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.411 ' C ' ' HD2' ' A' ' 52' ' ' LYS . . . 104.64 -18.53 43.95 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.33 -0.938 . . . . 54.210000000000001 112.351 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -110.37 153.04 25.5 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.86 0.362 . . . . 65.299999999999997 110.08 179.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 47.6 mm -81.31 115.48 23.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.739 -0.467 . . . . 72.340000000000003 109.739 177.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -101.19 103.17 14.19 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.403 -0.362 . . . . 70.420000000000002 110.223 -177.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.58 124.82 28.57 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.391 -0.368 . . . . 72.120000000000005 111.526 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.428 ' CE2' ' HA ' ' A' ' 66' ' ' LEU . 74.6 m-85 -124.38 104.04 8.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.144 0.497 . . . . 70.310000000000002 111.44 176.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.485 ' OG ' ' HB3' ' A' ' 48' ' ' LYS . 5.8 m -95.2 -2.81 48.92 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.389 -0.823 . . . . 73.140000000000001 109.407 173.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -130.86 136.94 49.1 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.225 -0.898 . . . . 72.340000000000003 110.783 -177.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.6 tp -81.95 -27.24 33.37 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.909 -0.587 . . . . 65.030000000000001 110.801 -177.144 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -65.91 -44.2 85.93 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.244 0.545 . . . . 75.319999999999993 110.112 -178.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.424 ' HA ' ' HZ2' ' A' ' 68' ' ' LYS . 45.5 m -65.66 -41.16 92.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.665 -0.698 . . . . 73.010000000000005 110.567 175.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.428 ' HA ' ' CE2' ' A' ' 60' ' ' PHE . 45.8 tp -61.1 -46.8 89.14 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 63.25 111.05 -178.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.449 ' HG3' HD21 ' A' ' 84' ' ' LEU . 50.3 ttt-85 -55.31 -48.34 74.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.135 -0.484 . . . . 65.109999999999999 111.063 178.292 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.424 ' HZ2' ' HA ' ' A' ' 65' ' ' SER . 9.9 mtmp? -70.52 -30.39 67.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.199 -0.455 . . . . 72.540000000000006 111.333 -177.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.514 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 81.7 t80 -70.22 -45.86 65.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.309 -0.405 . . . . 53.219999999999999 110.149 176.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.21 -30.48 71.62 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.095 0.474 . . . . 73.120000000000005 110.465 178.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.5 t -71.02 -29.61 65.58 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.721 -0.672 . . . . 64.109999999999999 111.226 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.514 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 9.7 pt20 -86.66 -9.48 55.9 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.215 0.531 . . . . 71.319999999999993 110.01 177.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.917 ' HE2' ' HA ' ' A' ' 73' ' ' LYS . 9.0 mmpt? -81.79 164.03 21.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.653 -0.703 . . . . 74.109999999999999 109.945 176.073 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.2 t -100.45 -42.82 6.44 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.239 -0.652 . . . . 71.230000000000004 109.239 173.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.49 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 15.1 p -73.16 -58.8 3.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.648 -0.706 . . . . 71.400000000000006 110.778 179.018 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.457 ' HA ' HD12 ' A' ' 79' ' ' LEU . 86.9 mtp -65.09 -17.2 64.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.68 -0.691 . . . . 75.129999999999995 111.746 -176.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.535 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 24.8 ttpp -59.02 -38.32 78.99 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.272 -0.422 . . . . 65.25 110.825 -178.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -106.8 5.05 28.2 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.164 0.507 . . . . 72.010000000000005 110.816 -178.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.763 ' HB3' HG21 ' B' ' 133' ' ' ILE . 31.2 mt -81.41 -54.0 5.83 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.819 -0.628 . . . . 72.230000000000004 110.301 176.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.53 -5.59 50.61 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.095 -0.502 . . . . 75.340000000000003 111.98 -174.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 62.7 pttt -65.93 -9.07 26.29 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.958 0.408 . . . . 72.140000000000001 111.19 -178.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -61.02 -37.53 82.89 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.774 -0.648 . . . . 75.129999999999995 110.406 176.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 14.8 p -115.54 -23.18 4.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.801 -0.636 . . . . 74.030000000000001 110.453 178.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.462 ' O ' ' HA ' ' A' ' 81' ' ' LYS . 58.8 tp . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 115.975 -0.557 . . . . 75.129999999999995 110.315 -179.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 39.0 p90 . . . . . 0 N--CA 1.478 0.928 0 N-CA-C 113.27 0.841 . . . . 73.5 113.27 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 132' ' ' ASN . . . . . 0.479 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 27.3 p-10 -58.55 -48.49 80.7 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.77 0.319 . . . . 61.25 111.431 -174.272 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 133' ' ' ILE . . . . . 0.763 HG21 ' HB3' ' A' ' 79' ' ' LEU . 43.0 mm -64.73 -41.21 91.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.101 0.477 . . . . 73.409999999999997 111.156 -177.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.447 HD22 HD23 ' A' ' 49' ' ' LEU . 9.8 mp -65.45 -35.87 82.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.737 -0.665 . . . . 75.439999999999998 110.613 179.535 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -69.92 -41.65 74.36 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.79 -0.641 . . . . 62.310000000000002 110.264 177.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 136' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 5.8 mm-40 -64.25 -42.2 96.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.964 -0.562 . . . . 75.439999999999998 111.456 178.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -94.17 7.43 45.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.328 -0.396 . . . . 55.439999999999998 111.672 -175.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 10.4 t70 60.97 43.32 11.69 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.794 -0.639 . . . . 74.209999999999994 112.233 172.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -74.05 -10.56 59.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.877 0.37 . . . . 71.200000000000003 110.66 172.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 58.09 78.26 0.37 Allowed Pre-proline 0 C--O 1.232 0.182 0 CA-C-N 115.325 -0.852 . . . . 63.210000000000001 110.313 -174.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . 0.414 ' HG3' ' HB3' ' B' ' 134' ' ' LEU . 10.9 Cg_endo -86.17 145.71 8.58 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 122.887 2.391 . . . . 52.109999999999999 112.418 -178.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 142' ' ' LYS . . . . . 0.454 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 4.7 mptp? . . . . . 0 C--N 1.323 -0.555 0 CA-C-N 116.097 -0.502 . . . . 70.540000000000006 110.028 178.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.507 -0.707 0 N-CA-C 109.553 -0.536 . . . . 73.420000000000002 109.553 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.477 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.8 mp -68.42 75.76 0.26 Allowed 'General case' 0 C--O 1.219 -0.535 0 O-C-N 123.91 0.756 . . . . 72.219999999999999 109.558 174.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.554 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -81.98 59.25 4.26 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.202 0.525 . . . . 62.5 110.451 -179.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 151' ' ' PHE . . . . . 0.477 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 44.2 p90 -86.84 162.78 17.58 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.662 -0.699 . . . . 71.319999999999993 110.588 -177.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 152' ' ' LYS . . . . . 0.432 ' HD3' ' CD1' ' B' ' 157' ' ' ILE . 21.6 tptt -92.76 113.47 25.75 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.518 -0.765 . . . . 64.340000000000003 109.659 -177.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 153' ' ' CYS . . . . . 0.536 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 29.9 t -123.29 96.12 4.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.01 0.433 . . . . 62.43 110.44 -176.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 57.91 55.05 5.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.174 -0.921 . . . . 70.450000000000003 111.628 179.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 95.17 -35.85 4.08 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.596 -0.729 . . . . 73.140000000000001 113.054 172.251 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -107.31 141.13 39.13 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.22 0.533 . . . . 60.100000000000001 111.277 -175.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . 0.432 ' CD1' ' HD3' ' B' ' 152' ' ' LYS . 43.3 mm -76.01 119.51 24.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.522 -0.763 . . . . 74.409999999999997 109.525 174.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 158' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -106.28 97.79 7.55 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.909 -0.316 . . . . 74.239999999999995 110.386 -177.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 2.6 p -76.47 124.24 27.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.221 -0.445 . . . . 73.420000000000002 111.815 -177.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 86.9 m-85 -125.37 107.32 10.57 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.27 -0.423 . . . . 64.219999999999999 111.206 176.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 39.6 m -97.21 -0.67 46.39 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.748 -0.66 . . . . 51.210000000000001 109.448 172.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -129.56 131.84 46.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.198 -0.91 . . . . 75.010000000000005 109.797 -179.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 51.0 tp -76.49 -35.35 58.44 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.354 -0.385 . . . . 73.109999999999999 110.79 -175.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -62.27 -44.64 96.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.936 0.398 . . . . 71.420000000000002 110.491 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . 0.674 ' HA ' ' HE2' ' B' ' 168' ' ' LYS . 32.0 m -61.55 -32.14 72.2 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.976 -0.557 . . . . 72.530000000000001 110.932 178.411 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 49.5 tp -68.09 -40.16 82.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 75.420000000000002 110.414 179.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . 0.555 ' HG3' HD21 ' B' ' 184' ' ' LEU . 24.2 ttt180 -57.22 -45.65 83.67 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.047 0.451 . . . . 74.409999999999997 110.543 175.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 168' ' ' LYS . . . . . 0.674 ' HE2' ' HA ' ' B' ' 165' ' ' SER . 52.0 mtmt -63.34 -36.46 83.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.519 -0.764 . . . . 62.200000000000003 111.195 -179.086 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -71.26 -44.95 64.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.092 -0.504 . . . . 74.5 110.736 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.08 -28.65 69.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.212 -0.449 . . . . 72.510000000000005 110.972 -179.514 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 33.2 t -66.29 -30.92 71.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.96 -0.564 . . . . 64.310000000000002 111.29 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -100.53 10.93 40.52 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.098 0.475 . . . . 74.209999999999994 110.695 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 173' ' ' LYS . . . . . 0.536 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 30.7 mmmt -108.05 117.88 35.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.939 -0.573 . . . . 61.399999999999999 110.738 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 39.8 t -64.27 -37.13 86.38 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.956 -0.565 . . . . 71.129999999999995 110.456 -178.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 16.9 p -78.25 -35.75 47.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.748 -0.66 . . . . 71.510000000000005 111.778 -177.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 76.9 mtp -90.7 -16.64 28.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.317 -0.401 . . . . 74.230000000000004 111.824 -172.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -56.68 -37.73 71.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.495 -0.321 . . . . 70.230000000000004 111.558 -177.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -96.73 0.15 49.13 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.305 0.574 . . . . 63.5 110.529 -174.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 179' ' ' LEU . . . . . 0.509 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 59.6 mt -88.72 -51.97 5.38 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.245 -0.889 . . . . 31.43 109.408 176.076 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.0 -19.64 59.99 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.368 -0.833 . . . . 74.219999999999999 111.797 -176.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -60.34 -15.08 22.25 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.057 0.391 . . . . 63.119999999999997 112.057 -177.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -75.05 -32.54 61.56 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.086 0.47 . . . . 62.5 110.659 -173.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 27.0 m -117.05 -15.39 9.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.811 -0.631 . . . . 60.420000000000002 110.997 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 184' ' ' LEU . . . . . 0.555 HD21 ' HG3' ' B' ' 167' ' ' ARG . 42.5 tp . . . . . 0 C--N 1.325 -0.467 0 CA-C-N 116.024 -0.534 . . . . 71.150000000000006 109.969 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.49 ' HB2' ' HB2' ' A' ' 41' ' ' PRO . 14.0 p90 . . . . . 0 N--CA 1.456 -0.17 0 CA-C-O 120.491 0.186 . . . . 73.349999999999994 110.991 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.418 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 12.1 t30 -61.58 -53.68 53.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.454 -0.339 . . . . 73.420000000000002 111.114 -173.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.447 ' H ' HD12 ' A' ' 33' ' ' ILE . 3.6 mp -62.77 -39.73 85.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.134 0.493 . . . . 72.400000000000006 110.378 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.498 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 88.8 mt -62.49 -34.79 77.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.014 -0.539 . . . . 64.450000000000003 110.736 178.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -69.88 -38.67 76.46 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.141 -0.481 . . . . 75.099999999999994 110.441 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 34.1 mm-40 -65.93 -31.3 72.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.052 -0.522 . . . . 71.209999999999994 111.08 178.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -100.39 4.35 43.82 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.13 -0.486 . . . . 73.439999999999998 111.281 -177.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.5 t0 67.69 47.09 1.21 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.617 -0.719 . . . . 74.019999999999996 112.054 171.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.498 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 28.7 m-85 -81.21 -7.63 59.6 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.525 -0.307 . . . . 64.209999999999994 111.608 173.215 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.93 69.53 1.35 Allowed Pre-proline 0 CA--C 1.538 0.515 0 CA-C-O 121.321 0.581 . . . . 71.140000000000001 110.076 -175.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.551 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 87.2 Cg_endo -89.07 175.75 3.38 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 123.017 2.478 . . . . 75.549999999999997 112.637 -177.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.431 ' HD2' ' C ' ' A' ' 41' ' ' PRO . 12.7 mptt . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 116.276 -0.42 . . . . 72.219999999999999 111.125 -178.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.509 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.727 0.298 . . . . 63.520000000000003 111.022 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.653 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.9 mp -73.67 92.18 1.95 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.904 -0.589 . . . . 72.019999999999996 110.889 -177.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -94.11 68.18 3.7 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.272 -0.64 . . . . 73.200000000000003 109.272 171.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.653 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 44.9 p90 -91.68 165.12 13.47 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.994 -0.548 . . . . 75.409999999999997 111.132 -173.288 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.2 tptm -92.24 116.61 29.11 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.568 -0.742 . . . . 65.109999999999999 110.338 -176.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.554 ' HB3' ' HG2' ' A' ' 58' ' ' LYS . 47.3 t -120.06 100.49 7.24 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.993 0.425 . . . . 65.310000000000002 110.362 178.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 64.41 15.9 9.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.265 -0.88 . . . . 64.219999999999999 112.317 174.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.63 -32.26 3.92 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.297 -0.954 . . . . 74.140000000000001 112.638 177.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -100.66 153.74 19.17 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 110.117 -0.327 . . . . 75.530000000000001 110.117 -179.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 48.1 mm -83.9 116.48 27.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.401 -0.363 . . . . 72.329999999999998 110.166 177.243 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.739 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 31.8 mmmt -101.01 115.9 31.56 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.381 -0.6 . . . . 73.230000000000004 109.381 177.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -97.8 112.06 24.11 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.864 -0.607 . . . . 72.450000000000003 111.16 -174.716 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.739 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 23.8 m-85 -121.6 140.72 51.89 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.839 -0.619 . . . . 64.219999999999999 111.228 -178.239 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.509 ' HB3' ' HB3' ' A' ' 48' ' ' LYS . 17.1 p -137.08 15.55 3.04 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.811 -0.631 . . . . 74.219999999999999 109.75 175.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.466 ' OD2' ' HB3' ' A' ' 64' ' ' GLN . 4.9 t70 -148.1 127.55 13.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.488 -0.778 . . . . 73.319999999999993 110.692 -177.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 56.1 tp -68.25 -29.61 68.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.915 -0.584 . . . . 74.040000000000006 111.144 -177.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.466 ' HB3' ' OD2' ' A' ' 62' ' ' ASP . 44.3 tt0 -62.1 -47.92 82.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.26 0.552 . . . . 61.329999999999998 109.674 178.339 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 42.6 m -58.03 -45.05 87.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.389 -0.823 . . . . 75.040000000000006 111.109 177.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 37.1 tp -68.71 -34.63 75.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.285 -0.416 . . . . 73.409999999999997 110.977 -177.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 67' ' ' ARG . 46.4 ttp180 -61.96 -31.91 72.29 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.143 0.497 . . . . 71.450000000000003 110.463 177.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 64' ' ' GLN . 3.8 mtmp? -75.71 -42.62 50.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.988 -0.551 . . . . 74.319999999999993 110.343 176.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.469 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 63.7 t80 -65.98 -41.98 90.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.652 -0.703 . . . . 74.340000000000003 111.011 -176.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.38 -26.89 64.88 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.524 -0.307 . . . . 63.0 111.009 177.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.7 t -75.58 -28.6 59.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.915 0.388 . . . . 73.099999999999994 110.522 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 19.9 pt20 -87.69 -10.53 50.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.383 0.611 . . . . 72.299999999999997 109.847 176.059 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.458 ' O ' ' HE3' ' A' ' 77' ' ' LYS . 26.9 mmmt -94.03 163.33 13.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.334 -0.848 . . . . 71.209999999999994 109.431 173.016 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.1 t -105.42 -44.86 4.61 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.645 -0.502 . . . . 65.409999999999997 109.645 176.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.594 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 17.7 p -65.91 -53.35 40.57 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.969 -0.56 . . . . 70.510000000000005 110.891 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 81.3 mtp -64.87 -26.63 68.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.786 -0.643 . . . . 74.120000000000005 111.383 -177.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.458 ' HE3' ' O ' ' A' ' 73' ' ' LYS . 37.1 ttmt -61.12 -34.12 74.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.268 0.556 . . . . 63.340000000000003 110.47 178.468 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -102.88 8.08 39.25 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.631 0.729 . . . . 72.310000000000002 109.799 -176.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 75' ' ' SER . 45.6 mt -94.14 -52.87 4.19 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.063 -0.971 . . . . 72.329999999999998 108.912 172.041 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.483 ' HA ' HG13 ' B' ' 133' ' ' ILE . 9.1 mt -80.25 6.67 11.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.427 -0.806 . . . . 75.310000000000002 111.306 -173.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -54.36 -20.81 8.0 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.628 0.58 . . . . 71.219999999999999 112.481 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.586 ' HB3' HD11 ' B' ' 133' ' ' ILE . 27.6 t70 -67.69 -41.99 82.78 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.972 0.415 . . . . 72.400000000000006 110.365 175.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 35.6 t -91.33 -42.55 13.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.069 -0.514 . . . . 73.409999999999997 110.405 -178.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.1 mp . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 116.107 -0.497 . . . . 74.319999999999993 110.495 -179.247 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 26.0 p90 . . . . . 0 N--CA 1.463 0.191 0 N-CA-C 112.219 0.451 . . . . 74.519999999999996 112.219 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 132' ' ' ASN . . . . . 0.466 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 54.7 t30 -55.52 -60.14 3.84 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.142 0.276 . . . . 75.510000000000005 111.661 -171.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 133' ' ' ILE . . . . . 0.586 HD11 ' HB3' ' A' ' 82' ' ' ASP . 39.5 mm -59.52 -46.52 92.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.27 0.557 . . . . 75.420000000000002 111.482 -176.007 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.432 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 88.0 mt -58.22 -30.71 66.71 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.587 -0.733 . . . . 54.32 111.613 -179.564 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -77.73 -33.61 52.91 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.751 0.31 . . . . 63.030000000000001 110.599 -178.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 136' ' ' GLU . . . . . 0.469 ' OE1' ' HA ' ' B' ' 133' ' ' ILE . 33.5 mt-10 -64.72 -46.56 81.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.406 0.622 . . . . 62.240000000000002 110.296 177.609 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 39.3 m-80 -90.83 5.25 49.19 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.363 -0.835 . . . . 65.109999999999999 110.796 -175.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 31.5 t70 60.2 65.13 1.12 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.982 -1.008 . . . . 64.409999999999997 112.754 173.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 139' ' ' PHE . . . . . 0.432 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 9.7 m-85 -95.92 1.29 52.82 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.667 -0.697 . . . . 65.209999999999994 109.938 169.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 60.34 76.5 0.42 Allowed Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.647 -0.706 . . . . 62.009999999999998 110.796 -178.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -79.86 157.19 24.15 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.814 2.342 . . . . 75.209999999999994 112.087 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 11.8 mptt . . . . . 0 C--N 1.325 -0.481 0 CA-C-O 120.925 0.393 . . . . 75.209999999999994 111.766 -176.134 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.516 -0.344 0 CA-C-O 120.502 0.191 . . . . 65.019999999999996 110.504 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.569 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.9 mp -73.04 88.2 1.39 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.294 -0.412 . . . . 72.010000000000005 110.576 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -91.69 72.06 5.82 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.424 -0.584 . . . . 65.319999999999993 109.424 174.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 151' ' ' PHE . . . . . 0.569 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 50.3 p90 -102.09 166.08 10.8 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.04 -0.527 . . . . 74.319999999999993 110.584 -176.102 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.8 tppp? -94.69 124.36 38.68 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.014 -0.539 . . . . 63.5 110.212 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 153' ' ' CYS . . . . . 0.538 ' HB3' ' CG ' ' B' ' 158' ' ' LYS . 32.5 t -138.64 117.09 12.02 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.321 -0.399 . . . . 73.209999999999994 110.194 178.158 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 73.2 4.51 4.91 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.235 -0.893 . . . . 54.229999999999997 112.087 174.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 119.6 -19.46 9.75 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.439 -0.886 . . . . 55.130000000000003 112.822 178.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -114.51 156.1 25.22 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.984 -0.376 . . . . 73.140000000000001 109.984 177.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 46.4 mm -78.35 117.55 23.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 110.039 -0.356 . . . . 65.430000000000007 110.039 177.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 158' ' ' LYS . . . . . 0.705 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 29.0 mmmt -100.34 103.62 15.03 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.192 -0.67 . . . . 70.25 109.192 178.622 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . 0.464 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.2 OUTLIER -89.51 113.39 24.77 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.048 -0.523 . . . . 73.200000000000003 111.165 -176.228 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 160' ' ' PHE . . . . . 0.705 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 34.3 m-85 -115.17 134.3 55.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.115 0.484 . . . . 75.219999999999999 110.989 -179.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 16.6 p -114.38 1.68 14.47 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.692 -0.686 . . . . 74.409999999999997 110.616 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 162' ' ' ASP . . . . . 0.577 ' HB2' ' CB ' ' B' ' 165' ' ' SER . 4.1 m-20 -134.65 150.17 50.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.891 -0.595 . . . . 74.010000000000005 110.077 -174.475 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 5.6 tt -79.12 -51.03 10.08 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.006 -0.739 . . . . 72.219999999999999 109.006 177.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 61.4 tt0 -60.82 -35.78 77.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.515 -0.766 . . . . 71.409999999999997 110.771 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . 0.665 ' HA ' ' HE3' ' B' ' 168' ' ' LYS . 13.4 t -65.02 -36.27 83.85 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.732 -0.667 . . . . 72.549999999999997 110.624 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . 0.509 ' HA ' ' CE2' ' B' ' 160' ' ' PHE . 52.4 tp -71.25 -31.8 67.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.797 0.332 . . . . 72.340000000000003 110.408 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . 0.42 ' HG3' HD11 ' B' ' 184' ' ' LEU . 56.5 ttp180 -61.54 -36.12 79.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.964 -0.562 . . . . 75.519999999999996 110.124 177.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 168' ' ' LYS . . . . . 0.665 ' HE3' ' HA ' ' B' ' 165' ' ' SER . 9.8 mtmp? -59.63 -43.62 93.76 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.903 -0.59 . . . . 74.0 110.558 176.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 169' ' ' PHE . . . . . 0.483 ' O ' ' HG2' ' B' ' 172' ' ' GLN . 40.4 t80 -70.7 -40.76 72.69 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.453 -0.794 . . . . 65.230000000000004 110.007 -178.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 170' ' ' ALA . . . . . 0.462 ' HB2' HD12 ' B' ' 180' ' ' LEU . . . -61.88 -31.44 71.72 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.995 -0.548 . . . . 64.430000000000007 111.179 177.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 9.1 t -78.33 -28.95 47.42 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 121.062 -0.255 . . . . 72.439999999999998 111.233 -176.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . 0.483 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 21.0 pt20 -85.82 -5.94 59.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.468 0.651 . . . . 71.239999999999995 109.937 177.563 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 10.7 mmmm -118.41 98.09 6.09 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.232 -0.894 . . . . 63.409999999999997 110.101 -179.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 16.8 t -51.35 -34.85 35.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.083 0.468 . . . . 32.399999999999999 110.454 -179.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 175' ' ' SER . . . . . 0.577 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 3.9 m -62.06 -47.29 85.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.799 -0.637 . . . . 65.439999999999998 111.059 178.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 86.3 mtp -82.89 -21.65 34.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.929 -0.578 . . . . 71.109999999999999 111.224 -175.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 20.5 ttmm -66.57 -23.73 66.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.678 0.752 . . . . 75.340000000000003 109.296 175.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -100.15 4.28 44.36 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.947 -1.024 . . . . 72.340000000000003 109.655 -177.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 179' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' B' ' 175' ' ' SER . 57.7 mt -103.16 -49.96 3.61 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.293 -0.867 . . . . 73.430000000000007 109.325 175.525 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 180' ' ' LEU . . . . . 0.462 HD12 ' HB2' ' B' ' 170' ' ' ALA . 9.8 mt -86.91 5.74 35.45 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.821 -0.627 . . . . 74.129999999999995 110.477 -176.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 181' ' ' LYS . . . . . 0.403 ' HA ' ' HB2' ' B' ' 184' ' ' LEU . 63.4 pttt -59.7 -11.84 5.85 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.474 -0.784 . . . . 73.230000000000004 111.673 178.317 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -63.54 -35.02 79.09 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.368 0.604 . . . . 73.150000000000006 109.683 175.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 23.9 t -102.76 -37.74 5.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.048 -0.978 . . . . 64.409999999999997 110.098 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 184' ' ' LEU . . . . . 0.42 HD11 ' HG3' ' B' ' 167' ' ' ARG . 10.7 mp . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 115.617 -0.72 . . . . 52.229999999999997 110.497 -178.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.438 ' HB3' HD21 ' B' ' 149' ' ' LEU . 32.4 p90 . . . . . 0 C--O 1.233 0.225 0 N-CA-C 111.895 0.332 . . . . 74.299999999999997 111.895 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.552 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 50.1 t30 -54.62 -54.91 35.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.052 0.453 . . . . 73.140000000000001 111.046 -176.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.752 HG21 ' HB3' ' B' ' 179' ' ' LEU . 36.1 mm -58.55 -38.47 70.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.678 -0.692 . . . . 65.120000000000005 111.489 -176.324 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.6 mt -62.66 -34.51 77.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.84 -0.618 . . . . 74.140000000000001 111.771 -177.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 74.8 ttt180 -81.02 -36.72 30.25 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.492 -0.483 . . . . 71.510000000000005 110.366 178.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.552 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 8.5 mm-40 -67.04 -31.4 71.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.76 0.314 . . . . 62.109999999999999 111.139 -178.486 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -98.33 -1.15 42.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.9 0.381 . . . . 65.109999999999999 111.003 178.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 19.5 t70 59.84 74.95 0.42 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.926 0.87 . . . . 73.040000000000006 111.749 176.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.484 ' HB3' ' HB2' ' B' ' 151' ' ' PHE . 3.7 m-85 -94.54 -4.21 48.42 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.986 -1.007 . . . . 71.120000000000005 109.865 169.002 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 59.39 74.7 0.56 Allowed Pre-proline 0 N--CA 1.463 0.22 0 O-C-N 124.178 0.924 . . . . 70.230000000000004 110.252 -174.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -80.32 -165.2 0.32 Allowed 'Trans proline' 0 N--CA 1.458 -0.599 0 C-N-CA 123.277 2.651 . . . . 54.43 112.221 -177.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.932 ' HD3' ' HB3' ' B' ' 150' ' ' ALA . 6.9 tptp . . . . . 0 C--N 1.327 -0.399 0 CA-C-N 116.134 -0.485 . . . . 73.129999999999995 110.327 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.531 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.399 0 CA-C-O 121.398 0.618 . . . . 72.209999999999994 109.802 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.521 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 9.3 mp -67.33 91.15 0.24 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.997 -1.001 . . . . 74.239999999999995 111.171 -176.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' B' ' 142' ' ' LYS . . . -90.38 96.72 10.79 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.911 -0.774 . . . . 71.430000000000007 108.911 170.281 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.639 ' HB3' ' HA ' ' B' ' 141' ' ' PRO . 49.5 p90 -129.93 170.01 14.49 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.71 -0.677 . . . . 54.219999999999999 110.34 -176.185 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.7 tppp? -85.08 131.22 34.48 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.257 -0.429 . . . . 73.319999999999993 110.65 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 39.4 t -146.89 119.31 8.42 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.646 -0.502 . . . . 52.109999999999999 109.646 174.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 31.4 t70 71.39 2.74 4.38 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.668 -0.696 . . . . 33.350000000000001 112.404 175.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 117.76 -20.06 11.04 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.415 -0.898 . . . . 74.420000000000002 112.15 -179.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -107.77 163.83 12.76 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.819 -0.437 . . . . 64.129999999999995 109.819 178.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.7 mm -93.03 125.41 45.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.734 -0.469 . . . . 74.340000000000003 109.734 177.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.559 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 30.6 mmmt -107.46 141.13 39.36 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.337 -0.392 . . . . 74.420000000000002 110.023 -179.295 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -112.63 115.67 28.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.0 0.428 . . . . 45.340000000000003 111.169 176.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -120.75 106.28 11.55 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.162 -0.472 . . . . 63.210000000000001 110.834 178.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.531 ' HB3' ' HB3' ' A' ' 48' ' ' LYS . 5.4 p -96.96 -2.42 43.67 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.102 -0.499 . . . . 51.229999999999997 110.944 178.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -131.14 138.69 49.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.033 -0.53 . . . . 72.299999999999997 110.775 179.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 46.4 tp -70.36 -31.03 68.13 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.282 -0.636 . . . . 74.340000000000003 109.282 175.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -56.94 -47.17 81.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.782 -0.644 . . . . 74.519999999999996 110.389 174.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.6 m -63.77 -43.18 97.15 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.928 -0.578 . . . . 74.230000000000004 110.952 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 33.6 tp -72.94 -32.08 65.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.414 . . . . 72.239999999999995 110.862 -177.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.404 ' HG2' HD21 ' A' ' 84' ' ' LEU . 55.4 ttp180 -59.29 -44.45 92.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.055 -0.52 . . . . 75.099999999999994 110.19 178.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -62.79 -46.82 86.23 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.728 -0.669 . . . . 74.530000000000001 110.827 178.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.46 ' CE2' ' HE3' ' A' ' 73' ' ' LYS . 46.5 t80 -63.72 -45.42 90.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.249 -0.887 . . . . 71.430000000000007 110.883 -176.388 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.73 -24.98 64.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.134 -0.484 . . . . 70.299999999999997 112.018 -176.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.1 m -65.05 -38.11 89.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.813 0.34 . . . . 75.200000000000003 111.231 -179.106 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -92.27 0.11 57.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.09 0.472 . . . . 70.219999999999999 111.217 -178.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 66.4 mmtt -97.5 116.91 30.61 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.909 -0.587 . . . . 75.0 110.247 177.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.2 m -64.61 -35.0 79.59 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.093 0.473 . . . . 42.439999999999998 110.561 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 23.3 t -78.78 -34.05 45.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.689 -0.687 . . . . 53.0 110.916 -179.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.509 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 82.4 mtp -92.15 -12.47 32.77 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.652 0.263 . . . . 61.43 111.64 -175.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.58 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 40.4 tttp -52.27 -43.11 64.24 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.04 -0.527 . . . . 61.109999999999999 110.972 174.406 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.467 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 28.7 mm-40 -90.88 -2.53 57.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.485 0.66 . . . . 63.100000000000001 110.444 -172.037 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.549 ' HB2' HD22 ' A' ' 80' ' ' LEU . 36.1 mt -90.48 -53.7 4.32 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.162 -0.926 . . . . 72.200000000000003 109.872 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.549 HD22 ' HB2' ' A' ' 79' ' ' LEU . 3.0 mm? -94.93 3.45 54.95 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.768 -0.651 . . . . 53.43 111.515 -176.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.58 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 65.3 pttt -55.98 -16.41 4.81 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.274 0.472 . . . . 70.010000000000005 112.274 178.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -58.63 -30.56 67.38 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.935 0.398 . . . . 74.129999999999995 111.228 177.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 19.7 m -123.18 10.34 5.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.215 0.531 . . . . 71.519999999999996 111.01 178.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.446 ' HB2' ' HA ' ' A' ' 81' ' ' LYS . 3.1 mt . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 115.903 -0.59 . . . . 53.43 110.602 -177.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 43.4 p90 . . . . . 0 CA--C 1.535 0.386 0 N-CA-C 111.76 0.281 . . . . 74.219999999999999 111.76 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -54.92 -48.47 73.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.082 -0.508 . . . . 75.530000000000001 110.959 179.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 133' ' ' ILE . . . . . 0.515 HG21 ' HB3' ' A' ' 79' ' ' LEU . 43.2 mm -61.99 -42.54 95.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.339 0.59 . . . . 62.310000000000002 110.777 -179.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.518 HD12 HD23 ' A' ' 49' ' ' LEU . 98.9 mt -70.29 -26.31 63.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.613 -0.722 . . . . 52.43 111.784 -174.267 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -76.37 -35.18 58.81 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.336 -0.546 . . . . 75.120000000000005 109.875 176.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -63.83 -30.24 71.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.838 -0.619 . . . . 72.230000000000004 110.723 176.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -102.62 5.74 39.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.045 -0.525 . . . . 63.130000000000003 111.263 -179.472 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 57.41 51.3 10.05 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.708 -0.678 . . . . 62.329999999999998 112.317 174.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 139' ' ' PHE . . . . . 0.488 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 7.6 m-85 -82.72 -8.0 59.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.109 -0.496 . . . . 64.450000000000003 110.221 172.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 140' ' ' GLU . . . . . 0.41 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 37.0 tt0 58.42 75.89 0.5 Allowed Pre-proline 0 N--CA 1.464 0.232 0 CA-C-N 115.487 -0.779 . . . . 71.200000000000003 110.785 -176.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . 0.639 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 78.1 Cg_endo -80.2 173.61 12.36 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.669 2.246 . . . . 74.329999999999998 112.491 -178.39 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 142' ' ' LYS . . . . . 0.82 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 11.5 tptp . . . . . 0 C--N 1.324 -0.539 0 CA-C-N 116.091 -0.504 . . . . 63.520000000000003 109.795 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . 0.771 ' HB3' ' HB3' ' B' ' 161' ' ' SER . 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.368 0 N-CA-C 108.911 -0.774 . . . . 70.409999999999997 108.911 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.627 HD22 ' H ' ' B' ' 149' ' ' LEU . 1.5 mm? -60.72 107.92 0.77 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.316 -0.857 . . . . 73.439999999999998 111.298 -171.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.932 ' HB3' ' HD3' ' A' ' 42' ' ' LYS . . . -97.08 87.47 4.22 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.835 -0.802 . . . . 54.310000000000002 108.835 171.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 151' ' ' PHE . . . . . 0.518 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 45.4 p90 -119.85 167.05 12.5 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.704 -0.68 . . . . 71.530000000000001 110.593 -175.544 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -93.65 122.25 35.91 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.997 -0.547 . . . . 72.409999999999997 110.079 177.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 153' ' ' CYS . . . . . 0.431 ' HB2' ' HE1' ' B' ' 151' ' ' PHE . 20.8 t -137.13 121.61 18.31 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.067 -0.515 . . . . 75.319999999999993 110.097 177.686 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 20.9 t70 73.54 1.8 4.07 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.874 -0.603 . . . . 61.32 111.545 171.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 116.3 -11.59 16.79 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.782 -0.723 . . . . 72.120000000000005 112.495 -179.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 156' ' ' GLU . . . . . 0.833 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 10.4 pt-20 -117.31 145.32 44.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.838 0.351 . . . . 71.319999999999993 110.667 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 46.2 mm -77.28 127.03 38.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 109.361 -0.607 . . . . 73.120000000000005 109.361 175.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 158' ' ' LYS . . . . . 0.833 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 30.6 mmmt -120.57 126.94 51.59 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.005 -0.543 . . . . 73.209999999999994 110.279 -176.379 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . 0.58 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.9 OUTLIER -103.01 115.42 30.57 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 123.249 0.343 . . . . 71.430000000000007 110.169 172.749 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 160' ' ' PHE . . . . . 0.418 ' CE2' ' HB3' ' B' ' 158' ' ' LYS . 59.9 m-85 -115.28 102.84 10.24 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.349 0.595 . . . . 63.140000000000001 111.758 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . 0.771 ' HB3' ' HB3' ' B' ' 148' ' ' LYS . 34.1 p -108.12 12.35 26.83 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.174 -0.921 . . . . 65.219999999999999 108.714 168.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -132.0 108.12 9.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.766 -1.106 . . . . 53.399999999999999 110.243 -179.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 50.9 tp -66.25 -26.33 67.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.656 -0.702 . . . . 73.340000000000003 110.66 -178.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.09 -52.1 65.26 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.093 -0.503 . . . . 73.299999999999997 110.67 -179.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 30.9 m -72.32 -28.71 63.24 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.645 -0.252 . . . . 61.539999999999999 110.743 178.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 60.6 tp -64.98 -39.88 94.14 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.054 -0.351 . . . . 70.310000000000002 110.054 178.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . 0.545 ' HG3' ' HG ' ' B' ' 184' ' ' LEU . 29.1 ttp180 -61.73 -36.56 81.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.12 0.486 . . . . 63.020000000000003 110.3 177.747 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -66.08 -51.45 57.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.856 -0.611 . . . . 74.209999999999994 110.882 175.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -68.56 -46.06 70.45 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.787 -0.642 . . . . 75.310000000000002 111.651 -174.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -60.9 -37.43 82.19 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.147 0.425 . . . . 33.109999999999999 112.147 -176.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . 0.481 ' HB3' HD23 ' B' ' 184' ' ' LEU . 22.8 p -73.02 -23.51 60.62 Favored 'General case' 0 C--N 1.323 -0.543 0 N-CA-C 112.054 0.391 . . . . 72.209999999999994 112.054 -174.649 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -95.89 -8.71 33.3 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.839 0.352 . . . . 75.120000000000005 111.138 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 173' ' ' LYS . . . . . 1.092 ' HE2' ' HA ' ' B' ' 173' ' ' LYS . 7.2 mmpt? -86.61 129.88 34.7 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 110.049 -0.352 . . . . 62.229999999999997 110.049 177.188 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 19.2 m -58.31 -43.17 88.01 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.841 0.353 . . . . 75.549999999999997 111.541 -176.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 175' ' ' SER . . . . . 0.586 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 47.1 t -77.21 -49.29 15.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.049 0.452 . . . . 74.439999999999998 110.143 -179.484 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.811 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 73.0 mtp -66.11 -23.94 66.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.757 -0.656 . . . . 72.209999999999994 111.789 -175.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 177' ' ' LYS . . . . . 0.648 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 28.5 tttp -59.26 -35.94 74.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 65.530000000000001 110.788 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -88.86 -21.38 23.71 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 121.519 0.676 . . . . 72.120000000000005 110.314 -176.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 179' ' ' LEU . . . . . 0.752 ' HB3' HG21 ' A' ' 33' ' ' ILE . 35.8 mt -75.88 -46.24 31.24 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.845 -1.07 . . . . 74.5 110.466 -178.093 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 180' ' ' LEU . . . . . 0.821 ' HB3' HD13 ' B' ' 184' ' ' LEU . 3.7 mm? -98.57 -3.35 36.5 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.532 -0.758 . . . . 75.510000000000005 112.027 -174.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 181' ' ' LYS . . . . . 0.648 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 64.9 pttt -56.12 -18.24 9.35 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.904 0.705 . . . . 65.310000000000002 112.904 -177.459 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -70.04 -38.62 75.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.002 0.43 . . . . 61.020000000000003 110.937 179.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 18.7 m -108.63 -9.01 11.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.996 -0.547 . . . . 72.409999999999997 111.605 -175.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 184' ' ' LEU . . . . . 0.821 HD13 ' HB3' ' B' ' 180' ' ' LEU . 8.6 mp . . . . . 0 C--N 1.325 -0.488 0 N-CA-C 110.221 -0.289 . . . . 62.049999999999997 110.221 177.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 35.3 p90 . . . . . 0 N--CA 1.478 0.925 0 N-CA-C 113.095 0.776 . . . . 61.200000000000003 113.095 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -65.11 -46.11 82.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.013 0.435 . . . . 61.0 110.437 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.4 HG21 ' O ' ' B' ' 179' ' ' LEU . 40.6 mm -58.97 -34.35 52.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.718 -0.674 . . . . 72.420000000000002 110.769 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.479 ' CD1' HD21 ' B' ' 149' ' ' LEU . 80.2 mt -72.14 -28.41 63.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.795 -0.639 . . . . 74.129999999999995 110.524 -178.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.99 -44.3 63.7 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.497 -0.557 . . . . 64.219999999999999 109.497 174.381 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -60.32 -45.95 91.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.558 -0.746 . . . . 74.329999999999998 111.355 -179.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -85.36 0.54 51.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.445 -0.343 . . . . 75.409999999999997 111.16 -178.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 21.4 t70 58.1 69.09 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.475 -0.784 . . . . 75.239999999999995 111.609 178.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.6 m-30 -101.63 -2.21 30.93 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.906 -0.588 . . . . 72.219999999999999 110.861 174.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.638 ' HG3' ' HE2' ' A' ' 42' ' ' LYS . 7.5 tp10 62.59 80.87 0.24 Allowed Pre-proline 0 N--CA 1.466 0.35 0 O-C-N 123.68 0.613 . . . . 75.150000000000006 110.624 -174.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -88.92 138.0 3.4 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.048 2.499 . . . . 72.420000000000002 113.352 -176.398 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.678 ' O ' ' HA ' ' B' ' 149' ' ' LEU . 5.6 mptp? . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 63.240000000000002 109.758 177.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.419 ' HD3' ' CG2' ' A' ' 59' ' ' THR . 0.2 OUTLIER . . . . . 0 CA--C 1.513 -0.463 0 N-CA-C 110.028 -0.36 . . . . 70.530000000000001 110.028 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.565 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.9 mp -71.52 82.41 0.81 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.001 0.429 . . . . 74.319999999999993 110.765 -178.55 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.09 58.19 4.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.792 -0.64 . . . . 75.140000000000001 109.343 173.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.565 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 52.3 p90 -89.24 169.42 11.46 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.674 -0.694 . . . . 72.409999999999997 110.723 -175.132 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.509 ' HE3' HD13 ' A' ' 57' ' ' ILE . 3.8 tppp? -100.95 124.27 46.4 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.86 -0.609 . . . . 71.099999999999994 111.035 -177.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.47 ' HB3' ' CG ' ' A' ' 58' ' ' LYS . 45.2 t -143.04 132.12 23.05 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.947 -0.57 . . . . 64.319999999999993 109.535 175.676 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 65.15 11.71 7.4 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.043 -0.526 . . . . 73.420000000000002 112.399 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 102.32 -6.35 53.13 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.74 -0.743 . . . . 60.049999999999997 112.734 177.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -123.72 159.05 30.25 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.841 0.353 . . . . 72.319999999999993 110.293 177.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.509 HD13 ' HE3' ' A' ' 52' ' ' LYS . 41.3 mm -78.43 123.97 36.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 109.787 -0.449 . . . . 75.140000000000001 109.787 176.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.47 ' CG ' ' HB3' ' A' ' 53' ' ' CYS . 27.7 mmmt -104.48 85.26 2.31 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.429 -0.582 . . . . 75.319999999999993 109.429 178.605 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.419 ' CG2' ' HD3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -74.07 112.08 9.86 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.021 -0.536 . . . . 73.510000000000005 111.525 -174.744 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -123.45 116.01 22.53 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.901 0.381 . . . . 74.420000000000002 110.992 178.39 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.5 m -91.1 -12.66 34.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.431 0.634 . . . . 63.299999999999997 109.451 172.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.462 ' OD2' ' HB3' ' A' ' 64' ' ' GLN . 33.4 t70 -115.6 118.87 34.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.34 -0.845 . . . . 54.32 109.923 -179.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -74.11 -25.61 59.88 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.018 0.437 . . . . 62.530000000000001 110.511 -176.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.463 ' O ' ' HB3' ' A' ' 67' ' ' ARG . 28.5 tt0 -63.23 -39.72 95.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.962 -0.563 . . . . 63.140000000000001 109.963 176.267 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.7 m -70.98 -29.05 64.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.641 -0.709 . . . . 75.109999999999999 110.77 177.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 69.4 tp -64.74 -38.75 92.06 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.768 -0.456 . . . . 74.019999999999996 109.768 175.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.463 ' HB3' ' O ' ' A' ' 64' ' ' GLN . 16.5 ttt-85 -56.34 -40.95 75.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.706 -0.679 . . . . 72.019999999999996 110.647 174.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 60.4 mmtt -60.94 -48.83 79.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.164 -0.471 . . . . 73.120000000000005 110.913 177.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.509 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 63.3 t80 -67.23 -46.65 73.18 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.673 -0.694 . . . . 75.340000000000003 111.194 -177.489 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.5 -29.76 70.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.338 -0.392 . . . . 73.530000000000001 111.818 -177.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.4 m -69.21 -25.82 64.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.518 -0.31 . . . . 52.200000000000003 111.608 -178.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.509 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 11.6 pt20 -99.37 -0.68 40.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.141 0.496 . . . . 74.239999999999995 110.524 -179.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.774 ' HE2' ' HA ' ' A' ' 73' ' ' LYS . 9.1 mmpt? -95.96 120.02 35.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.776 -0.647 . . . . 64.049999999999997 109.984 177.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.6 m -57.0 -42.96 81.25 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.933 0.396 . . . . 41.020000000000003 110.813 179.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.472 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 4.7 m -78.35 -42.61 30.03 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.034 -0.53 . . . . 74.409999999999997 111.212 -176.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.734 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 86.9 mtp -74.28 -19.9 60.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.401 -0.363 . . . . 75.120000000000005 111.339 -175.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.442 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 1.8 tmtm? -56.23 -41.91 76.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.181 -0.463 . . . . 71.510000000000005 110.024 177.329 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -85.13 -20.72 29.86 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.621 0.724 . . . . 61.439999999999998 110.041 -174.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.701 ' HB3' HG21 ' B' ' 133' ' ' ILE . 83.6 mt -75.3 -53.04 9.44 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.734 -1.121 . . . . 73.030000000000001 110.235 179.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.514 ' HB3' HD12 ' A' ' 84' ' ' LEU . 4.1 mm? -82.62 -16.07 49.74 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.564 -0.744 . . . . 74.549999999999997 112.516 -173.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.417 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 63.7 pttt -62.79 -14.69 48.31 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 120.755 0.312 . . . . 35.350000000000001 111.636 -178.102 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -68.51 -42.94 77.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.128 0.49 . . . . 65.420000000000002 110.37 179.269 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.523 HG13 ' HG ' ' A' ' 84' ' ' LEU . 7.7 p -99.09 -37.1 5.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.94 -0.573 . . . . 74.010000000000005 111.102 -178.492 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.523 ' HG ' HG13 ' A' ' 83' ' ' VAL . 90.7 mt . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 116.473 -0.33 . . . . 71.120000000000005 110.946 -177.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 52.3 p90 . . . . . 0 C--O 1.233 0.215 0 CA-C-O 120.793 0.33 . . . . 72.310000000000002 110.533 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 132' ' ' ASN . . . . . 0.45 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 7.3 t30 -55.41 -55.08 35.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.761 -0.654 . . . . 61.43 111.226 -179.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 133' ' ' ILE . . . . . 0.701 HG21 ' HB3' ' A' ' 79' ' ' LEU . 49.0 mm -54.75 -46.89 74.42 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.155 -0.475 . . . . 74.420000000000002 111.201 -178.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.545 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 84.7 mt -62.82 -37.22 85.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.71 -0.677 . . . . 73.430000000000007 111.021 -177.503 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.437 HH11 ' HG2' ' B' ' 136' ' ' GLU . 0.1 OUTLIER -65.61 -41.6 92.55 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.673 0.273 . . . . 53.43 110.53 177.944 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 136' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' B' ' 132' ' ' ASN . 16.6 mt-10 -69.75 -28.13 65.53 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.399 -0.364 . . . . 71.140000000000001 111.2 -176.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -101.48 8.13 42.17 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.157 0.503 . . . . 73.319999999999993 110.439 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 60.27 45.93 10.82 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.11 -0.95 . . . . 65.530000000000001 112.395 173.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 139' ' ' PHE . . . . . 0.545 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 8.1 m-85 -79.83 -8.92 59.56 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.12 -0.491 . . . . 70.140000000000001 109.926 172.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 140' ' ' GLU . . . . . 0.437 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 10.5 tp10 63.21 70.69 0.71 Allowed Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 115.306 -0.861 . . . . 73.450000000000003 110.679 179.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . 0.409 ' C ' ' HD2' ' B' ' 142' ' ' LYS . 89.2 Cg_endo -87.93 151.11 7.15 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.792 2.328 . . . . 74.049999999999997 112.348 -179.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 142' ' ' LYS . . . . . 0.409 ' HD2' ' C ' ' B' ' 141' ' ' PRO . 4.2 mptp? . . . . . 0 C--N 1.323 -0.548 0 N-CA-C 109.562 -0.533 . . . . 63.439999999999998 109.562 179.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.508 -0.649 0 N-CA-C 110.041 -0.355 . . . . 44.229999999999997 110.041 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.678 ' HA ' ' O ' ' A' ' 42' ' ' LYS . 61.7 tp -71.81 79.32 0.87 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.672 -0.694 . . . . 65.200000000000003 109.488 176.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.641 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -83.81 74.93 10.14 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.941 -0.572 . . . . 73.409999999999997 110.997 -177.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 151' ' ' PHE . . . . . 0.584 ' CD1' ' HG ' ' B' ' 149' ' ' LEU . 15.0 p90 -107.09 161.63 14.58 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.986 -0.552 . . . . 73.230000000000004 110.229 179.131 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 152' ' ' LYS . . . . . 0.417 ' HE3' ' CD1' ' B' ' 157' ' ' ILE . 4.8 tppp? -90.94 117.36 29.48 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.413 -0.812 . . . . 62.340000000000003 110.325 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 153' ' ' CYS . . . . . 0.558 ' HB2' ' CE2' ' B' ' 151' ' ' PHE . 42.6 t -135.83 122.65 21.15 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.657 -0.701 . . . . 51.329999999999998 110.035 179.013 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.7 t70 73.64 4.27 4.7 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.757 -0.656 . . . . 72.010000000000005 111.182 172.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 109.12 -4.02 31.63 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.826 -0.702 . . . . 74.340000000000003 112.351 179.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -125.45 155.82 39.86 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 110.017 -0.364 . . . . 73.140000000000001 110.017 176.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . 0.417 ' CD1' ' HE3' ' B' ' 152' ' ' LYS . 44.5 mm -84.76 115.52 26.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 109.358 -0.608 . . . . 50.229999999999997 109.358 177.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 158' ' ' LYS . . . . . 0.487 ' HE2' ' CE1' ' B' ' 169' ' ' PHE . 31.9 mmmt -100.24 94.63 6.31 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.555 0.217 . . . . 74.129999999999995 111.025 -175.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 1.2 p -78.09 111.88 14.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.007 0.432 . . . . 72.030000000000001 111.941 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 160' ' ' PHE . . . . . 0.454 ' CD2' HD13 ' B' ' 166' ' ' LEU . 64.1 m-85 -121.16 126.66 50.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.899 -0.591 . . . . 72.120000000000005 110.623 175.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 54.1 m -99.92 9.86 42.26 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.025 0.44 . . . . 73.519999999999996 110.453 174.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -143.51 138.75 29.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.93 -0.577 . . . . 71.400000000000006 110.943 -175.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . 0.478 HD13 ' O ' ' B' ' 163' ' ' LEU . 2.0 tm? -81.35 -33.41 32.44 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.781 -0.452 . . . . 74.010000000000005 109.781 -176.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 164' ' ' GLN . . . . . 0.449 ' O ' ' HB3' ' B' ' 167' ' ' ARG . 22.1 tt0 -57.97 -47.33 83.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.823 -0.626 . . . . 63.32 110.838 179.516 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . 0.482 ' O ' ' HB2' ' B' ' 168' ' ' LYS . 18.5 m -70.02 -31.73 69.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.933 -0.576 . . . . 74.420000000000002 111.193 179.426 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . 0.454 HD13 ' CD2' ' B' ' 160' ' ' PHE . 54.9 tp -67.53 -33.64 75.47 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.709 -0.478 . . . . 73.319999999999993 109.709 175.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' B' ' 164' ' ' GLN . 50.5 ttp180 -59.87 -36.76 77.58 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.693 -0.685 . . . . 75.530000000000001 109.879 173.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 168' ' ' LYS . . . . . 0.482 ' HB2' ' O ' ' B' ' 165' ' ' SER . 67.2 mmtt -63.76 -51.69 63.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.761 -0.654 . . . . 75.019999999999996 110.522 176.287 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 169' ' ' PHE . . . . . 0.487 ' CE1' ' HE2' ' B' ' 158' ' ' LYS . 41.0 t80 -59.47 -41.6 90.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.797 -0.638 . . . . 54.100000000000001 110.509 -178.14 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 170' ' ' ALA . . . . . 0.543 ' HB2' HD12 ' B' ' 180' ' ' LEU . . . -62.79 -42.56 99.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.214 -0.448 . . . . 74.109999999999999 111.591 178.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 49.3 m -67.22 -28.81 68.38 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.492 -0.322 . . . . 40.130000000000003 111.598 -176.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -95.51 9.57 39.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.091 0.472 . . . . 71.209999999999994 110.731 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 55.6 mmtt -118.21 156.68 28.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.84 -0.618 . . . . 72.439999999999998 110.757 179.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.2 p -87.13 -56.18 3.49 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.17 0.509 . . . . 62.420000000000002 109.681 172.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 175' ' ' SER . . . . . 0.534 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 3.4 m -55.95 -53.74 53.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.449 -0.796 . . . . 73.019999999999996 111.427 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 19.0 mtp -74.7 -20.04 60.01 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.041 -0.527 . . . . 73.549999999999997 112.163 -172.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -64.36 -36.38 83.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.09 0.472 . . . . 74.230000000000004 110.671 178.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -94.21 -11.52 30.15 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 115.792 -0.64 . . . . 53.340000000000003 109.905 -173.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 179' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' B' ' 175' ' ' SER . 62.8 mt -76.03 -51.4 12.4 Favored 'General case' 0 N--CA 1.437 -1.101 0 N-CA-C 108.971 -0.752 . . . . 70.150000000000006 108.971 174.575 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 180' ' ' LEU . . . . . 0.543 HD12 ' HB2' ' B' ' 170' ' ' ALA . 8.5 mt -92.42 -1.48 56.98 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.524 -0.762 . . . . 64.200000000000003 111.574 -171.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -60.18 -13.22 11.15 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.769 0.319 . . . . 64.120000000000005 111.729 178.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -70.21 -29.44 66.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.991 0.424 . . . . 53.399999999999999 110.782 178.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 28.5 m -114.66 -19.9 6.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.185 -0.461 . . . . 63.43 111.355 179.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 184' ' ' LEU . . . . . . . . . . . . . 83.5 mt . . . . . 0 C--N 1.325 -0.489 0 N-CA-C 109.877 -0.416 . . . . 71.239999999999995 109.877 178.398 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.594 0 N-CA-C 112.029 -0.428 . . . . 63.509999999999998 112.029 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.9 p -105.0 147.35 10.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 109.114 -0.699 . . . . 74.5 109.114 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 18.7 tp -143.58 -113.26 0.11 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.13 0.491 . . . . 73.200000000000003 111.658 -174.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 69.9 mtp -144.36 101.05 3.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.615 -0.721 . . . . 71.209999999999994 110.168 -173.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -83.2 163.38 20.82 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 110.12 -0.326 . . . . 71.319999999999993 110.12 173.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -125.99 -177.98 4.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.402 -0.363 . . . . 54.109999999999999 110.362 177.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -88.52 -139.8 6.93 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.748 -0.739 . . . . 55.439999999999998 112.143 179.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -115.49 113.39 23.61 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.782 0.325 . . . . 54.420000000000002 110.571 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.6 p -108.84 136.85 43.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.076 0.465 . . . . 73.340000000000003 110.539 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.682 ' H ' HD23 ' A' ' 10' ' ' LEU . 2.5 pt? -115.84 176.08 5.25 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.939 -0.573 . . . . 73.519999999999996 109.68 179.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 15.2 t -115.72 176.84 4.9 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.783 0.325 . . . . 53.439999999999998 110.273 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 51.4 tp -113.85 142.54 45.97 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.286 -0.416 . . . . 73.219999999999999 110.017 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.65 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -69.88 117.95 12.11 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.43 -0.35 . . . . 33.210000000000001 110.589 176.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.533 ' HB2' HG23 ' B' ' 123' ' ' ILE . . . -69.55 94.11 0.74 Allowed 'General case' 0 C--N 1.321 -0.641 0 O-C-N 123.392 0.433 . . . . 72.209999999999994 111.213 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.0 OUTLIER 78.57 -16.48 0.66 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.834 -1.075 . . . . 74.329999999999998 111.668 172.251 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.65 ' HB3' ' HB1' ' A' ' 13' ' ' ALA . 6.9 tt -71.0 -43.0 68.87 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.274 -0.421 . . . . 71.219999999999999 110.062 178.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 34.8 t -101.25 -46.79 4.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.277 0.56 . . . . 72.030000000000001 109.974 179.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 69.4 m -146.36 149.11 33.14 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.971 -0.559 . . . . 43.100000000000001 109.549 176.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.35 124.4 21.17 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.949 0.404 . . . . 61.439999999999998 111.199 -177.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.455 ' OG1' ' HA ' ' A' ' 14' ' ' ALA . 35.0 m -92.86 115.02 27.73 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.061 -0.518 . . . . 72.310000000000002 109.79 179.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 8.2 tt -134.83 136.95 42.87 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.086 -0.506 . . . . 75.430000000000007 110.155 -174.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.524 ' O ' ' HE3' ' A' ' 48' ' ' LYS . 23.4 t70 -90.55 137.72 32.13 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.045 -0.525 . . . . 61.539999999999999 111.39 -177.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 6.0 tt -141.55 122.73 12.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.016 -0.538 . . . . 63.119999999999997 109.738 176.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.671 ' HA ' ' CD ' ' B' ' 146' ' ' GLU . 37.7 m -81.0 115.77 20.63 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.554 0.692 . . . . 74.450000000000003 112.355 -171.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.419 ' HD3' ' OE2' ' B' ' 146' ' ' GLU . 0.0 OUTLIER -123.92 5.19 8.7 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.946 -1.024 . . . . 75.439999999999998 109.496 173.242 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.412 ' HB2' ' OE2' ' B' ' 146' ' ' GLU . 0.0 OUTLIER -83.54 174.87 10.21 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 115.456 -0.793 . . . . 74.549999999999997 110.8 176.962 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.435 ' HB3' ' H ' ' A' ' 28' ' ' SER . 93.6 m95 -121.7 -151.62 0.48 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.037 -0.529 . . . . 75.230000000000004 111.848 -177.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.435 ' H ' ' HB3' ' A' ' 27' ' ' TRP . 9.5 m -66.53 -51.16 59.56 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 113.625 0.972 . . . . 72.129999999999995 113.625 -169.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -70.52 99.09 1.56 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.983 0.421 . . . . 72.420000000000002 110.792 -174.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.8 m -100.74 93.44 2.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.065 -0.516 . . . . 54.210000000000001 111.355 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.454 ' CD2' HD11 ' B' ' 149' ' ' LEU . 41.3 p90 44.82 28.92 0.39 Allowed 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.227 1.011 . . . . 70.319999999999993 113.518 175.285 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.505 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 54.0 t30 -59.53 -51.94 67.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.924 0.392 . . . . 73.239999999999995 111.334 -175.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.524 ' H ' HD12 ' A' ' 33' ' ' ILE . 3.4 mp -61.1 -39.51 82.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.822 -0.627 . . . . 63.229999999999997 111.25 -175.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.3 mt -62.19 -35.44 78.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.808 0.337 . . . . 74.140000000000001 110.964 179.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 47.8 ttt180 -69.46 -44.01 72.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.219 -0.446 . . . . 65.340000000000003 110.454 177.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.505 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 36.9 mt-10 -66.02 -26.19 67.42 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.136 -0.484 . . . . 64.230000000000004 111.263 -178.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -100.01 1.06 42.14 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.275 -0.421 . . . . 71.25 111.079 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 62.29 45.61 6.61 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 113.044 0.757 . . . . 72.129999999999995 113.044 173.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.458 ' HB3' ' HB2' ' B' ' 151' ' ' PHE . 13.5 m-85 -78.16 -8.01 57.77 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.287 -0.635 . . . . 74.140000000000001 109.287 169.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 54.24 79.4 0.34 Allowed Pre-proline 0 C--O 1.233 0.211 0 CA-C-N 114.706 -1.134 . . . . 73.319999999999993 111.286 -173.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.479 ' HB3' HD12 ' B' ' 149' ' ' LEU . 7.7 Cg_exo -72.45 165.72 31.86 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.48 2.12 . . . . 74.439999999999998 110.771 175.082 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.933 ' HD2' ' HB3' ' B' ' 150' ' ' ALA . 0.1 OUTLIER -92.57 -162.18 0.91 Allowed 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.313 -0.555 . . . . 75.430000000000007 110.315 -179.511 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 42.9 t80 177.24 -30.71 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.808 0.814 . . . . 64.430000000000007 109.25 -171.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 48.6 tp -74.81 102.42 4.69 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.719 -1.128 . . . . 74.019999999999996 109.914 177.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.586 ' SG ' ' HA ' ' B' ' 147' ' ' VAL . 51.7 m -145.7 175.34 10.46 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.57 -0.741 . . . . 63.520000000000003 110.037 -179.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.568 ' OE2' ' HA ' ' B' ' 124' ' ' SER . 9.8 mm-40 -78.88 85.35 4.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.467 0.651 . . . . 63.200000000000003 110.299 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.833 HG11 ' HA ' ' B' ' 143' ' ' PHE . 24.7 t -78.04 154.38 5.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.515 -0.766 . . . . 70.040000000000006 110.714 -178.166 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.613 ' HA ' ' HA ' ' A' ' 61' ' ' SER . 0.3 OUTLIER -93.86 123.71 37.39 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 108.884 -0.784 . . . . 73.230000000000004 108.884 174.892 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.555 ' HB3' ' CD1' ' A' ' 51' ' ' PHE . 8.5 mp -74.2 88.9 1.99 Allowed 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 109.705 -0.479 . . . . 70.129999999999995 109.705 172.327 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.936 ' HB3' ' HD2' ' B' ' 142' ' ' LYS . . . -90.62 86.66 6.45 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.709 -0.678 . . . . 71.140000000000001 109.337 173.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.555 ' CD1' ' HB3' ' A' ' 49' ' ' LEU . 44.9 p90 -124.03 167.23 14.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.343 -0.844 . . . . 71.319999999999993 110.741 -173.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.7 tppt? -90.85 112.36 24.16 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.934 -0.575 . . . . 73.25 110.448 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.533 ' HB2' ' CE2' ' A' ' 51' ' ' PHE . 46.1 t -124.76 113.71 18.31 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.032 -0.531 . . . . 73.209999999999994 110.162 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 t70 64.7 24.49 12.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.736 -0.666 . . . . 74.200000000000003 111.487 173.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 105.94 -19.3 38.45 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.239 -0.982 . . . . 72.129999999999995 113.381 177.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.461 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 10.3 pt-20 -115.68 147.48 40.8 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 117.262 0.531 . . . . 62.409999999999997 111.127 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 43.6 mm -81.31 120.48 33.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.057 -0.52 . . . . 73.340000000000003 110.033 176.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.737 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 28.9 mmmt -101.78 148.9 24.74 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.992 -0.549 . . . . 75.030000000000001 109.537 179.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -121.29 109.23 14.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.97 0.414 . . . . 74.540000000000006 110.927 173.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.421 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 69.0 m-85 -117.16 101.53 8.54 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.122 0.487 . . . . 54.210000000000001 111.027 177.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.613 ' HA ' ' HA ' ' A' ' 48' ' ' LYS . 3.2 p -85.58 -12.99 50.2 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.448 -0.797 . . . . 75.099999999999994 110.241 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.67 ' OD2' ' HB3' ' A' ' 64' ' ' GLN . 33.6 t70 -127.68 113.38 15.96 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.349 -0.841 . . . . 72.329999999999998 109.396 177.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.91 -23.01 62.19 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.088 -0.505 . . . . 50.329999999999998 111.113 -175.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.67 ' HB3' ' OD2' ' A' ' 62' ' ' ASP . 0.7 OUTLIER -58.27 -50.25 74.25 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.814 -0.81 . . . . 74.439999999999998 108.814 172.172 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.1 m -64.74 -27.8 69.15 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.335 -0.848 . . . . 51.530000000000001 110.855 177.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 64.1 tp -69.05 -32.47 71.99 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.78 0.324 . . . . 70.349999999999994 110.63 177.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 62.9 ttt180 -61.55 -34.61 75.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.938 0.399 . . . . 75.420000000000002 110.177 175.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.582 ' HE2' ' OE1' ' A' ' 64' ' ' GLN . 62.8 mttm -68.63 -26.09 65.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.204 0.526 . . . . 71.120000000000005 110.607 178.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.467 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 78.1 t80 -85.83 -52.9 5.45 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.691 -0.686 . . . . 71.140000000000001 111.257 -177.233 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.46 ' HA ' ' HB2' ' A' ' 73' ' ' LYS . . . -68.04 -14.56 63.06 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.282 0.475 . . . . 62.520000000000003 112.282 -175.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.0 p -78.55 -32.04 47.67 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.758 0.313 . . . . 62.219999999999999 110.723 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.467 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 10.5 pt20 -91.65 -21.62 20.7 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.092 0.473 . . . . 43.539999999999999 109.945 177.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.46 ' HB2' ' HA ' ' A' ' 70' ' ' ALA . 29.6 mmmt -79.97 106.3 11.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.784 -0.644 . . . . 75.209999999999994 110.375 175.189 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.8 t -58.22 -37.74 75.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.964 0.411 . . . . 74.230000000000004 110.351 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.4 m -58.8 -52.41 65.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.105 -0.498 . . . . 61.539999999999999 111.141 178.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 84.1 mtp -80.5 -17.07 52.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.197 -0.456 . . . . 72.5 111.11 -175.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.625 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 25.1 ttmm -62.66 -24.6 67.7 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-N 116.279 -0.419 . . . . 75.150000000000006 110.152 175.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -92.48 -9.23 42.2 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.301 0.572 . . . . 73.5 110.132 -177.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.61 ' HB3' HG21 ' B' ' 133' ' ' ILE . 78.5 mt -95.62 -50.87 4.77 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.857 -1.065 . . . . 51.219999999999999 109.978 178.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.9 mt -90.71 -5.52 55.63 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.967 -0.56 . . . . 62.439999999999998 111.94 -172.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.625 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 64.5 pttt -58.34 -19.01 31.73 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.228 0.455 . . . . 75.209999999999994 112.228 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -76.89 -29.54 55.81 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.784 0.326 . . . . 73.299999999999997 110.865 -178.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.464 HG23 ' HG ' ' A' ' 84' ' ' LEU . 27.6 m -108.35 -27.21 3.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.403 -0.362 . . . . 62.310000000000002 111.716 -178.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.464 ' HG ' HG23 ' A' ' 83' ' ' VAL . 93.9 mt -104.16 141.62 22.91 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.658 -0.246 . . . . 65.109999999999999 110.418 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -63.32 112.68 1.8 Allowed 'Trans proline' 0 C--O 1.231 0.155 0 C-N-CA 122.67 2.247 . . . . 74.5 112.213 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -127.11 123.62 37.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.046 -0.524 . . . . 70.010000000000005 109.979 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.48 ' HB3' ' NZ ' ' A' ' 87' ' ' LYS . 8.7 mtpm? -97.03 -12.1 23.66 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.29 0.566 . . . . 54.119999999999997 110.254 178.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 . . . . . 0 C--N 1.321 -0.646 0 CA-C-N 115.371 -0.832 . . . . 70.450000000000003 110.674 -178.945 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.491 0 N-CA-C 111.839 -0.504 . . . . 63.310000000000002 111.839 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 7.7 p -118.49 110.67 31.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.63 0.729 . . . . 75.129999999999995 110.601 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 50.2 tp -159.94 142.49 13.49 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.425 -0.807 . . . . 65.409999999999997 110.16 178.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 80.8 mtp -90.89 93.69 9.33 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.667 -0.864 . . . . 70.230000000000004 108.667 174.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -100.22 141.04 33.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.716 -0.675 . . . . 53.520000000000003 111.668 -170.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -105.07 159.89 15.48 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.149 -0.932 . . . . 60.439999999999998 109.476 176.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -89.88 -142.0 9.12 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.494 -0.86 . . . . 63.240000000000002 112.733 -177.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -122.35 112.12 17.72 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.816 0.341 . . . . 72.010000000000005 111.143 -176.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 7.2 p -101.02 129.9 51.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.173 -0.467 . . . . 70.340000000000003 110.704 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -72.83 159.4 33.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.823 -0.626 . . . . 71.120000000000005 111.08 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 33.2 m -106.27 138.35 42.61 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.051 -0.522 . . . . 63.329999999999998 110.642 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 53.8 tp -89.89 136.94 32.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.367 -0.378 . . . . 60.229999999999997 110.362 178.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -90.63 124.59 35.18 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.025 -0.534 . . . . 71.420000000000002 110.809 178.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.591 ' O ' ' HA ' ' B' ' 119' ' ' ALA . . . -78.53 -22.94 46.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.933 -0.576 . . . . 72.420000000000002 112.426 -174.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -115.24 -34.01 5.14 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.839 -0.344 . . . . 70.120000000000005 110.928 -178.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 91.9 mt -76.32 -51.44 11.95 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.431 -0.35 . . . . 61.420000000000002 111.549 -178.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 14.1 m -87.72 -67.72 0.81 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.504 -0.317 . . . . 54.100000000000001 111.156 -175.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 52.0 m -146.9 136.32 22.8 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.488 -0.324 . . . . 73.299999999999997 110.533 -177.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.591 ' HA ' ' O ' ' B' ' 114' ' ' ALA . . . -60.01 114.43 2.83 Favored 'General case' 0 C--N 1.331 -0.228 0 O-C-N 123.464 0.478 . . . . 71.140000000000001 110.95 -178.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 26.4 m -125.11 135.1 52.34 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.753 -0.658 . . . . 73.349999999999994 110.427 -177.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . 0.486 HD23 ' H ' ' B' ' 121' ' ' LEU . 2.6 pt? -130.35 -177.31 4.27 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.702 -0.481 . . . . 62.229999999999997 109.702 178.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 122' ' ' ASP . . . . . 0.468 ' OD1' ' HG3' ' B' ' 148' ' ' LYS . 0.0 OUTLIER -108.03 149.62 28.19 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.288 0.566 . . . . 74.409999999999997 111.062 -178.808 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . 0.533 HG23 ' HB2' ' A' ' 14' ' ' ALA . 9.3 tt -153.01 127.6 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.345 -0.843 . . . . 55.119999999999997 108.774 174.13 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.568 ' HA ' ' OE2' ' A' ' 46' ' ' GLU . 53.0 m -63.85 115.13 4.54 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.801 0.667 . . . . 65.239999999999995 112.801 -170.212 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . 0.493 ' HD2' ' HB1' ' A' ' 14' ' ' ALA . 0.6 OUTLIER -120.22 2.89 10.89 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.826 -0.625 . . . . 65.420000000000002 109.375 173.167 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.73 -173.37 2.84 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.59 -0.732 . . . . 71.049999999999997 111.109 -178.336 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -123.04 -153.3 0.55 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.359 -0.382 . . . . 70.329999999999998 111.385 -174.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 15.1 p -86.52 -33.31 20.34 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.778 0.659 . . . . 73.420000000000002 112.778 -171.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -78.08 96.6 5.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.924 0.393 . . . . 71.129999999999995 110.217 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.614 HG12 ' CD2' ' B' ' 131' ' ' PHE . 14.4 t -120.57 114.13 42.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.205 -0.452 . . . . 61.340000000000003 110.285 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 131' ' ' PHE . . . . . 0.614 ' CD2' HG12 ' B' ' 130' ' ' VAL . 20.2 p90 47.75 21.99 0.31 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.808 1.243 . . . . 74.340000000000003 114.024 178.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.463 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 53.3 t30 -59.86 -55.23 36.78 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.713 0.292 . . . . 72.129999999999995 111.096 -176.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 133' ' ' ILE . . . . . 0.61 HG21 ' HB3' ' A' ' 79' ' ' LEU . 39.3 mm -58.84 -38.38 72.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.484 0.659 . . . . 73.319999999999993 110.771 -179.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.484 HD22 HD23 ' A' ' 49' ' ' LEU . 10.2 mp -66.3 -34.36 77.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.304 -0.862 . . . . 74.209999999999994 111.094 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -67.47 -40.38 85.31 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.036 -0.529 . . . . 72.120000000000005 110.152 178.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 136' ' ' GLU . . . . . 0.463 ' HG3' ' O ' ' B' ' 132' ' ' ASN . 27.2 mt-10 -69.16 -42.74 75.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.883 -0.599 . . . . 74.120000000000005 111.086 -178.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -87.1 1.18 53.79 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.324 -0.398 . . . . 72.129999999999995 111.396 -178.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 37.5 t70 53.78 66.99 1.08 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.681 0.753 . . . . 62.130000000000003 111.581 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -90.38 -1.35 57.9 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.281 -0.872 . . . . 73.5 109.838 171.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 57.34 67.33 2.52 Favored Pre-proline 0 C--O 1.234 0.283 0 CA-C-N 114.855 -1.066 . . . . 44.100000000000001 110.902 -176.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -74.94 161.14 39.42 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.244 1.963 . . . . 74.430000000000007 111.299 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 142' ' ' LYS . . . . . 0.936 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -97.41 179.68 4.79 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.447 -0.501 . . . . 74.329999999999998 110.256 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 143' ' ' PHE . . . . . 0.833 ' HA ' HG11 ' A' ' 47' ' ' VAL . 0.2 OUTLIER -169.34 22.36 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.554 0.692 . . . . 61.399999999999999 109.347 -172.592 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 59.0 tp -118.14 120.47 37.83 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.296 -0.865 . . . . 73.120000000000005 109.868 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 145' ' ' CYS . . . . . 0.601 ' SG ' HG22 ' A' ' 47' ' ' VAL . 24.5 p -148.31 175.0 11.45 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.949 -0.568 . . . . 74.420000000000002 109.551 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . 0.671 ' CD ' ' HA ' ' A' ' 24' ' ' SER . 5.4 mm-40 -83.28 71.98 10.2 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.624 0.726 . . . . 72.040000000000006 109.337 179.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 147' ' ' VAL . . . . . 0.586 ' HA ' ' SG ' ' A' ' 45' ' ' CYS . 91.3 t -58.1 131.78 22.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 114.578 -1.192 . . . . 74.239999999999995 111.416 -176.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . 0.468 ' HG3' ' OD1' ' B' ' 122' ' ' ASP . 0.0 OUTLIER -84.64 112.93 20.9 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 109.33 -0.618 . . . . 72.299999999999997 109.33 176.278 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.63 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 1.8 mm? -67.49 92.73 0.31 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.463 -0.79 . . . . 75.430000000000007 110.99 -178.264 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.933 ' HB3' ' HD2' ' A' ' 42' ' ' LYS . . . -88.89 78.76 7.5 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.116 -0.947 . . . . 33.329999999999998 109.368 173.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 151' ' ' PHE . . . . . 0.63 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 49.5 p90 -111.22 164.45 12.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.557 -0.747 . . . . 73.040000000000006 110.802 -176.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 6.8 tppt? -90.22 116.4 28.18 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.861 -0.609 . . . . 70.239999999999995 110.85 -177.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 153' ' ' CYS . . . . . . . . . . . . . 44.6 t -130.69 114.07 14.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.291 -0.413 . . . . 65.420000000000002 110.328 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 64.26 22.8 12.92 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.578 -0.737 . . . . 73.409999999999997 112.56 173.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 109.75 -24.52 19.32 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.143 -1.027 . . . . 70.010000000000005 112.988 176.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -112.73 149.89 32.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 117.163 0.482 . . . . 73.120000000000005 110.889 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 46.9 mm -79.81 130.91 35.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.074 -0.512 . . . . 71.519999999999996 109.953 176.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 158' ' ' LYS . . . . . 0.852 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 26.5 mmmt -100.71 157.3 16.79 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.068 -0.716 . . . . 72.099999999999994 109.068 178.212 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -132.58 109.32 9.67 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.94 0.4 . . . . 73.219999999999999 110.919 174.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 160' ' ' PHE . . . . . 0.441 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 80.2 m-85 -120.73 115.41 23.26 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.115 -0.493 . . . . 73.329999999999998 111.149 -179.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 33.9 m -98.03 4.6 49.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.187 0.518 . . . . 72.200000000000003 110.603 178.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -147.14 126.55 13.16 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.065 -0.516 . . . . 74.109999999999999 109.751 -177.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 92.5 mt -71.82 -21.27 61.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.515 -0.311 . . . . 73.340000000000003 110.859 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 164' ' ' GLN . . . . . 0.536 ' OE1' ' HE3' ' B' ' 168' ' ' LYS . 0.6 OUTLIER -69.73 -41.77 74.86 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.779 -0.822 . . . . 65.129999999999995 108.779 176.103 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 32.6 t -67.69 -42.38 82.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.295 -0.866 . . . . 63.219999999999999 109.895 175.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 64.9 tp -63.66 -31.52 72.72 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.041 -0.527 . . . . 65.329999999999998 110.489 178.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . 0.524 ' HD2' HD22 ' B' ' 184' ' ' LEU . 56.3 ttt180 -56.8 -45.86 81.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.226 -0.443 . . . . 74.150000000000006 110.868 176.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 168' ' ' LYS . . . . . 0.536 ' HE3' ' OE1' ' B' ' 164' ' ' GLN . 93.1 mttt -63.8 -30.56 71.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.123 -0.489 . . . . 34.210000000000001 110.864 -178.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -80.46 -47.88 13.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.947 -0.57 . . . . 62.5 110.61 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -66.18 -29.6 69.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.948 -0.569 . . . . 40.229999999999997 111.619 -175.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 34.2 p -68.68 -45.4 71.76 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 121.124 -0.23 . . . . 75.340000000000003 110.914 -179.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -82.88 -3.87 57.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.191 0.52 . . . . 63.409999999999997 110.858 -178.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 173' ' ' LYS . . . . . 0.423 ' HB3' ' HE3' ' B' ' 173' ' ' LYS . 24.2 mmmt -86.74 111.02 20.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.078 -0.51 . . . . 73.019999999999996 110.035 173.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 48.3 t -55.82 -37.48 68.72 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.797 0.332 . . . . 75.299999999999997 111.711 -177.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 8.6 p -78.26 -46.64 19.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.845 0.355 . . . . 51.130000000000003 111.602 -178.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 81.6 mtp -76.29 -12.79 60.14 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.352 -0.385 . . . . 61.240000000000002 111.688 -175.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . 0.548 ' O ' ' HG3' ' B' ' 186' ' ' GLN . 19.0 ttmm -57.24 -30.09 64.34 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.869 -0.605 . . . . 74.310000000000002 111.15 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -100.58 5.02 43.85 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.356 0.598 . . . . 75.439999999999998 110.716 -175.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 179' ' ' LEU . . . . . 0.493 ' HB3' HG21 ' A' ' 33' ' ' ILE . 63.4 mt -97.51 -53.59 3.4 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.578 -0.737 . . . . 74.239999999999995 110.217 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 180' ' ' LEU . . . . . 0.502 ' HB3' HD12 ' B' ' 184' ' ' LEU . 3.5 mm? -86.39 1.39 51.42 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.807 -0.633 . . . . 60.340000000000003 111.322 -176.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -49.33 -29.14 5.65 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.111 0.782 . . . . 75.310000000000002 113.111 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -73.12 -28.51 62.3 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.413 0.523 . . . . 64.140000000000001 112.413 -174.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 183' ' ' VAL . . . . . 0.748 HG23 ' HG ' ' B' ' 184' ' ' LEU . 31.5 m -112.01 -14.32 10.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.864 0.364 . . . . 51.520000000000003 111.122 179.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 184' ' ' LEU . . . . . 0.748 ' HG ' HG23 ' B' ' 183' ' ' VAL . 42.5 mt -128.54 119.63 20.49 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.12 -0.491 . . . . 70.099999999999994 110.133 -178.477 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.66 122.14 10.99 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 122.919 2.413 . . . . 74.219999999999999 112.52 -178.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 186' ' ' GLN . . . . . 0.548 ' HG3' ' O ' ' B' ' 177' ' ' LYS . 81.5 mm-40 -113.94 -149.0 0.44 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.913 -0.585 . . . . 71.519999999999996 110.948 -178.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 187' ' ' LYS . . . . . 0.462 ' HB3' ' HE2' ' B' ' 187' ' ' LYS . 29.5 mtpt 70.27 96.43 0.07 Allowed 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 124.109 0.964 . . . . 65.329999999999998 111.198 -175.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 . . . . . 0 C--N 1.306 -1.297 0 CA-C-N 114.376 -1.284 . . . . 64.420000000000002 109.399 176.898 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.659 0 N-CA-C 111.526 -0.63 . . . . 74.109999999999999 111.526 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.1 m -98.28 164.32 2.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.754 0.311 . . . . 73.540000000000006 110.716 -178.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -90.37 146.06 24.47 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.951 0.405 . . . . 73.310000000000002 110.434 -177.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 87.8 mtp -89.95 101.53 14.24 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.955 -0.566 . . . . 74.030000000000001 110.097 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -73.11 114.68 11.55 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.907 -0.588 . . . . 73.019999999999996 110.31 178.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -74.38 123.21 24.23 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.458 -0.792 . . . . 74.109999999999999 110.902 -178.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.99 51.09 3.16 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.043 -0.598 . . . . 72.400000000000006 112.101 -178.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -132.25 123.29 26.67 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.802 0.334 . . . . 71.420000000000002 110.696 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 49.1 t -79.11 129.6 37.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 109.567 -0.531 . . . . 74.430000000000007 109.567 176.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.422 HD22 ' HB3' ' B' ' 110' ' ' LEU . 85.8 mt -74.33 132.75 42.33 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.924 0.392 . . . . 54.049999999999997 111.446 -176.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.7 m -70.78 105.32 3.17 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.84 -0.618 . . . . 74.340000000000003 110.136 174.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 28.8 tp -74.4 116.92 15.62 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.085 0.469 . . . . 73.109999999999999 110.596 -178.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -83.01 -6.38 59.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.805 -0.634 . . . . 63.409999999999997 111.223 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 70.58 -53.84 0.65 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.637 0.775 . . . . 72.329999999999998 112.972 175.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -78.59 48.5 0.8 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.899 0.38 . . . . 64.329999999999998 111.778 -173.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.4 mp 49.3 32.76 4.64 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.842 0.682 . . . . 72.200000000000003 112.842 174.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.0 t -71.67 -27.01 62.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.141 0.496 . . . . 51.140000000000001 110.054 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.9 t -154.76 138.57 16.21 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.616 -0.883 . . . . 63.310000000000002 108.616 174.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -84.46 120.88 26.82 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.105 0.479 . . . . 41.420000000000002 112.151 -174.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.1 m -88.65 143.26 27.05 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.383 -0.826 . . . . 73.409999999999997 109.697 174.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.476 ' HG ' ' HG ' ' B' ' 112' ' ' LEU . 66.9 mt -82.26 162.54 22.28 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.069 0.462 . . . . 74.129999999999995 111.327 -179.088 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -131.13 151.0 51.9 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.382 -0.826 . . . . 72.420000000000002 109.927 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.6 tp -119.43 125.48 74.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 121.321 0.581 . . . . 74.230000000000004 110.805 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.8 p -140.66 104.88 4.82 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.753 -0.658 . . . . 61.25 110.343 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.499 ' C ' ' HG3' ' A' ' 26' ' ' GLN . 0.0 OUTLIER -114.61 89.53 3.12 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.501 -0.318 . . . . 73.25 111.323 176.719 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.499 ' HG3' ' C ' ' A' ' 25' ' ' LYS . 0.1 OUTLIER 40.99 92.94 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 114.435 1.272 . . . . 71.530000000000001 114.435 174.755 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -87.7 -29.19 21.3 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.656 -0.702 . . . . 73.219999999999999 109.984 177.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.2 m -90.19 15.9 9.49 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.495 -0.775 . . . . 73.340000000000003 111.914 -174.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.48 ' OD1' ' HB3' ' A' ' 32' ' ' ASN . 47.0 t30 -77.52 74.04 4.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.603 0.716 . . . . 74.439999999999998 109.899 177.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 42.3 t -120.95 -59.29 2.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.209 -0.905 . . . . 73.540000000000006 109.849 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -74.46 -18.98 60.56 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.673 -0.694 . . . . 75.140000000000001 110.838 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.519 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 6.8 t30 -62.42 -44.15 97.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.319 -0.4 . . . . 55.420000000000002 111.124 -178.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 39.5 mm -55.39 -46.22 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-O 121.332 0.587 . . . . 60.229999999999997 110.705 177.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.524 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 68.7 mt -65.46 -32.59 74.29 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.684 -0.689 . . . . 64.329999999999998 111.178 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -70.0 -38.99 76.15 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.798 0.332 . . . . 61.399999999999999 110.219 177.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 6.0 mm-40 -70.21 -23.08 62.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.172 -0.467 . . . . 75.430000000000007 110.819 179.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 28.9 m-80 -99.59 1.95 44.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.227 -0.442 . . . . 73.319999999999993 110.927 177.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 60.85 43.47 11.9 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.543 -0.753 . . . . 74.200000000000003 112.185 176.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.524 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 3.4 m-85 -80.06 -11.66 59.75 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.875 -0.602 . . . . 74.129999999999995 109.451 171.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 57.32 73.93 0.72 Allowed Pre-proline 0 C--O 1.231 0.108 0 CA-C-N 114.806 -1.088 . . . . 71.230000000000004 111.054 -175.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.558 ' C ' ' HE2' ' A' ' 42' ' ' LYS . 83.3 Cg_endo -86.42 147.27 8.66 Favored 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.735 2.29 . . . . 71.400000000000006 111.685 177.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.558 ' HE2' ' C ' ' A' ' 41' ' ' PRO . 1.4 mpmm? -95.19 159.07 15.18 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.326 0.584 . . . . 72.040000000000006 111.072 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.406 ' HA ' HG13 ' B' ' 147' ' ' VAL . 28.9 t80 -157.21 31.34 0.29 Allowed 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 107.754 -1.202 . . . . 74.329999999999998 107.754 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 59.7 tp -69.2 105.12 2.39 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.47 -1.241 . . . . 74.310000000000002 111.017 -175.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.458 ' C ' ' H ' ' A' ' 47' ' ' VAL . 78.2 m -86.08 99.9 11.8 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.781 -0.645 . . . . 64.319999999999993 110.023 176.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -76.57 23.78 0.15 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.834 -0.621 . . . . 71.409999999999997 110.653 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.458 ' H ' ' C ' ' A' ' 45' ' ' CYS . 43.4 t -82.81 99.07 5.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.378 0.609 . . . . 64.140000000000001 111.237 -174.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.0 112.35 5.26 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.145 -0.934 . . . . 75.109999999999999 108.867 172.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.858 ' H ' HD23 ' A' ' 49' ' ' LEU . 0.3 OUTLIER -76.15 91.47 3.16 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.32 0.581 . . . . 54.520000000000003 110.891 -175.404 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.638 ' HB2' HG23 ' A' ' 59' ' ' THR . . . -84.54 78.32 9.86 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.177 -0.92 . . . . 72.239999999999995 109.638 173.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.443 ' HB3' ' HA ' ' B' ' 141' ' ' PRO . 52.1 p90 -97.98 162.57 13.16 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.012 -0.54 . . . . 63.399999999999999 110.791 -174.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -93.17 119.73 32.69 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.118 -0.492 . . . . 73.349999999999994 110.078 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.479 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 45.4 t -128.7 108.96 10.9 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.372 -0.376 . . . . 54.149999999999999 110.621 178.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.5 t70 72.88 2.15 4.27 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.581 -0.736 . . . . 70.349999999999994 111.97 171.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 129.39 -25.87 4.46 Favored Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.184 -1.008 . . . . 63.210000000000001 112.587 179.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.493 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 11.2 pt-20 -106.07 149.18 26.96 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.643 -0.423 . . . . 63.439999999999998 110.788 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 44.6 mm -84.39 117.14 29.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.032 -0.531 . . . . 71.140000000000001 109.778 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.584 ' HB3' ' CE1' ' A' ' 60' ' ' PHE . 30.1 mmmt -99.2 102.43 14.08 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.328 -0.396 . . . . 64.439999999999998 110.362 -177.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.638 HG23 ' HB2' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -82.86 101.91 11.3 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.242 -0.435 . . . . 75.510000000000005 110.588 178.186 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.584 ' CE1' ' HB3' ' A' ' 58' ' ' LYS . 4.8 m-85 -108.25 136.1 48.47 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.43 -0.35 . . . . 64.409999999999997 111.576 -177.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.4 p -118.73 -0.46 11.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.996 -0.547 . . . . 71.329999999999998 111.006 174.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -130.43 135.58 48.14 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 120.853 0.359 . . . . 74.040000000000006 111.841 -177.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.9 tp -70.69 -34.96 72.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.713 -0.676 . . . . 74.239999999999995 109.594 174.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -57.45 -44.98 85.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.607 -0.724 . . . . 75.150000000000006 110.615 176.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.435 ' O ' ' HG3' ' A' ' 68' ' ' LYS . 50.9 m -69.75 -33.12 72.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.842 -0.617 . . . . 75.349999999999994 110.829 179.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 46.6 tp -68.22 -37.79 81.21 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.993 -0.373 . . . . 72.5 109.993 177.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 51.6 ttp180 -58.6 -50.16 74.82 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.874 -0.603 . . . . 73.420000000000002 111.0 178.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.528 ' HD3' ' N ' ' A' ' 69' ' ' PHE . 0.0 OUTLIER -67.7 -39.59 84.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.799 0.333 . . . . 65.310000000000002 111.396 -178.202 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.528 ' N ' ' HD3' ' A' ' 68' ' ' LYS . 74.0 t80 -67.11 -44.83 78.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.897 -0.592 . . . . 72.340000000000003 110.933 -178.58 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.74 -30.01 70.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.347 -0.388 . . . . 61.420000000000002 111.134 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.8 t -72.72 -35.16 67.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.34 -0.391 . . . . 53.030000000000001 110.818 -178.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -86.81 -11.9 49.57 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.035 0.445 . . . . 74.549999999999997 110.729 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.479 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 27.3 mmmt -89.82 122.77 33.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.095 -0.502 . . . . 74.019999999999996 110.2 175.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.5 m -63.99 -38.65 91.85 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.585 0.231 . . . . 65.140000000000001 111.344 -178.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.408 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 10.7 p -72.98 -40.23 65.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.882 0.372 . . . . 55.409999999999997 111.367 -179.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.469 ' HA ' HD12 ' A' ' 79' ' ' LEU . 74.3 mtp -85.18 -15.21 44.46 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.935 0.346 . . . . 53.32 111.935 -174.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 81.0 tttt -59.84 -37.47 79.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.217 -0.447 . . . . 65.25 111.79 -174.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.631 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 28.2 mt-10 -102.51 7.74 40.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.644 0.735 . . . . 54.119999999999997 110.651 -176.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.649 ' HB3' HG21 ' B' ' 133' ' ' ILE . 70.0 mt -87.3 -41.18 13.85 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.138 -0.937 . . . . 75.340000000000003 109.549 174.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -101.02 6.44 43.46 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.609 -0.723 . . . . 64.030000000000001 110.509 -178.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.631 ' HB3' ' HA ' ' A' ' 78' ' ' GLU . 18.8 ptmt -61.27 -12.83 14.86 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.447 -0.797 . . . . 74.329999999999998 112.124 -178.147 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -81.57 -46.08 14.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.751 0.31 . . . . 73.329999999999998 110.931 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 24.6 m -84.62 -18.83 9.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.1 0.476 . . . . 73.549999999999997 110.66 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 55.3 mt -107.61 98.24 23.41 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 108.448 -0.945 . . . . 72.430000000000007 108.448 171.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -46.57 91.02 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 123.983 3.122 . . . . 41.43 114.849 -168.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -144.75 104.57 4.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.372 -0.831 . . . . 75.109999999999999 108.988 174.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -83.32 -32.46 26.29 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.969 0.414 . . . . 75.510000000000005 110.373 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.451 -0.418 0 CA-C-N 115.91 -0.586 . . . . 63.450000000000003 110.55 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.239 0 N-CA-C 112.288 -0.325 . . . . 73.120000000000005 112.288 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 31.2 m -131.46 157.0 43.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.972 -0.381 . . . . 63.520000000000003 109.972 177.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 80.8 mt -74.81 118.84 18.22 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.404 -0.362 . . . . 63.039999999999999 110.809 178.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 24.5 ptp -71.95 114.35 9.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.236 0.541 . . . . 75.099999999999994 109.695 175.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -80.56 92.8 5.97 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 122.033 0.921 . . . . 73.129999999999995 110.48 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -73.25 118.52 16.3 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.341 -1.3 . . . . 54.539999999999999 110.445 178.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -77.56 61.01 3.63 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 121.121 -0.562 . . . . 73.019999999999996 112.014 178.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -96.38 106.38 18.6 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.707 0.289 . . . . 62.219999999999999 110.318 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 39.3 t -71.99 110.53 5.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.473 -0.565 . . . . 75.030000000000001 109.473 177.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 110' ' ' LEU . . . . . 0.422 ' HB3' HD22 ' A' ' 10' ' ' LEU . 92.0 mt -92.66 134.42 35.04 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.17 0.509 . . . . 74.530000000000001 110.98 -175.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 91.3 m -81.87 119.33 23.78 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.683 -0.69 . . . . 70.319999999999993 110.207 177.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . 0.476 ' HG ' ' HG ' ' A' ' 21' ' ' LEU . 0.2 OUTLIER -62.65 130.74 46.37 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.229 -0.656 . . . . 74.129999999999995 109.229 177.546 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.61 4.15 1.54 Allowed 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.518 0.562 . . . . 73.310000000000002 112.518 -177.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . 68.96 -74.08 0.08 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.68 0.792 . . . . 70.420000000000002 112.933 174.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -81.73 63.65 6.09 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.454 0.539 . . . . 55.210000000000001 112.454 -166.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 94.3 mt 59.51 8.73 1.29 Allowed 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.51 0.929 . . . . 73.219999999999999 113.51 170.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 22.4 t -68.78 -44.8 72.88 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.065 0.459 . . . . 62.399999999999999 110.85 -176.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 26.6 t -134.71 89.92 2.59 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.859 0.361 . . . . 60.210000000000001 110.165 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -138.67 90.72 2.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.146 -0.479 . . . . 44.210000000000001 110.448 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 89.7 m -156.76 125.54 5.87 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.988 -0.551 . . . . 71.450000000000003 109.608 179.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . 0.676 HD21 HG22 ' B' ' 123' ' ' ILE . 8.8 tt -154.41 139.16 17.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.489 -0.323 . . . . 74.439999999999998 110.508 -176.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -143.2 101.38 3.8 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.167 0.508 . . . . 74.340000000000003 110.288 173.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . 0.676 HG22 HD21 ' B' ' 121' ' ' LEU . 7.1 tp -146.71 114.03 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 109.023 -0.732 . . . . 70.120000000000005 109.023 173.032 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 19.9 p -170.02 165.65 9.37 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.918 -0.583 . . . . 73.030000000000001 109.863 -172.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -128.77 -60.19 1.11 Allowed 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 116.35 -0.386 . . . . 75.140000000000001 111.021 -178.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -143.39 122.27 12.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.157 -0.474 . . . . 74.120000000000005 110.968 -173.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -109.76 -34.61 6.41 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.293 -0.412 . . . . 74.349999999999994 110.886 177.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 5.4 m -90.08 13.32 15.25 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.216 -0.447 . . . . 61.340000000000003 112.026 -173.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -81.56 81.29 7.7 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.334 0.588 . . . . 61.009999999999998 111.259 -175.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.55 HG13 ' HD1' ' B' ' 131' ' ' PHE . 3.2 p -134.74 -44.44 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.383 -0.826 . . . . 73.219999999999999 109.018 170.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 131' ' ' PHE . . . . . 0.55 ' HD1' HG13 ' B' ' 130' ' ' VAL . 40.5 p90 -104.2 -1.03 27.75 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.865 -0.607 . . . . 74.120000000000005 109.604 174.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -63.02 -63.54 1.17 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.136 -0.938 . . . . 64.310000000000002 111.72 -173.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 133' ' ' ILE . . . . . 0.649 HG21 ' HB3' ' A' ' 79' ' ' LEU . 48.6 mm -60.45 -37.58 75.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.399 0.618 . . . . 64.230000000000004 110.609 -178.326 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.542 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 79.0 mt -60.94 -40.03 91.71 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.473 -0.785 . . . . 52.539999999999999 111.143 179.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' B' ' 135' ' ' ARG . 28.4 ttt180 -65.61 -42.93 91.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.733 0.301 . . . . 54.109999999999999 110.359 177.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -61.33 -35.62 77.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.867 -0.606 . . . . 64.239999999999995 111.317 -179.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -98.09 9.21 43.42 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.186 -0.461 . . . . 74.340000000000003 110.841 -179.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 63.1 41.09 8.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.422 -0.808 . . . . 74.219999999999999 112.619 171.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 139' ' ' PHE . . . . . 0.542 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 26.3 m-85 -74.01 -15.39 61.09 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.541 -0.54 . . . . 73.420000000000002 109.541 170.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 52.5 74.62 0.75 Allowed Pre-proline 0 C--O 1.234 0.262 0 CA-C-N 114.89 -1.05 . . . . 71.109999999999999 110.952 -176.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.443 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 95.8 Cg_endo -88.22 178.42 3.04 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.875 2.383 . . . . 74.439999999999998 111.904 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 142' ' ' LYS . . . . . 0.476 ' H ' ' HA ' ' A' ' 49' ' ' LEU . 0.7 OUTLIER -127.07 141.54 51.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.33 0.586 . . . . 51.439999999999998 111.211 -179.77 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -141.31 50.37 1.61 Allowed 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 107.267 -1.383 . . . . 70.340000000000003 107.267 177.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.55 86.71 1.59 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.702 -1.135 . . . . 74.439999999999998 111.301 -171.723 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 71.3 m -83.06 69.97 9.95 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.229 0.538 . . . . 72.540000000000006 110.051 175.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.34 44.67 1.16 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.455 0.645 . . . . 74.230000000000004 109.609 177.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 147' ' ' VAL . . . . . 0.406 HG13 ' HA ' ' A' ' 43' ' ' PHE . 85.8 t -76.72 101.9 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 115.26 -0.882 . . . . 63.420000000000002 109.825 178.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -131.93 111.27 11.41 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.276 -0.874 . . . . 74.140000000000001 109.756 178.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.787 HD23 ' H ' ' B' ' 149' ' ' LEU . 0.3 OUTLIER -76.96 90.11 3.54 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.273 -0.421 . . . . 71.230000000000004 110.692 -178.34 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.589 ' HA ' ' O ' ' B' ' 158' ' ' LYS . . . -80.15 85.0 5.76 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.531 -0.759 . . . . 71.299999999999997 109.831 174.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 151' ' ' PHE . . . . . 0.408 ' HB2' ' HB3' ' A' ' 39' ' ' PHE . 52.1 p90 -104.67 165.5 11.02 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.924 -0.58 . . . . 74.099999999999994 110.319 -177.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 2.4 tppp? -93.65 116.11 28.59 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.006 -0.543 . . . . 65.319999999999993 110.032 176.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 153' ' ' CYS . . . . . . . . . . . . . 23.1 t -88.85 -131.61 0.08 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.322 -0.854 . . . . 75.409999999999997 110.028 178.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -74.06 35.98 0.09 Allowed 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 123.962 0.905 . . . . 71.439999999999998 111.556 -179.068 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 110.59 -17.18 28.39 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.676 -0.773 . . . . 60.409999999999997 111.541 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 156' ' ' GLU . . . . . 0.431 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 13.1 pt-20 -106.06 140.85 38.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.879 0.371 . . . . 74.450000000000003 110.631 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 41.3 mm -82.93 120.65 34.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 109.494 -0.558 . . . . 64.439999999999998 109.494 176.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 158' ' ' LYS . . . . . 0.589 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 31.6 mmmt -103.99 132.75 49.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.682 0.277 . . . . 63.329999999999998 111.084 -176.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -112.58 103.7 11.76 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.212 -0.449 . . . . 74.430000000000007 111.377 177.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 160' ' ' PHE . . . . . 0.461 ' CD2' HD13 ' B' ' 166' ' ' LEU . 64.6 m-85 -120.01 143.69 47.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.135 -0.484 . . . . 63.450000000000003 110.722 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 18.9 p -118.57 -18.37 9.08 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.49 0.662 . . . . 50.329999999999998 109.481 173.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -111.16 138.66 47.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.293 -0.867 . . . . 63.329999999999998 109.206 178.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.9 pp -81.69 -10.96 59.25 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.858 -0.423 . . . . 72.349999999999994 109.858 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -65.49 -51.98 56.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.364 0.602 . . . . 72.140000000000001 109.83 175.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . 0.519 ' O ' ' HG3' ' B' ' 168' ' ' LYS . 0.3 OUTLIER -70.42 -31.64 68.91 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.363 -0.835 . . . . 53.329999999999998 110.623 179.287 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . 0.461 HD13 ' CD2' ' B' ' 160' ' ' PHE . 68.7 tp -69.99 -41.36 74.51 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.179 -0.464 . . . . 72.129999999999995 110.593 177.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . 0.67 ' HG3' HD13 ' B' ' 184' ' ' LEU . 50.6 ttp180 -61.88 -47.63 84.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.364 -0.38 . . . . 74.310000000000002 110.772 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 168' ' ' LYS . . . . . 0.519 ' HG3' ' O ' ' B' ' 165' ' ' SER . 0.0 OUTLIER -65.22 -36.54 84.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.925 0.393 . . . . 40.439999999999998 110.879 -179.711 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -65.52 -48.62 71.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.738 -0.665 . . . . 74.120000000000005 110.606 175.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.02 -37.04 83.41 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.403 -0.362 . . . . 60.130000000000003 111.446 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 10.9 t -68.43 -22.31 64.61 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.401 -0.363 . . . . 50.420000000000002 111.26 -177.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -102.05 3.53 38.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.955 0.407 . . . . 73.409999999999997 110.633 178.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 173' ' ' LYS . . . . . 0.45 ' O ' ' HB2' ' B' ' 177' ' ' LYS . 27.4 mmmt -104.27 111.81 24.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.181 -0.463 . . . . 72.439999999999998 110.747 -179.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 25.2 m -52.8 -31.75 40.38 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 123.241 0.338 . . . . 43.43 111.898 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 11.0 p -81.84 -49.49 10.3 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.757 0.313 . . . . 63.420000000000002 111.622 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.457 ' HA ' HD12 ' B' ' 179' ' ' LEU . 82.1 mtp -80.78 -18.61 47.04 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.201 0.445 . . . . 72.109999999999999 112.201 -172.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . 0.45 ' HB2' ' O ' ' B' ' 173' ' ' LYS . 79.8 tttt -60.88 -31.31 70.79 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.183 -0.462 . . . . 74.430000000000007 110.936 -176.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . 0.925 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 44.4 mt-10 -99.15 3.28 46.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.457 0.646 . . . . 65.439999999999998 110.641 -174.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 179' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' B' ' 176' ' ' MET . 86.3 mt -93.38 -56.44 2.94 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.464 -0.789 . . . . 54.219999999999999 110.378 178.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 180' ' ' LEU . . . . . 0.43 ' HB3' HD12 ' B' ' 184' ' ' LEU . 3.5 mm? -76.54 -10.98 59.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.665 -0.698 . . . . 64.310000000000002 111.666 -176.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 181' ' ' LYS . . . . . 0.925 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 17.5 ptmt -61.37 -9.43 5.36 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.851 0.686 . . . . 72.310000000000002 112.851 -174.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -76.09 -31.91 58.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.998 0.428 . . . . 65.409999999999997 110.585 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 20.8 m -113.24 -10.77 12.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.016 -0.538 . . . . 61.310000000000002 110.806 178.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 184' ' ' LEU . . . . . 0.67 HD13 ' HG3' ' B' ' 167' ' ' ARG . 95.7 mt -110.62 109.43 57.95 Favored Pre-proline 0 C--N 1.327 -0.388 0 N-CA-C 108.977 -0.749 . . . . 71.239999999999995 108.977 173.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -45.04 96.47 0.03 OUTLIER 'Trans proline' 0 C--O 1.238 0.477 0 C-N-CA 124.201 3.267 . . . . 71.209999999999994 114.57 -170.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 186' ' ' GLN . . . . . 0.751 ' HB2' ' HB2' ' B' ' 181' ' ' LYS . 79.2 mt-30 -139.63 104.76 5.0 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.717 -0.846 . . . . 74.209999999999994 108.717 172.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -72.46 -47.71 46.72 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.233 -0.439 . . . . 61.439999999999998 111.735 -173.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 . . . . . 0 C--O 1.245 0.83 0 CA-C-O 118.529 -0.748 . . . . 73.450000000000003 110.269 -177.98 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.71 0 N-CA-C 111.623 -0.591 . . . . 64.439999999999998 111.623 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 42.6 t -91.43 -55.4 6.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.734 -0.469 . . . . 74.030000000000001 109.734 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 19.8 tp -90.6 151.48 21.29 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.766 -0.652 . . . . 72.049999999999997 109.696 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -76.84 104.55 7.4 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.412 0.625 . . . . 61.109999999999999 110.435 178.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -107.73 156.09 19.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.797 -0.638 . . . . 73.409999999999997 110.033 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -133.8 135.73 44.03 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.156 -0.474 . . . . 60.140000000000001 110.199 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -96.64 -95.65 1.85 Allowed Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.613 -0.803 . . . . 53.310000000000002 112.201 -179.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -147.89 168.31 22.55 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.667 0.27 . . . . 74.109999999999999 111.115 -177.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 24.3 m -98.97 153.67 4.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.118 -0.492 . . . . 64.340000000000003 110.549 177.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.1 pp -91.32 173.03 8.13 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.244 -0.435 . . . . 62.439999999999998 110.356 177.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.3 m -124.61 120.73 32.74 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.289 0.566 . . . . 73.209999999999994 111.388 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.551 HD23 ' N ' ' A' ' 13' ' ' ALA . 4.4 tt -114.33 142.4 46.37 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.213 -1.032 . . . . 74.140000000000001 108.213 176.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.843 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -104.57 102.79 12.39 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.836 0.351 . . . . 63.119999999999997 111.281 -176.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 18' ' ' SER . . . -67.29 -34.22 76.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.179 -0.464 . . . . 71.109999999999999 111.707 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -100.48 -41.79 6.85 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.867 0.365 . . . . 72.549999999999997 111.304 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.843 ' HB3' ' HB1' ' A' ' 13' ' ' ALA . 57.0 tp -72.85 -27.2 61.79 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.18 -0.464 . . . . 74.140000000000001 111.804 -175.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 31.4 t -119.34 -47.81 2.44 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.886 -0.326 . . . . 74.219999999999999 111.087 -177.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 19.8 m -84.56 52.67 2.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.893 0.378 . . . . 50.43 111.648 -178.211 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -94.16 174.41 7.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.355 -0.384 . . . . 64.109999999999999 110.048 177.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.9 t -91.72 158.64 16.26 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.74 -0.384 . . . . 74.019999999999996 110.561 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.431 HD23 ' N ' ' A' ' 21' ' ' LEU . 2.2 pt? -139.74 20.15 2.51 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.321 -0.4 . . . . 74.420000000000002 111.171 -177.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -95.1 173.44 7.57 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.216 -0.29 . . . . 74.030000000000001 110.216 -179.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 10.7 tt -126.7 -43.77 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 C-N-CA 120.953 -0.299 . . . . 74.340000000000003 111.709 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.4 m -153.65 157.03 38.98 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.057 -0.402 . . . . 73.400000000000006 111.872 -176.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.827 ' HD3' ' HA ' ' B' ' 164' ' ' GLN . 0.0 OUTLIER -168.07 21.2 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.733 -0.667 . . . . 71.099999999999994 109.333 175.325 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -68.13 122.78 19.01 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.586 -0.734 . . . . 75.409999999999997 111.399 -171.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 8.1 t-105 -150.32 -174.2 4.67 Favored 'General case' 0 N--CA 1.442 -0.831 0 N-CA-C 108.329 -0.989 . . . . 72.319999999999993 108.329 178.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 15.2 m -96.83 -1.59 45.81 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.315 0.579 . . . . 63.020000000000003 110.762 -172.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -84.17 14.22 4.47 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.836 -0.62 . . . . 65.120000000000005 111.392 -175.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.599 HG12 HD13 ' B' ' 163' ' ' LEU . 17.4 m -60.82 -47.67 92.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 112.346 0.499 . . . . 74.430000000000007 112.346 -176.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -104.99 2.34 29.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.637 0.256 . . . . 63.310000000000002 111.062 -176.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.591 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 6.5 t30 -65.69 -42.5 91.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.27 -0.423 . . . . 63.539999999999999 110.922 -173.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.63 HG21 ' HB3' ' B' ' 179' ' ' LEU . 30.2 mm -74.26 -32.8 32.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.643 0.735 . . . . 62.240000000000002 110.479 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.507 HD12 HD23 ' B' ' 149' ' ' LEU . 76.6 mt -70.75 -34.48 71.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.387 -0.824 . . . . 70.010000000000005 111.749 -175.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.569 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 7.9 ptm180 -69.62 -37.24 76.76 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.969 0.414 . . . . 61.109999999999999 110.536 178.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.591 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 38.2 mt-10 -63.33 -44.68 94.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.61 -0.723 . . . . 75.140000000000001 111.387 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 -95.41 5.99 50.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.255 -0.43 . . . . 75.200000000000003 110.973 -175.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 55.48 65.77 1.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.355 -0.839 . . . . 74.010000000000005 112.685 177.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.409 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 4.6 m-85 -90.53 -3.61 57.48 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.461 -0.791 . . . . 73.310000000000002 109.397 170.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.402 ' O ' ' HA ' ' B' ' 151' ' ' PHE . 45.3 mt-10 56.98 71.17 1.18 Allowed Pre-proline 0 CA--C 1.53 0.186 0 CA-C-N 114.958 -1.019 . . . . 64.420000000000002 111.565 -179.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.402 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 85.1 Cg_endo -85.18 170.11 9.69 Favored 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 122.456 2.104 . . . . 63.409999999999997 111.693 177.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.651 ' HD3' ' HB3' ' B' ' 150' ' ' ALA . 5.1 mptp? -93.46 -178.58 4.77 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 121.07 -0.252 . . . . 73.430000000000007 110.359 179.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 73.8 t80 172.93 -40.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.426 0.631 . . . . 74.409999999999997 110.469 -169.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -78.16 98.15 5.73 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.104 -0.953 . . . . 73.439999999999998 110.667 -177.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 37.1 t -130.63 157.71 42.0 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.953 -0.567 . . . . 73.430000000000007 109.561 179.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.5 mp0 -73.22 92.47 1.76 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.178 0.513 . . . . 71.530000000000001 110.488 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.631 HG22 ' SG ' ' B' ' 145' ' ' CYS . 3.0 t -81.37 163.04 3.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.818 -0.628 . . . . 61.229999999999997 109.927 179.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.74 118.77 36.52 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.475 0.655 . . . . 74.420000000000002 109.79 174.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.79 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.9 mp -75.55 94.8 3.22 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.353 -0.84 . . . . 70.409999999999997 110.949 -175.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -87.25 59.33 5.5 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.637 -0.505 . . . . 63.340000000000003 109.637 172.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.79 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 54.9 p90 -88.08 166.94 14.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.097 -0.501 . . . . 74.239999999999995 110.713 -176.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.4 tppp? -96.15 131.51 42.52 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.524 -0.762 . . . . 73.439999999999998 110.415 179.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.473 ' SG ' ' HE2' ' A' ' 69' ' ' PHE . 49.7 t -139.35 107.73 5.82 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.869 0.366 . . . . 73.219999999999999 110.478 175.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 t70 70.54 13.56 7.36 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.429 -0.805 . . . . 74.040000000000006 111.56 172.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 120.17 -29.6 5.92 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.291 -0.957 . . . . 64.510000000000005 112.702 177.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.449 ' CD ' ' HD3' ' A' ' 58' ' ' LYS . 12.7 pt-20 -102.17 155.2 18.36 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 110.064 -0.347 . . . . 75.299999999999997 110.064 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 47.8 mm -86.86 129.2 38.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.494 -0.558 . . . . 74.319999999999993 109.494 176.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.561 ' HB3' ' CE2' ' A' ' 60' ' ' PHE . 31.7 mmmt -117.56 97.01 5.65 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 121.266 -0.174 . . . . 44.450000000000003 110.767 -176.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.58 ' HA ' ' O ' ' A' ' 49' ' ' LEU . 0.6 OUTLIER -79.09 110.31 14.22 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.872 0.323 . . . . 70.129999999999995 111.872 -179.855 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.561 ' CE2' ' HB3' ' A' ' 58' ' ' LYS . 82.6 m-85 -129.47 140.1 51.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.803 0.335 . . . . 65.5 110.369 176.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.7 p -124.01 13.32 9.09 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.234 0.54 . . . . 62.43 110.557 176.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -140.01 -177.74 5.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.849 -0.614 . . . . 72.209999999999994 110.738 -176.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.47 HD13 HG22 ' B' ' 130' ' ' VAL . 26.6 tp -127.91 32.6 4.91 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.746 -0.661 . . . . 33.549999999999997 109.972 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -120.82 -42.66 2.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.171 0.51 . . . . 64.329999999999998 109.871 177.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.6 m -81.14 -43.05 19.96 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.641 -0.503 . . . . 55.43 109.641 174.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.544 HD12 ' HB2' ' A' ' 60' ' ' PHE . 5.9 tt -63.4 -41.52 98.76 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.447 -0.575 . . . . 62.409999999999997 109.447 177.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.6 ttt180 -60.0 -38.66 83.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.808 -0.633 . . . . 73.040000000000006 110.996 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.1 mtmm -64.71 -43.24 94.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.935 0.397 . . . . 70.349999999999994 110.673 175.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.473 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 64.1 t80 -63.44 -44.91 93.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.002 -0.545 . . . . 74.420000000000002 110.541 179.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.46 -25.58 66.79 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.855 -0.612 . . . . 64.530000000000001 111.95 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.1 t -80.71 -28.48 36.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.506 0.193 . . . . 73.409999999999997 111.21 -177.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -88.38 -19.32 26.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.209 0.528 . . . . 75.439999999999998 110.16 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -86.68 118.8 26.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.586 -0.733 . . . . 70.129999999999995 110.67 176.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.4 m -62.21 -40.33 95.75 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.004 0.43 . . . . 74.040000000000006 110.303 178.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.402 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 36.4 t -63.67 -49.11 74.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.679 -0.691 . . . . 73.420000000000002 110.787 -179.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 68.9 mtp -78.62 -14.99 59.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.295 -0.411 . . . . 70.109999999999999 111.183 -175.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.434 ' HB2' ' HE3' ' A' ' 77' ' ' LYS . 38.8 ttmt -64.3 -32.65 74.34 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.082 -0.508 . . . . 61.219999999999999 110.549 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.469 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 20.6 mm-40 -88.99 -4.26 58.48 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 121.639 0.733 . . . . 65.120000000000005 110.127 -178.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.612 ' HB3' HG21 ' B' ' 133' ' ' ILE . 49.0 mt -95.19 -52.96 3.97 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.835 -1.075 . . . . 73.030000000000001 109.583 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.682 ' HB3' HD13 ' A' ' 84' ' ' LEU . 4.1 mm? -84.8 -0.75 54.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.298 -0.864 . . . . 71.329999999999998 111.412 -176.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.469 ' HD3' ' HA ' ' A' ' 78' ' ' GLU . 64.7 pttt -56.74 -14.44 3.34 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 111.895 0.331 . . . . 62.149999999999999 111.895 176.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -63.4 -42.11 98.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.995 0.426 . . . . 75.230000000000004 110.862 176.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.411 HG13 HD12 ' A' ' 84' ' ' LEU . 7.5 p -111.52 -15.64 9.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.308 0.575 . . . . 64.120000000000005 111.009 -176.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.682 HD13 ' HB3' ' A' ' 80' ' ' LEU . 11.2 mp -90.33 129.45 45.37 Favored Pre-proline 0 C--N 1.327 -0.412 0 N-CA-C 109.882 -0.414 . . . . 54.520000000000003 109.882 173.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 84' ' ' LEU . 27.4 Cg_exo -61.45 102.15 0.22 Allowed 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 123.024 2.483 . . . . 73.340000000000003 112.527 -177.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -141.79 145.46 34.79 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.147 -0.478 . . . . 64.530000000000001 109.72 -178.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt 52.32 37.58 22.67 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 123.861 0.726 . . . . 75.120000000000005 111.66 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 . . . . . 0 C--N 1.317 -0.821 0 CA-C-N 115.404 -0.816 . . . . 62.130000000000003 111.103 -179.358 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.301 0 N-CA-C 112.023 -0.431 . . . . 32.520000000000003 112.023 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 48.7 t -87.76 -45.51 16.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 109.513 -0.551 . . . . 45.439999999999998 109.513 178.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 3.5 pp -140.64 153.12 45.9 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.373 -0.831 . . . . 64.230000000000004 109.914 175.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 89.6 mmm -115.29 108.35 16.45 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.906 0.384 . . . . 73.239999999999995 111.16 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -75.17 119.04 18.77 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.107 -0.701 . . . . 62.25 109.107 171.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -138.47 104.15 5.07 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.036 -0.529 . . . . 74.129999999999995 110.423 -172.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -176.27 -35.91 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.727 -0.749 . . . . 74.200000000000003 112.369 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -79.16 75.97 5.69 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.31 0.576 . . . . 64.329999999999998 111.244 -178.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 70.2 t -97.76 128.36 49.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.718 -0.674 . . . . 75.030000000000001 110.324 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 110' ' ' LEU . . . . . 0.792 HD13 ' H ' ' B' ' 110' ' ' LEU . 0.0 OUTLIER -92.31 178.41 5.85 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.331 -0.395 . . . . 62.240000000000002 110.616 178.455 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 11.2 t -147.92 163.54 36.51 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.877 -0.416 . . . . 62.420000000000002 109.877 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 5.1 tt -143.09 127.21 17.48 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.136 -0.691 . . . . 73.540000000000006 109.136 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 113' ' ' ALA . . . . . 0.561 ' HB3' ' HB2' ' B' ' 117' ' ' SER . . . -84.35 103.87 13.89 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.768 0.318 . . . . 74.510000000000005 110.157 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -60.7 -45.29 94.78 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.601 -0.727 . . . . 74.299999999999997 112.159 -172.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -91.57 -36.48 13.67 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.758 0.313 . . . . 65.420000000000002 111.492 -177.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.535 ' HB3' ' HB1' ' B' ' 113' ' ' ALA . 47.9 tp -82.22 -59.88 2.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 74.540000000000006 111.941 -172.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.561 ' HB2' ' HB3' ' B' ' 113' ' ' ALA . 5.6 t -71.01 -41.29 71.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.015 0.436 . . . . 75.420000000000002 109.872 -176.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 24.4 m -92.65 87.07 5.77 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.588 -0.523 . . . . 64.310000000000002 109.588 174.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -81.53 111.01 17.45 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.02 -0.537 . . . . 73.109999999999999 110.796 -175.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 120' ' ' THR . . . . . 0.412 HG22 ' H ' ' B' ' 122' ' ' ASP . 21.4 m -60.71 111.93 1.82 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.0 -0.546 . . . . 63.5 111.31 -178.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . 0.816 HD23 ' H ' ' B' ' 121' ' ' LEU . 2.5 pt? -99.82 22.23 11.38 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.931 -0.577 . . . . 75.129999999999995 110.407 -179.187 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 122' ' ' ASP . . . . . 0.412 ' H ' HG22 ' B' ' 120' ' ' THR . 18.4 t70 -64.4 117.52 7.4 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.829 -0.623 . . . . 74.140000000000001 110.169 -177.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . 0.898 HG12 ' H ' ' B' ' 124' ' ' SER . 13.0 tt -86.09 -168.93 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-N 115.5 -0.773 . . . . 73.010000000000005 111.379 -170.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.898 ' H ' HG12 ' B' ' 123' ' ' ILE . 7.8 m -80.24 141.64 35.38 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 120.917 0.389 . . . . 73.040000000000006 111.628 -178.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . 0.421 ' HE3' ' HB3' ' B' ' 125' ' ' LYS . 0.0 OUTLIER -162.68 32.2 0.1 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.318 0.58 . . . . 52.310000000000002 109.743 176.148 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -64.67 113.76 3.97 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.404 -0.816 . . . . 63.229999999999997 110.612 -174.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 9.8 t-105 -132.91 -162.86 1.28 Allowed 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.172 -0.922 . . . . 75.510000000000005 108.904 -173.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 15.6 m -105.49 -0.55 25.81 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.202 0.525 . . . . 63.310000000000002 110.739 -178.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -83.44 56.25 3.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.799 -0.637 . . . . 73.409999999999997 110.994 -176.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.47 HG22 HD13 ' A' ' 63' ' ' LEU . 32.3 t -119.18 -68.54 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.114 -0.494 . . . . 74.540000000000006 110.644 -178.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -70.85 -19.44 62.64 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.044 -0.526 . . . . 75.040000000000006 111.291 -177.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.487 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 50.4 t30 -59.2 -51.1 71.44 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 116.117 -0.492 . . . . 74.319999999999993 110.965 -178.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 133' ' ' ILE . . . . . 0.612 HG21 ' HB3' ' A' ' 79' ' ' LEU . 4.0 mp -67.88 -34.09 65.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.367 0.603 . . . . 72.530000000000001 110.563 -177.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.615 HD12 HD23 ' A' ' 49' ' ' LEU . 92.4 mt -73.47 -25.24 60.39 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.834 -0.621 . . . . 74.430000000000007 111.985 -175.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.601 ' HG3' ' N ' ' B' ' 136' ' ' GLU . 3.5 ptp180 -75.96 -40.43 53.96 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.54 -0.464 . . . . 74.349999999999994 109.82 175.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 136' ' ' GLU . . . . . 0.601 ' N ' ' HG3' ' B' ' 135' ' ' ARG . 10.4 mm-40 -58.7 -45.51 89.35 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.355 -0.839 . . . . 62.030000000000001 111.142 -179.183 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -95.81 5.83 50.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.783 -0.644 . . . . 63.140000000000001 111.323 -175.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 52.54 70.11 0.61 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.512 -0.767 . . . . 73.209999999999994 112.742 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -96.09 4.88 52.21 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.55 -0.75 . . . . 71.319999999999993 109.989 172.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 55.57 67.69 2.87 Favored Pre-proline 0 C--O 1.232 0.155 0 CA-C-N 115.023 -0.989 . . . . 73.239999999999995 111.238 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.474 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 90.1 Cg_endo -88.2 165.31 6.93 Favored 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 122.528 2.152 . . . . 74.200000000000003 112.415 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -93.04 172.75 8.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.816 -0.629 . . . . 61.43 109.512 175.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 143' ' ' PHE . . . . . 0.453 ' CA ' HG11 ' A' ' 47' ' ' VAL . 64.1 t80 179.24 -32.72 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.582 0.706 . . . . 64.25 110.237 -170.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -80.57 99.3 8.02 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.165 -0.925 . . . . 71.109999999999999 109.749 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 145' ' ' CYS . . . . . 0.631 ' SG ' HG22 ' A' ' 47' ' ' VAL . 13.5 p -117.47 175.8 5.46 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.791 -0.64 . . . . 71.219999999999999 110.443 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 -83.52 81.88 8.54 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.079 0.466 . . . . 73.319999999999993 110.41 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 31.1 t -84.77 152.27 3.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.445 -0.798 . . . . 75.430000000000007 109.718 178.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . 0.698 ' HD3' ' H ' ' B' ' 148' ' ' LYS . 0.3 OUTLIER -110.75 130.28 55.62 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 109.123 -0.695 . . . . 72.0 109.123 176.501 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.717 ' HB3' ' HD1' ' B' ' 151' ' ' PHE . 9.7 mp -71.65 90.61 1.05 Allowed 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.51 -0.768 . . . . 73.439999999999998 110.511 -178.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.651 ' HB3' ' HD3' ' A' ' 42' ' ' LYS . . . -87.7 68.29 9.43 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.621 -0.511 . . . . 63.310000000000002 109.621 174.654 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 151' ' ' PHE . . . . . 0.717 ' HD1' ' HB3' ' B' ' 149' ' ' LEU . 53.5 p90 -100.17 164.91 11.76 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.763 -0.653 . . . . 72.439999999999998 110.622 -176.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 5.3 tppp? -93.98 120.16 33.86 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.744 -0.662 . . . . 74.239999999999995 110.431 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 153' ' ' CYS . . . . . 0.477 ' SG ' ' HE2' ' B' ' 169' ' ' PHE . 43.5 t -125.77 108.77 11.82 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 116.448 -0.342 . . . . 61.539999999999999 110.528 177.316 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 2.0 t70 68.8 10.25 7.8 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.527 -0.76 . . . . 71.239999999999995 111.852 170.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 119.99 -19.94 9.35 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.314 -0.946 . . . . 75.239999999999995 112.824 179.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 156' ' ' GLU . . . . . 0.578 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 9.9 pt-20 -112.95 139.04 48.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.798 0.333 . . . . 75.340000000000003 110.284 178.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 44.0 mm -75.48 118.4 21.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.216 -0.447 . . . . 74.439999999999998 109.919 177.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 158' ' ' LYS . . . . . 0.578 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 31.7 mmmt -107.78 94.52 5.12 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.557 -0.292 . . . . 53.140000000000001 110.896 -175.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . 0.499 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.7 OUTLIER -74.44 117.21 15.99 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.954 0.406 . . . . 63.299999999999997 110.852 177.852 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 160' ' ' PHE . . . . . 0.526 ' CD2' HD13 ' B' ' 166' ' ' LEU . 41.4 m-85 -126.29 120.09 29.07 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.139 -0.482 . . . . 74.430000000000007 110.003 176.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 25.5 p -101.1 6.7 43.37 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.378 0.609 . . . . 73.329999999999998 109.844 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -150.29 162.22 40.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.322 -0.854 . . . . 65.030000000000001 110.137 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . 0.599 HD13 HG12 ' A' ' 30' ' ' VAL . 35.3 tp -96.28 -1.61 47.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.171 0.51 . . . . 74.109999999999999 111.151 -176.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 164' ' ' GLN . . . . . 0.827 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 61.5 tt0 -81.42 -52.03 7.69 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.727 -0.472 . . . . 72.430000000000007 109.727 -178.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 3.2 m -67.25 -28.56 68.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.576 -0.738 . . . . 71.129999999999995 110.104 177.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . 0.526 HD13 ' CD2' ' B' ' 160' ' ' PHE . 43.5 tp -64.54 -39.47 93.82 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.16 -0.473 . . . . 73.010000000000005 110.258 178.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 75.2 ttt180 -65.04 -38.0 89.44 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.818 -0.438 . . . . 52.5 109.818 175.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 168' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' B' ' 164' ' ' GLN . 13.1 mmmm -56.51 -36.95 69.76 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.583 -0.735 . . . . 71.439999999999998 110.576 179.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 169' ' ' PHE . . . . . 0.528 ' O ' ' HG2' ' B' ' 173' ' ' LYS . 58.0 t80 -89.54 -47.73 7.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.463 -0.79 . . . . 73.439999999999998 110.945 -177.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.18 -33.18 74.05 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.664 0.616 . . . . 75.230000000000004 112.664 -176.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 6.5 t -67.54 -20.13 65.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.658 0.266 . . . . 34.520000000000003 111.441 -175.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 11.4 pt20 -105.49 -3.2 22.75 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.913 0.387 . . . . 75.420000000000002 110.534 179.034 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 173' ' ' LYS . . . . . 0.602 ' HB2' ' HB2' ' B' ' 176' ' ' MET . 29.8 mmmt -87.23 129.89 34.79 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.176 -0.466 . . . . 63.340000000000003 111.017 -178.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 3.5 m -56.66 -45.6 81.56 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.701 -0.681 . . . . 51.25 110.593 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 175' ' ' SER . . . . . 0.472 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 40.1 t -82.92 -49.17 9.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.018 -0.537 . . . . 73.120000000000005 111.703 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.602 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 66.1 mtp -70.75 -20.53 62.62 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.405 0.52 . . . . 72.030000000000001 112.405 -169.324 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . 0.498 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 88.8 tttt -62.11 -35.01 77.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.982 0.42 . . . . 74.519999999999996 110.641 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . 0.458 ' HA ' ' HD3' ' B' ' 181' ' ' LYS . 25.9 mm-40 -91.22 -8.76 47.56 Favored 'General case' 0 CA--C 1.511 -0.519 0 CA-C-O 121.619 0.723 . . . . 73.530000000000001 110.213 -176.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 179' ' ' LEU . . . . . 0.63 ' HB3' HG21 ' A' ' 33' ' ' ILE . 81.2 mt -89.9 -48.41 7.24 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.883 -1.053 . . . . 75.319999999999993 109.798 178.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 180' ' ' LEU . . . . . 0.651 ' HB3' HD13 ' B' ' 184' ' ' LEU . 4.2 mm? -86.17 -11.05 53.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.574 -0.739 . . . . 45.149999999999999 111.778 -176.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 181' ' ' LYS . . . . . 0.498 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 64.1 pttt -55.71 -18.3 7.83 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 111.625 0.232 . . . . 73.239999999999995 111.625 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -60.16 -46.85 88.27 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.821 0.343 . . . . 75.109999999999999 110.879 177.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 17.4 m -105.98 -14.46 9.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.128 -0.487 . . . . 45.229999999999997 111.375 -176.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 184' ' ' LEU . . . . . 0.651 HD13 ' HB3' ' B' ' 180' ' ' LEU . 8.2 mp -81.95 137.09 46.87 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 109.739 -0.467 . . . . 64.019999999999996 109.739 176.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 185' ' ' PRO . . . . . 0.492 ' HD3' ' HA ' ' B' ' 184' ' ' LEU . 12.6 Cg_exo -70.14 74.75 1.43 Allowed 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 122.823 2.348 . . . . 62.329999999999998 112.108 179.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -130.64 158.78 39.11 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.721 -0.672 . . . . 73.349999999999994 109.901 178.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp 54.77 80.87 0.12 Allowed 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.37 1.044 . . . . 73.409999999999997 112.406 175.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 . . . . . 0 C--O 1.247 0.967 0 CA-C-N 115.08 -0.964 . . . . 75.299999999999997 109.672 175.597 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.795 0 N-CA-C 111.496 -0.642 . . . . 41.039999999999999 111.496 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 3.4 p -150.4 110.7 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.512 0.672 . . . . 61.329999999999998 110.765 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -104.15 137.19 42.44 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.758 -0.656 . . . . 71.400000000000006 110.016 178.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -94.3 25.41 3.85 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.89 -0.596 . . . . 63.109999999999999 110.572 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -96.7 150.42 20.7 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.311 -0.859 . . . . 71.430000000000007 110.704 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -115.32 83.31 1.9 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.92 -0.771 . . . . 72.340000000000003 108.92 172.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -105.13 30.17 10.41 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.474 -0.785 . . . . 74.209999999999994 112.283 -176.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -101.85 84.97 2.62 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.672 -0.492 . . . . 75.230000000000004 109.672 177.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 58.1 t -125.3 119.92 56.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.669 -0.696 . . . . 73.510000000000005 110.23 -175.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.735 HD13 HE22 ' B' ' 126' ' ' GLN . 1.6 pp -90.24 153.57 20.38 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.943 -0.571 . . . . 72.430000000000007 110.955 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 13.1 t -146.58 -173.49 4.22 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.208 -0.664 . . . . 75.120000000000005 109.208 178.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.404 ' HB3' ' HG3' ' B' ' 126' ' ' GLN . 4.0 pp -114.54 156.76 24.03 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.278 0.561 . . . . 63.210000000000001 111.155 177.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.668 ' HB3' ' HA ' ' A' ' 17' ' ' SER . . . -82.44 -167.15 1.48 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.146 -0.934 . . . . 75.010000000000005 111.753 -176.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.9 -39.1 2.75 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.111 -0.495 . . . . 35.420000000000002 110.751 176.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -90.18 -44.98 9.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.954 -0.566 . . . . 71.239999999999995 110.661 178.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.433 ' C ' ' HB3' ' A' ' 13' ' ' ALA . 23.0 tp -119.7 53.34 1.05 Allowed 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 107.608 -1.256 . . . . 71.329999999999998 107.608 175.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.668 ' HA ' ' HB3' ' A' ' 13' ' ' ALA . 2.5 m -43.43 -39.65 3.36 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 114.609 -1.178 . . . . 75.040000000000006 113.196 -169.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.3 p -170.7 158.58 6.16 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.8 -0.636 . . . . 75.340000000000003 110.677 -174.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -152.1 108.7 3.46 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.453 -0.339 . . . . 55.439999999999998 110.692 178.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 14.5 t -96.74 -5.08 39.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.633 0.73 . . . . 71.530000000000001 109.447 175.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 59.0 tp -131.79 116.56 17.41 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.16 -0.927 . . . . 53.43 109.769 178.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.44 ' OD2' ' HD2' ' A' ' 25' ' ' LYS . 2.3 p-10 -84.87 126.04 33.14 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.253 0.549 . . . . 64.409999999999997 110.628 179.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 9.0 tt -81.71 -51.17 15.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.916 -0.584 . . . . 71.209999999999994 111.483 -176.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.3 t -113.53 109.03 17.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.396 0.617 . . . . 75.400000000000006 111.901 -173.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.44 ' HD2' ' OD2' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -115.13 67.72 0.7 Allowed 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.249 -0.887 . . . . 72.430000000000007 109.346 171.473 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -73.77 -12.95 60.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.681 -0.691 . . . . 73.519999999999996 110.636 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.418 ' HB3' ' H ' ' A' ' 28' ' ' SER . 90.5 m95 -99.31 -156.13 0.53 Allowed 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.557 -0.747 . . . . 74.109999999999999 109.236 174.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.418 ' H ' ' HB3' ' A' ' 27' ' ' TRP . 79.9 p 56.69 6.34 0.28 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.296 1.039 . . . . 73.120000000000005 113.683 178.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.629 ' HB3' HG21 ' B' ' 183' ' ' VAL . 47.0 t30 -78.6 69.26 4.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.664 0.745 . . . . 71.200000000000003 109.613 176.259 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.664 HG13 HD11 ' B' ' 180' ' ' LEU . 46.1 t -119.16 -46.27 3.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.206 -0.906 . . . . 71.239999999999995 109.748 179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -56.35 -43.45 79.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.683 -0.689 . . . . 72.230000000000004 110.44 178.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.535 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 8.5 t30 -60.0 -51.7 68.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.629 -0.714 . . . . 75.219999999999999 110.698 178.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.482 HG22 ' OD1' ' A' ' 37' ' ' ASN . 50.1 mm -58.67 -53.59 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 116.39 -0.368 . . . . 74.239999999999995 110.718 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 88.7 mt -54.92 -32.55 61.25 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.148 -0.478 . . . . 73.340000000000003 111.759 -178.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 34.6 ttt180 -69.29 -41.28 77.0 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.854 -0.339 . . . . 74.420000000000002 110.361 176.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.535 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 30.2 mt-10 -68.69 -35.53 77.31 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.299 -0.41 . . . . 71.040000000000006 110.353 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.482 ' OD1' HG22 ' A' ' 33' ' ' ILE . 4.3 m120 -73.48 -13.62 61.09 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.122 -0.49 . . . . 64.340000000000003 109.806 177.152 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.4 t70 68.4 36.4 3.02 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.202 -0.908 . . . . 62.140000000000001 110.982 -178.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -75.67 -22.92 56.26 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.848 -0.615 . . . . 73.409999999999997 109.522 172.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 60.31 82.66 0.22 Allowed Pre-proline 0 N--CA 1.463 0.191 0 CA-C-N 114.806 -1.088 . . . . 70.400000000000006 111.046 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.709 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 60.1 Cg_endo -87.83 178.24 3.28 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.878 2.385 . . . . 73.340000000000003 111.929 177.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.448 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 0.0 OUTLIER -121.25 149.19 43.23 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.744 0.307 . . . . 73.120000000000005 110.989 -177.772 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.482 ' HA ' HG13 ' B' ' 147' ' ' VAL . 78.4 t80 -162.33 84.53 0.56 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.62 -0.718 . . . . 71.120000000000005 109.37 -174.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.411 HD13 ' HA ' ' A' ' 44' ' ' LEU . 4.2 mm? -87.9 80.63 7.75 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.143 0.496 . . . . 75.030000000000001 110.391 -178.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 42.5 t -132.52 81.87 1.98 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.785 -0.643 . . . . 74.140000000000001 109.807 -179.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.88 23.3 1.56 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.537 -0.756 . . . . 64.329999999999998 109.288 178.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.576 HG11 ' HB2' ' B' ' 145' ' ' CYS . 4.6 m -66.75 154.93 7.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.774 -1.103 . . . . 71.329999999999998 112.047 -167.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -131.62 133.8 45.33 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 107.737 -1.209 . . . . 74.150000000000006 107.737 176.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 35.5 tp -79.96 68.42 6.07 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.497 -0.927 . . . . 61.43 108.497 173.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.584 ' HB2' HG22 ' A' ' 59' ' ' THR . . . -84.3 97.86 9.68 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 114.892 -1.049 . . . . 51.420000000000002 110.616 -176.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -111.39 165.99 11.49 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.974 -0.557 . . . . 52.100000000000001 110.376 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -90.28 124.9 35.27 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.139 -0.482 . . . . 71.540000000000006 110.275 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 14.7 t -138.54 116.88 11.94 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.777 -0.453 . . . . 62.210000000000001 109.777 178.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 64.63 16.22 10.2 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.714 0.635 . . . . 63.340000000000003 112.714 176.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 107.69 -17.5 36.0 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.068 -1.063 . . . . 65.329999999999998 112.412 177.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -111.78 146.66 37.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.777 0.323 . . . . 72.510000000000005 110.433 177.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 45.2 mm -79.84 126.9 39.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.165 -0.47 . . . . 74.109999999999999 110.14 178.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.483 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 27.6 mmmt -107.33 117.3 33.71 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.113 -0.329 . . . . 74.109999999999999 110.113 -179.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.584 HG22 ' HB2' ' A' ' 50' ' ' ALA . 2.6 p -93.91 123.88 37.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.166 -0.47 . . . . 74.329999999999998 111.044 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.461 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 71.9 m-85 -131.2 135.2 47.19 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.303 -0.408 . . . . 72.329999999999998 111.21 178.436 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.7 p -126.55 -5.02 6.51 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.826 -0.624 . . . . 64.239999999999995 109.983 175.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -125.32 130.57 52.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.724 -0.671 . . . . 75.329999999999998 110.181 178.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.603 HD21 ' HA ' ' B' ' 128' ' ' SER . 10.1 mp -73.72 -33.23 64.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.443 . . . . 74.549999999999997 111.665 -175.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -60.43 -46.04 91.47 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.32 0.581 . . . . 74.25 110.474 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.0 t -61.54 -46.89 88.01 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.717 -0.674 . . . . 53.409999999999997 110.533 177.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.647 HD21 HG11 ' B' ' 130' ' ' VAL . 48.3 tp -65.95 -36.61 83.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.015 -0.538 . . . . 74.510000000000005 111.436 -177.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -56.78 -41.5 77.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.079 0.466 . . . . 63.229999999999997 110.541 176.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.465 ' HB2' ' HZ2' ' A' ' 68' ' ' LYS . 10.4 mtmp? -69.94 -30.86 68.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.891 -0.595 . . . . 74.109999999999999 111.08 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.542 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 46.9 t80 -74.49 -45.75 43.93 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.94 -0.573 . . . . 74.400000000000006 110.647 -178.198 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.41 -27.53 67.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.295 -0.412 . . . . 74.230000000000004 111.364 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 43.8 t -67.29 -42.18 84.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.302 -0.408 . . . . 63.310000000000002 111.371 -178.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.542 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 13.9 pt20 -73.96 -25.04 59.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.123 0.487 . . . . 74.540000000000006 110.618 -176.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.611 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 71.1 mmtt -70.57 139.31 51.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.928 -0.578 . . . . 74.299999999999997 110.374 178.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 29.2 m -75.39 -39.87 58.59 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.993 0.425 . . . . 54.299999999999997 110.576 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.429 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 15.7 m -78.06 -50.49 11.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.212 -0.449 . . . . 64.239999999999995 111.136 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.611 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 83.4 mtp -67.78 -19.86 65.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 75.400000000000006 111.792 -174.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.433 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 4.6 ttmp? -58.79 -35.3 72.59 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.023 0.439 . . . . 72.510000000000005 110.769 177.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.402 ' O ' ' HE3' ' A' ' 81' ' ' LYS . 35.6 mt-10 -100.74 2.02 40.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.135 0.493 . . . . 74.120000000000005 110.333 -176.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.446 ' HB3' ' CG2' ' B' ' 133' ' ' ILE . 68.0 mt -89.0 -48.61 7.31 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.859 -0.609 . . . . 61.409999999999997 110.094 177.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.788 HD11 HG13 ' B' ' 130' ' ' VAL . 3.5 mm? -90.94 7.54 39.67 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.708 -0.678 . . . . 53.140000000000001 111.218 -176.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.496 ' HA ' HE21 ' A' ' 86' ' ' GLN . 21.3 pttp -56.19 -24.48 42.0 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.532 -0.758 . . . . 63.240000000000002 112.112 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -81.06 -9.11 59.87 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 111.997 0.369 . . . . 62.140000000000001 111.997 -175.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.661 HG11 ' HB3' ' B' ' 129' ' ' ASN . 12.6 m -127.0 -33.42 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 C-N-CA 120.983 -0.287 . . . . 72.340000000000003 111.422 178.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.678 HD13 ' HB3' ' A' ' 80' ' ' LEU . 10.3 mp -83.26 130.07 58.24 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.629 -0.26 . . . . 74.140000000000001 110.402 178.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -56.97 110.48 0.6 Allowed 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.84 2.36 . . . . 73.230000000000004 111.877 178.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.496 HE21 ' HA ' ' A' ' 81' ' ' LYS . 82.5 mm-40 -90.51 -161.16 0.77 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.515 -0.766 . . . . 64.040000000000006 110.773 -178.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -67.68 -23.19 65.28 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.99 -0.55 . . . . 74.530000000000001 110.952 -177.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 . . . . . 0 N--CA 1.442 -0.847 0 CA-C-N 116.1 -0.5 . . . . 74.310000000000002 110.575 -174.723 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 N-CA-C 112.273 -0.331 . . . . 63.450000000000003 112.273 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 49.0 t -77.34 115.89 19.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 120.797 0.332 . . . . 73.439999999999998 110.414 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 74.0 mt -99.8 112.04 24.32 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.934 0.397 . . . . 73.349999999999994 110.212 178.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.56 6.77 9.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.621 -0.718 . . . . 72.409999999999997 110.775 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -95.45 133.98 38.81 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.645 -0.707 . . . . 75.329999999999998 109.971 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -105.23 109.36 21.32 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.14 -0.318 . . . . 65.140000000000001 110.14 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -100.65 -93.01 2.13 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.441 -0.885 . . . . 72.219999999999999 113.351 -174.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -89.04 104.6 17.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.958 0.409 . . . . 72.019999999999996 111.354 -173.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 46.6 t -95.54 -56.6 5.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.012 -0.54 . . . . 74.319999999999993 110.134 178.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 3.7 pp -168.03 159.22 11.03 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.258 -0.883 . . . . 71.519999999999996 110.947 -179.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 11.8 t -154.28 -176.94 6.12 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.034 -0.728 . . . . 64.329999999999998 109.034 178.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . 0.613 HD13 ' HB3' ' B' ' 117' ' ' SER . 4.5 pp -126.44 155.82 41.61 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.914 0.387 . . . . 44.219999999999999 110.529 177.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 113' ' ' ALA . . . . . 0.689 ' HB3' ' HA ' ' B' ' 117' ' ' SER . . . -76.6 -170.83 1.66 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.659 -0.701 . . . . 72.430000000000007 112.396 -173.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -117.67 -49.02 2.56 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.202 -0.453 . . . . 75.099999999999994 110.94 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -73.83 -58.99 2.93 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.335 -0.617 . . . . 74.219999999999999 109.335 177.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.458 ' O ' ' HB3' ' B' ' 113' ' ' ALA . 3.4 mm? -116.29 80.6 1.48 Allowed 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.508 -0.923 . . . . 64.530000000000001 108.508 174.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.689 ' HA ' ' HB3' ' B' ' 113' ' ' ALA . 5.3 m -66.68 -9.56 37.42 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.475 -0.784 . . . . 72.150000000000006 112.801 -168.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 6.3 p -152.28 139.58 19.42 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.56 -0.291 . . . . 74.230000000000004 110.984 -178.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -107.28 134.1 50.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.29 -0.413 . . . . 53.020000000000003 110.784 178.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 64.4 m -115.7 -45.77 2.88 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.799 0.809 . . . . 74.030000000000001 110.33 178.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 45.6 tp -138.52 156.11 47.8 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 114.512 -1.222 . . . . 54.439999999999998 109.181 176.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -74.46 159.29 32.47 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.165 0.507 . . . . 64.349999999999994 110.955 -177.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 12.3 tt -96.64 -35.65 5.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.801 -0.636 . . . . 72.219999999999999 110.238 175.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 23.3 t -170.96 122.71 0.58 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.267 -0.424 . . . . 74.230000000000004 110.657 -179.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . 0.622 ' HD3' ' H ' ' B' ' 125' ' ' LYS . 0.0 OUTLIER -114.46 80.39 1.39 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.677 0.751 . . . . 72.310000000000002 109.544 172.113 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 126' ' ' GLN . . . . . 0.735 HE22 HD13 ' A' ' 10' ' ' LEU . 27.9 mm-40 -84.03 -1.99 55.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.459 -0.791 . . . . 75.540000000000006 110.703 179.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -98.86 -167.37 1.48 Allowed 'General case' 0 N--CA 1.441 -0.912 0 N-CA-C 109.54 -0.541 . . . . 74.409999999999997 109.54 176.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . 0.603 ' HA ' HD21 ' A' ' 63' ' ' LEU . 23.1 t 65.06 5.86 3.18 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.378 -0.828 . . . . 63.450000000000003 111.594 -178.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . 0.661 ' HB3' HG11 ' A' ' 83' ' ' VAL . 59.9 t30 -83.38 76.94 9.88 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 121.551 0.691 . . . . 71.340000000000003 110.291 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.788 HG13 HD11 ' A' ' 80' ' ' LEU . 54.6 t -129.06 -38.04 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.018 -0.992 . . . . 74.109999999999999 109.296 176.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 131' ' ' PHE . . . . . 0.459 ' HE1' HH11 ' B' ' 135' ' ' ARG . 53.0 t80 -54.83 -45.77 74.5 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.119 -0.946 . . . . 65.030000000000001 110.126 178.118 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.613 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 6.4 t30 -57.92 -48.92 78.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.934 -0.576 . . . . 75.310000000000002 111.439 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 133' ' ' ILE . . . . . 0.446 ' CG2' ' HB3' ' A' ' 79' ' ' LEU . 2.4 mp -61.49 -47.52 93.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 CA-C-O 121.056 0.455 . . . . 72.329999999999998 110.691 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 87.1 mt -62.65 -31.32 72.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.945 -0.57 . . . . 64.219999999999999 110.543 178.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.459 HH11 ' HE1' ' B' ' 131' ' ' PHE . 24.9 ttt180 -73.02 -42.07 63.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.159 -0.473 . . . . 70.099999999999994 110.762 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 136' ' ' GLU . . . . . 0.613 ' HG3' ' O ' ' B' ' 132' ' ' ASN . 41.2 mt-10 -60.07 -47.08 87.34 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.204 0.526 . . . . 75.319999999999993 110.8 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -86.83 -0.71 56.93 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.693 -0.685 . . . . 74.409999999999997 111.083 -177.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 25.6 t0 57.92 67.91 0.9 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.382 -0.826 . . . . 71.530000000000001 111.894 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -96.53 -3.91 42.3 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.193 -0.912 . . . . 72.140000000000001 109.032 169.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 140' ' ' GLU . . . . . 0.407 ' HG2' ' HE3' ' B' ' 142' ' ' LYS . 37.6 tt0 55.69 78.07 0.4 Allowed Pre-proline 0 C--O 1.232 0.161 0 CA-C-N 114.566 -1.197 . . . . 72.549999999999997 111.275 -176.186 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.432 ' C ' ' HD2' ' B' ' 142' ' ' LYS . 92.8 Cg_endo -82.99 163.41 15.65 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 123.076 2.517 . . . . 73.549999999999997 111.432 176.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 142' ' ' LYS . . . . . 0.432 ' HD2' ' C ' ' B' ' 141' ' ' PRO . 0.8 OUTLIER -122.59 148.98 44.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.096 0.474 . . . . 71.439999999999998 111.321 -175.437 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -167.79 82.07 0.19 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.408 -0.815 . . . . 73.519999999999996 109.561 -178.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -90.37 40.8 1.02 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.849 -0.614 . . . . 72.109999999999999 110.42 -177.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 145' ' ' CYS . . . . . 0.576 ' HB2' HG11 ' A' ' 47' ' ' VAL . 46.5 t -100.38 91.42 4.7 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.112 0.482 . . . . 71.319999999999993 111.277 -175.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -125.57 80.88 1.93 Allowed 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.756 -0.831 . . . . 74.409999999999997 108.756 170.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 147' ' ' VAL . . . . . 0.482 HG13 ' HA ' ' A' ' 43' ' ' PHE . 61.2 t -88.62 111.04 21.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.254 -0.884 . . . . 74.120000000000005 111.321 -171.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.16 135.29 46.27 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.544 -0.91 . . . . 64.319999999999993 108.544 172.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 5.4 mp -73.92 86.83 1.78 Allowed 'General case' 0 C--N 1.317 -0.816 0 O-C-N 123.244 0.34 . . . . 75.109999999999999 110.104 177.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.578 ' HA ' ' O ' ' B' ' 158' ' ' LYS . . . -91.58 97.61 11.15 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.414 -0.812 . . . . 75.519999999999996 109.561 174.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 151' ' ' PHE . . . . . 0.709 ' HB3' ' HA ' ' A' ' 41' ' ' PRO . 47.4 p90 -132.55 166.55 21.83 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.087 -0.506 . . . . 62.509999999999998 110.817 -176.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -94.23 114.03 26.06 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.133 -0.485 . . . . 73.450000000000003 110.053 178.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 153' ' ' CYS . . . . . 0.461 ' HB2' ' HE1' ' B' ' 151' ' ' PHE . 49.0 t -126.32 120.8 30.83 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.095 -0.502 . . . . 73.120000000000005 110.166 178.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 19.6 t70 70.48 6.0 5.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.875 -0.602 . . . . 55.439999999999998 111.789 170.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 111.19 -6.4 28.75 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.502 -0.856 . . . . 63.140000000000001 112.316 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 156' ' ' GLU . . . . . 0.523 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 12.6 pt-20 -120.91 145.74 47.36 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 110.023 -0.362 . . . . 74.310000000000002 110.023 177.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 42.5 mm -77.92 126.94 38.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 109.723 -0.473 . . . . 71.200000000000003 109.723 176.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 158' ' ' LYS . . . . . 0.578 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 29.1 mmmt -109.78 137.52 47.46 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.872 -0.418 . . . . 74.25 109.872 179.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.01 104.6 8.99 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 123.194 0.309 . . . . 73.340000000000003 110.791 178.443 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 160' ' ' PHE . . . . . 0.606 ' CD2' HD13 ' B' ' 166' ' ' LEU . 94.9 m-85 -117.11 122.62 44.62 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.782 -0.367 . . . . 72.439999999999998 111.017 178.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 10.5 p -92.81 -5.78 50.34 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.161 -0.472 . . . . 52.409999999999997 110.557 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -132.81 157.1 45.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.872 -0.604 . . . . 72.219999999999999 109.884 177.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -89.18 -16.84 30.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.274 -0.421 . . . . 63.43 111.055 -177.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 164' ' ' GLN . . . . . 0.413 ' O ' ' HG3' ' B' ' 168' ' ' LYS . 6.2 tp60 -67.94 -51.45 47.57 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.418 -0.355 . . . . 74.409999999999997 111.12 -176.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . 0.951 ' HA ' ' HE3' ' B' ' 168' ' ' LYS . 11.5 t -69.6 -34.15 73.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.852 0.358 . . . . 71.0 110.38 -178.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . 0.606 HD13 ' CD2' ' B' ' 160' ' ' PHE . 33.5 tp -68.02 -35.13 77.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.975 0.416 . . . . 75.120000000000005 110.515 177.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -62.41 -37.07 84.37 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.11 -0.495 . . . . 71.430000000000007 110.464 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 168' ' ' LYS . . . . . 0.951 ' HE3' ' HA ' ' B' ' 165' ' ' SER . 9.2 mtmp? -67.19 -42.87 83.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.866 -0.606 . . . . 73.510000000000005 110.295 175.406 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 169' ' ' PHE . . . . . 0.441 ' HA ' ' HG2' ' B' ' 172' ' ' GLN . 63.9 t80 -64.89 -44.28 90.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.5 -0.773 . . . . 75.340000000000003 110.755 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -59.1 -31.36 68.85 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.156 -0.475 . . . . 62.43 110.93 177.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 26.3 t -72.34 -41.84 66.04 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.822 -0.626 . . . . 75.510000000000005 111.003 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . 0.441 ' HG2' ' HA ' ' B' ' 169' ' ' PHE . 19.2 pt20 -77.34 -22.64 51.54 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.952 0.406 . . . . 70.340000000000003 110.781 -176.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 173' ' ' LYS . . . . . 0.875 ' HE2' ' HA ' ' B' ' 173' ' ' LYS . 9.1 mmpt? -75.75 142.68 42.32 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.813 -0.44 . . . . 72.519999999999996 109.813 173.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 19.9 m -80.25 -42.46 23.14 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.749 -0.463 . . . . 62.399999999999999 109.749 177.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 175' ' ' SER . . . . . 0.53 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 47.4 m -69.49 -50.44 45.25 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.413 -0.358 . . . . 73.420000000000002 110.863 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.713 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 68.0 mtp -63.11 -27.66 69.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.201 -0.454 . . . . 74.349999999999994 112.064 -174.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? -62.36 -28.66 69.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.008 0.432 . . . . 74.0 110.691 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -100.63 1.04 40.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.281 0.562 . . . . 75.209999999999994 110.616 -176.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 179' ' ' LEU . . . . . 0.69 HD12 ' HA ' ' B' ' 176' ' ' MET . 77.2 mt -95.32 -55.67 2.97 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.419 -0.81 . . . . 63.130000000000003 109.832 178.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 180' ' ' LEU . . . . . 0.664 HD11 HG13 ' A' ' 30' ' ' VAL . 3.2 mm? -78.98 -6.65 56.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.378 -0.828 . . . . 65.5 111.881 -176.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -55.36 -19.22 8.29 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.436 0.532 . . . . 64.219999999999999 112.436 -176.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -60.23 -36.82 78.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.967 0.413 . . . . 63.130000000000003 111.125 179.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 183' ' ' VAL . . . . . 0.629 HG21 ' HB3' ' A' ' 29' ' ' ASN . 13.2 m -123.06 -17.32 4.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.314 -0.403 . . . . 64.409999999999997 111.743 -179.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 184' ' ' LEU . . . . . . . . . . . . . 10.2 mp -99.55 109.1 54.02 Favored Pre-proline 0 C--N 1.327 -0.397 0 N-CA-C 109.723 -0.473 . . . . 60.399999999999999 109.723 177.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -63.02 104.83 0.41 Allowed 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 123.079 2.519 . . . . 75.409999999999997 112.581 -177.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 74.9 mm-40 -83.81 -143.32 0.07 Allowed 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.568 -0.901 . . . . 73.030000000000001 108.568 174.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 23.3 pttm -57.21 -32.52 66.59 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.029 -0.73 . . . . 74.439999999999998 109.029 170.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.345 -0.836 . . . . 52.509999999999998 109.269 172.296 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.689 0 N-CA-C 111.719 -0.552 . . . . 62.229999999999997 111.719 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.4 p -150.05 127.01 2.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.674 -0.491 . . . . 73.340000000000003 109.674 177.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -87.69 96.56 10.48 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.283 -0.417 . . . . 55.409999999999997 110.948 -174.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.2 mmt -88.99 101.24 13.89 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.143 -0.688 . . . . 74.129999999999995 109.143 174.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -98.94 140.4 33.16 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.941 -0.572 . . . . 74.209999999999994 111.043 -172.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -142.83 162.0 36.61 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.79 -0.641 . . . . 65.510000000000005 109.563 -176.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -85.49 -138.99 4.76 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.762 -0.733 . . . . 42.130000000000003 111.937 179.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -162.1 148.5 13.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.705 0.288 . . . . 75.549999999999997 110.332 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.3 t -89.87 119.11 36.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.073 -0.512 . . . . 64.549999999999997 109.981 177.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 11.2 mp -54.81 114.83 1.87 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.035 0.445 . . . . 65.109999999999999 110.923 178.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.557 ' HB ' ' HD3' ' B' ' 187' ' ' LYS . 63.5 m -140.92 134.07 29.45 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.667 -0.697 . . . . 74.329999999999998 110.187 -177.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.531 ' O ' HG22 ' A' ' 11' ' ' THR . 3.4 pp -74.79 151.87 39.05 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.619 -0.882 . . . . 51.420000000000002 108.619 170.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -51.32 126.88 18.14 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.318 0.488 . . . . 43.420000000000002 112.318 -173.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.34 -11.47 57.71 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.888 -0.597 . . . . 64.209999999999994 111.552 -177.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -88.32 12.49 13.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.375 0.607 . . . . 72.140000000000001 109.663 176.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.7 mt 62.63 35.62 14.14 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.348 -0.842 . . . . 74.040000000000006 110.649 179.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 26.5 m -95.71 33.7 1.61 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.772 -0.649 . . . . 74.109999999999999 111.593 -177.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.0 t -68.01 97.74 0.7 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.155 0.502 . . . . 71.420000000000002 110.086 176.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -86.67 -177.44 6.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.777 -0.647 . . . . 53.299999999999997 110.847 -177.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 18.4 m -126.52 120.2 29.06 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.434 -0.348 . . . . 53.43 110.682 -179.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 43.4 mt -75.39 102.18 5.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.33 0.586 . . . . 63.340000000000003 109.503 174.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -90.64 -89.39 0.16 Allowed 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.264 -0.88 . . . . 73.400000000000006 111.839 -168.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 12.8 tt -146.46 134.4 15.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.839 0.352 . . . . 62.43 111.171 -179.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.552 ' HB3' ' H ' ' B' ' 124' ' ' SER . 8.0 t -177.81 -174.78 0.47 Allowed 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.777 -0.647 . . . . 62.399999999999999 109.363 178.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.467 ' HB2' ' CZ2' ' B' ' 127' ' ' TRP . 0.6 OUTLIER -132.48 43.73 2.96 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.4 0.619 . . . . 75.400000000000006 110.452 -177.121 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 80.2 mm-40 -91.27 91.57 8.24 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.751 -0.659 . . . . 62.439999999999998 111.853 -173.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.408 ' C ' ' HE3' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -101.12 30.96 3.84 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.627 -0.715 . . . . 74.140000000000001 111.315 177.505 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.1 p -86.32 5.45 34.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.621 0.724 . . . . 75.420000000000002 110.31 -173.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.468 ' HB3' HG11 ' B' ' 183' ' ' VAL . 16.8 m120 -110.13 0.13 18.16 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.007 -0.997 . . . . 75.040000000000006 110.929 -178.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.411 ' C ' ' H ' ' A' ' 32' ' ' ASN . 46.6 t -93.83 129.49 44.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.101 -0.499 . . . . 60.439999999999998 110.563 -176.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 12.8 p90 57.28 -7.83 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 125.497 1.519 . . . . 74.200000000000003 114.461 174.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.513 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 11.8 t30 -58.12 -45.09 87.89 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 122.317 0.247 . . . . 70.120000000000005 111.578 -175.359 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.472 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 44.4 mm -60.16 -41.16 85.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.033 0.444 . . . . 65.230000000000004 111.399 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.568 HD12 HD23 ' B' ' 149' ' ' LEU . 88.3 mt -68.37 -27.57 66.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.189 -0.46 . . . . 75.319999999999993 110.691 -178.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -74.07 -34.67 64.11 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.123 -0.49 . . . . 71.140000000000001 109.95 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.513 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 5.8 mm-40 -71.52 -27.65 63.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.127 0.489 . . . . 73.049999999999997 110.736 178.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -101.55 4.37 40.97 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.15 -0.477 . . . . 73.430000000000007 111.04 -178.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 60.18 43.99 13.35 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.603 -0.726 . . . . 75.129999999999995 112.361 174.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.546 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 11.8 m-85 -77.74 -12.81 60.01 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.122 0.487 . . . . 74.209999999999994 109.995 171.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 58.9 73.85 0.66 Allowed Pre-proline 0 C--O 1.236 0.345 0 CA-C-N 114.99 -1.005 . . . . 71.409999999999997 110.859 -174.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -81.44 148.62 16.43 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.513 2.142 . . . . 53.439999999999998 111.304 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -104.83 138.46 41.06 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.133 0.492 . . . . 72.340000000000003 110.856 -177.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -146.05 31.24 1.03 Allowed 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.502 -0.925 . . . . 71.450000000000003 108.502 -175.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 29.5 tp -61.63 96.93 0.07 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.727 -1.124 . . . . 74.329999999999998 110.864 -177.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 41.5 t -102.04 82.87 2.28 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.736 -0.665 . . . . 71.310000000000002 110.095 -178.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.421 ' HG2' ' HE3' ' A' ' 48' ' ' LYS . 22.6 tt0 -92.26 26.53 2.51 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.898 0.856 . . . . 75.230000000000004 109.293 176.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.546 HG13 ' HA ' ' B' ' 143' ' ' PHE . 61.6 t -74.41 115.78 16.05 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 CA-C-N 114.94 -1.027 . . . . 74.420000000000002 110.357 178.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.421 ' HE3' ' HG2' ' A' ' 46' ' ' GLU . 0.0 OUTLIER -139.14 128.67 24.44 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.762 -0.458 . . . . 71.329999999999998 109.762 175.425 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.714 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.5 mp -67.92 88.42 0.26 Allowed 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.507 -0.769 . . . . 74.349999999999994 110.384 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.698 ' H ' ' HB2' ' B' ' 142' ' ' LYS . . . -85.17 58.05 4.81 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.851 -0.426 . . . . 44.210000000000001 109.851 176.113 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.714 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 51.5 p90 -86.02 162.55 18.43 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.982 -0.554 . . . . 61.439999999999998 110.731 -177.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.402 ' HD3' HD13 ' A' ' 57' ' ' ILE . 14.1 tptm -98.12 118.91 35.79 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.324 -0.853 . . . . 64.299999999999997 110.109 -176.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 46.5 t -120.18 99.89 6.86 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.917 0.389 . . . . 74.329999999999998 110.691 178.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 66.84 6.37 4.56 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.413 -0.812 . . . . 73.430000000000007 112.968 171.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 133.26 -27.58 3.4 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.403 -0.903 . . . . 71.239999999999995 112.636 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -107.86 139.33 42.62 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.253 0.549 . . . . 61.43 110.868 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.402 HD13 ' HD3' ' A' ' 52' ' ' LYS . 45.9 mm -77.37 123.41 33.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.473 -0.785 . . . . 73.120000000000005 109.939 178.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.42 ' HE2' ' CE1' ' A' ' 69' ' ' PHE . 30.9 mmmt -107.81 90.65 3.36 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 121.084 -0.246 . . . . 74.540000000000006 110.722 -177.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.58 110.09 7.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.33 -0.395 . . . . 61.210000000000001 111.572 -178.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -120.92 123.41 42.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.345 -0.388 . . . . 75.099999999999994 110.447 174.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 7.0 t -100.71 -4.31 28.48 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.396 0.617 . . . . 71.200000000000003 109.357 179.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -142.84 159.4 42.3 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.533 -0.758 . . . . 73.109999999999999 110.007 177.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 46.6 tp -87.14 -20.58 26.83 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.272 -0.422 . . . . 72.340000000000003 110.452 -175.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -61.6 -51.33 68.97 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.901 -0.591 . . . . 74.319999999999993 110.484 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.7 t -66.27 -36.82 83.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.818 -0.628 . . . . 63.210000000000001 110.429 178.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.469 HD23 ' O ' ' A' ' 66' ' ' LEU . 6.2 tt -66.1 -37.77 86.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.724 -0.671 . . . . 73.340000000000003 110.428 -178.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.851 ' HG3' HD21 ' A' ' 84' ' ' LEU . 55.3 ttp180 -57.65 -38.71 75.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 73.030000000000001 110.967 -179.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -63.39 -38.36 90.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 75.439999999999998 110.979 177.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.42 ' CE1' ' HE2' ' A' ' 58' ' ' LYS . 54.0 t80 -68.41 -47.86 66.17 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.082 -0.508 . . . . 73.239999999999995 110.554 -178.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.442 ' HA ' ' HB2' ' A' ' 73' ' ' LYS . . . -62.56 -28.74 70.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.828 0.347 . . . . 54.100000000000001 111.349 177.483 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 34.6 t -67.43 -31.15 71.14 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.143 -0.48 . . . . 62.329999999999998 111.084 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -100.76 6.71 43.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.353 0.597 . . . . 73.0 109.98 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.442 ' HB2' ' HA ' ' A' ' 70' ' ' ALA . 21.3 mmmt -112.54 102.9 10.96 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.369 -0.832 . . . . 63.43 110.584 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.484 ' O ' ' HB3' ' A' ' 77' ' ' LYS . 14.8 p -54.51 -38.74 66.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.331 -0.395 . . . . 62.409999999999997 111.591 -178.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.536 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 47.3 t -66.37 -49.61 66.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.796 0.331 . . . . 74.0 110.919 178.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 80.9 mtp -71.76 -22.22 61.63 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.931 0.396 . . . . 73.430000000000007 110.728 -175.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.484 ' HB3' ' O ' ' A' ' 74' ' ' SER . 29.3 tttp -53.82 -34.64 59.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.661 -0.699 . . . . 75.019999999999996 110.707 172.376 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.521 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 32.8 mm-40 -101.7 3.82 40.05 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.75 -0.659 . . . . 74.319999999999993 110.419 -175.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.582 HD22 ' ND2' ' B' ' 137' ' ' ASN . 53.2 mt -101.06 -47.26 4.81 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.17 -0.923 . . . . 71.540000000000006 109.168 175.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.0 mt -91.86 2.25 56.64 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.716 -0.675 . . . . 45.43 111.024 -175.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.521 ' HD2' ' HA ' ' A' ' 78' ' ' GLU . 20.8 ptmt -54.41 -20.72 8.0 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.146 -0.479 . . . . 61.219999999999999 112.278 178.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -82.27 -37.62 25.6 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.05 0.453 . . . . 65.310000000000002 110.945 178.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 24.3 t -79.75 -40.2 20.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.066 -0.515 . . . . 71.540000000000006 110.308 -178.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.851 HD21 ' HG3' ' A' ' 67' ' ' ARG . 10.6 mp -89.89 138.75 27.62 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 115.843 -0.617 . . . . 62.399999999999999 110.5 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -67.42 110.48 2.05 Favored 'Trans proline' 0 C--O 1.232 0.216 0 C-N-CA 122.706 2.271 . . . . 75.329999999999998 111.379 178.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 87.2 mm-40 -121.74 -176.36 3.3 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.206 0.527 . . . . 75.219999999999999 110.499 -176.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.778 ' HG3' ' HB ' ' B' ' 111' ' ' THR . 0.6 OUTLIER -143.47 39.62 1.42 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 122.133 0.968 . . . . 70.540000000000006 108.598 177.702 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 . . . . . 0 C--N 1.312 -1.038 0 CA-C-N 113.891 -1.504 . . . . 73.109999999999999 110.35 -176.983 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.423 0 N-CA-C 112.394 -0.282 . . . . 41.530000000000001 112.394 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 8.2 p -117.6 134.64 60.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 120.967 0.413 . . . . 75.209999999999994 110.715 -178.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' LEU . . . . . 0.448 HD12 ' O ' ' B' ' 103' ' ' LEU . 1.0 OUTLIER -127.56 144.72 51.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.006 0.431 . . . . 41.240000000000002 110.747 177.702 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 26.4 mmt -109.77 -30.03 8.04 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.964 -0.562 . . . . 74.030000000000001 109.968 -179.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 61.34 25.62 15.56 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.4 -0.818 . . . . 64.230000000000004 111.073 178.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -65.57 144.23 57.12 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.894 -1.048 . . . . 73.109999999999999 110.66 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -80.25 102.3 2.05 Favored Glycine 0 N--CA 1.44 -1.06 0 C-N-CA 121.228 -0.51 . . . . 51.409999999999997 112.531 -178.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -64.59 150.35 47.09 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.447 -0.376 . . . . 72.299999999999997 110.031 172.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 34.6 t -73.18 115.88 14.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.401 -0.363 . . . . 75.109999999999999 110.819 -175.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 110' ' ' LEU . . . . . 0.483 ' H ' HD12 ' B' ' 110' ' ' LEU . 6.5 mp -57.94 131.41 50.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.794 -0.639 . . . . 53.240000000000002 110.729 -179.352 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . 0.778 ' HB ' ' HG3' ' A' ' 87' ' ' LYS . 34.4 m -153.13 134.66 14.4 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.241 -0.436 . . . . 71.019999999999996 110.446 -178.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . 0.427 ' O ' HG22 ' B' ' 111' ' ' THR . 3.4 pp -100.89 170.66 8.15 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.496 -0.927 . . . . 70.099999999999994 108.496 167.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 113' ' ' ALA . . . . . 0.51 ' CB ' ' H ' ' B' ' 117' ' ' SER . . . -52.87 128.84 28.29 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.753 0.311 . . . . 64.230000000000004 111.65 -177.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -94.44 -32.05 13.7 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.169 0.509 . . . . 74.400000000000006 110.486 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -91.18 -36.4 13.97 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.808 -0.633 . . . . 70.430000000000007 111.161 -177.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 82.0 mt -98.16 -49.5 4.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.022 0.439 . . . . 75.239999999999995 109.997 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.51 ' H ' ' CB ' ' B' ' 113' ' ' ALA . 9.6 m 52.41 75.41 0.23 Allowed 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 114.876 -1.056 . . . . 70.200000000000003 111.712 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 9.5 t -92.55 148.69 21.88 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.969 -0.56 . . . . 74.109999999999999 110.609 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -146.38 122.0 10.46 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.297 -0.411 . . . . 72.310000000000002 110.564 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 32.8 m -112.8 102.94 10.94 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.392 -0.367 . . . . 71.230000000000004 111.164 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 13.6 mt -158.91 143.0 15.43 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.693 -0.685 . . . . 71.219999999999999 110.438 177.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 122' ' ' ASP . . . . . 0.445 ' O ' ' HB2' ' A' ' 24' ' ' SER . 6.1 t70 -161.5 -153.59 0.3 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.514 -0.921 . . . . 74.439999999999998 108.514 -178.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 14.3 tt -107.48 130.32 59.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.707 -0.479 . . . . 71.510000000000005 109.707 173.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.552 ' H ' ' HB3' ' A' ' 24' ' ' SER . 10.7 t -178.45 -171.23 0.24 Allowed 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.538 -0.541 . . . . 74.319999999999993 109.538 -177.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . 0.57 ' HD3' ' N ' ' B' ' 125' ' ' LYS . 0.3 OUTLIER -136.84 84.3 2.06 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.676 -0.693 . . . . 75.409999999999997 110.011 -178.4 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 86.8 mm-40 -128.99 117.99 21.84 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.049 0.452 . . . . 73.230000000000004 111.833 -175.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 127' ' ' TRP . . . . . 0.467 ' CZ2' ' HB2' ' A' ' 25' ' ' LYS . 82.5 m95 -127.28 78.48 1.82 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.895 -0.78 . . . . 75.200000000000003 108.895 175.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 13.5 m -100.71 -30.37 11.77 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.269 -0.423 . . . . 63.350000000000001 111.439 -171.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 42.7 m-20 -98.92 32.2 2.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.358 -0.383 . . . . 74.239999999999995 111.961 -174.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.558 HG12 ' HD2' ' B' ' 131' ' ' PHE . 34.8 t -91.11 115.83 31.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 109.979 -0.378 . . . . 72.010000000000005 109.979 178.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 131' ' ' PHE . . . . . 0.612 ' HB3' HD21 ' A' ' 49' ' ' LEU . 26.0 p90 52.53 9.36 0.1 Allowed 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.921 1.288 . . . . 74.010000000000005 113.92 178.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.4 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 44.7 t30 -56.58 -55.12 37.88 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.85 0.357 . . . . 73.510000000000005 111.324 -177.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 133' ' ' ILE . . . . . 0.527 HG21 ' HB3' ' A' ' 79' ' ' LEU . 49.1 mm -58.11 -41.42 80.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.002 -0.544 . . . . 71.25 111.247 -178.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.409 HD12 HD23 ' A' ' 49' ' ' LEU . 84.5 mt -63.65 -36.97 85.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.02 -0.536 . . . . 74.25 110.906 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -72.42 -38.89 68.27 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.653 -0.249 . . . . 60.140000000000001 110.488 179.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 136' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 28.7 mm-40 -64.31 -43.14 95.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.241 -0.436 . . . . 42.409999999999997 111.282 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 137' ' ' ASN . . . . . 0.582 ' ND2' HD22 ' A' ' 79' ' ' LEU . 92.1 m-20 -92.21 7.61 41.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.161 -0.472 . . . . 73.439999999999998 111.227 -178.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 55.63 57.91 4.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.408 -0.815 . . . . 72.5 112.96 174.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -82.97 -10.1 58.96 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.595 -0.891 . . . . 70.430000000000007 108.595 165.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 59.6 71.8 0.87 Allowed Pre-proline 0 C--O 1.234 0.274 0 CA-C-N 114.204 -1.362 . . . . 75.420000000000002 110.828 -176.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.5 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 89.1 Cg_endo -79.95 144.94 17.34 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.508 2.139 . . . . 75.109999999999999 111.591 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 142' ' ' LYS . . . . . 0.698 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 13.9 mptt -95.32 152.74 18.12 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.036 0.446 . . . . 70.540000000000006 110.448 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 143' ' ' PHE . . . . . 0.546 ' HA ' HG13 ' A' ' 47' ' ' VAL . 31.1 t80 -152.12 36.75 0.54 Allowed 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.205 -1.035 . . . . 73.409999999999997 108.205 -177.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 50.5 tp -62.67 100.1 0.18 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.769 -1.105 . . . . 63.130000000000003 109.846 -179.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 43.8 t -120.68 136.1 54.94 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.78 -0.645 . . . . 72.450000000000003 111.032 -172.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . 0.475 ' HB2' ' HE3' ' B' ' 148' ' ' LYS . 9.1 pt-20 -134.15 38.7 3.14 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.529 0.681 . . . . 70.329999999999998 109.259 172.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 92.3 t -75.05 96.5 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.637 -0.71 . . . . 72.019999999999996 110.005 178.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . 0.475 ' HE3' ' HB2' ' B' ' 146' ' ' GLU . 0.0 OUTLIER -141.76 131.47 24.15 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.055 -0.975 . . . . 74.209999999999994 109.758 177.179 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.767 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.5 mp -74.14 86.67 1.89 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.597 -0.729 . . . . 74.010000000000005 110.359 -178.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.501 ' HB2' HG23 ' B' ' 159' ' ' THR . . . -85.19 62.34 7.44 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.014 -0.539 . . . . 75.120000000000005 109.649 174.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 151' ' ' PHE . . . . . 0.767 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 49.6 p90 -92.09 164.01 13.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.015 -0.539 . . . . 74.209999999999994 110.737 -175.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -92.08 117.38 29.79 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.704 -0.68 . . . . 75.019999999999996 110.794 -178.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 153' ' ' CYS . . . . . 0.617 ' HB3' ' CG ' ' B' ' 158' ' ' LYS . 50.8 t -131.56 116.96 18.1 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.541 -0.3 . . . . 54.420000000000002 110.889 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 67.71 11.53 8.41 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.674 -0.694 . . . . 71.530000000000001 112.408 175.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 110.06 -16.24 30.37 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.407 -0.901 . . . . 65.150000000000006 112.572 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 156' ' ' GLU . . . . . 0.479 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 9.6 pt-20 -116.42 143.98 44.88 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.841 0.353 . . . . 73.239999999999995 110.41 177.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 43.5 mm -70.59 118.69 15.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.209 -0.451 . . . . 75.310000000000002 110.045 177.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 158' ' ' LYS . . . . . 0.617 ' CG ' ' HB3' ' B' ' 153' ' ' CYS . 31.5 mmmt -104.08 88.31 2.98 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.945 -0.391 . . . . 70.329999999999998 109.945 -179.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . 0.501 HG23 ' HB2' ' B' ' 150' ' ' ALA . 0.2 OUTLIER -75.63 110.19 9.83 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.892 -0.595 . . . . 70.430000000000007 111.461 -175.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -121.8 124.41 44.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.521 -0.308 . . . . 75.129999999999995 111.009 178.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . 0.453 ' HB2' ' HB3' ' B' ' 148' ' ' LYS . 9.5 t -106.38 0.61 25.05 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.038 -0.727 . . . . 61.329999999999998 109.038 176.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -121.28 124.18 44.0 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.499 -0.773 . . . . 50.240000000000002 110.339 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 55.2 tp -68.56 -32.77 72.93 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.149 -0.686 . . . . 63.130000000000003 109.149 175.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -59.62 -50.32 74.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.333 -0.849 . . . . 71.430000000000007 110.922 176.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 32.3 t -67.54 -39.6 85.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.203 -0.453 . . . . 72.200000000000003 110.432 -178.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . 0.425 HD23 ' O ' ' B' ' 166' ' ' LEU . 4.1 tt -65.71 -36.46 83.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.07 -0.514 . . . . 35.539999999999999 110.294 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . 0.559 ' HG3' HD11 ' B' ' 184' ' ' LEU . 43.3 ttp180 -62.78 -34.88 78.17 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.249 0.547 . . . . 72.010000000000005 110.062 179.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -66.66 -38.56 87.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.818 -0.628 . . . . 45.299999999999997 110.458 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 169' ' ' PHE . . . . . 0.518 ' CZ ' ' HE3' ' B' ' 173' ' ' LYS . 69.8 t80 -67.05 -46.38 74.54 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.424 -0.807 . . . . 72.439999999999998 110.661 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.61 -26.67 68.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.504 -0.316 . . . . 53.32 111.428 179.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 8.6 t -64.98 -27.84 69.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.241 -0.436 . . . . 63.399999999999999 110.59 -178.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -106.08 15.98 25.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.248 0.547 . . . . 74.439999999999998 110.33 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 173' ' ' LYS . . . . . 0.518 ' HE3' ' CZ ' ' B' ' 169' ' ' PHE . 64.1 mmtt -117.3 115.63 25.64 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.612 -0.722 . . . . 74.439999999999998 110.427 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.2 p -57.7 -41.44 81.68 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.909 0.385 . . . . 72.329999999999998 111.869 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 175' ' ' SER . . . . . 0.526 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 45.7 t -82.04 -47.08 13.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.827 0.346 . . . . 72.109999999999999 110.325 -178.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.462 ' HB2' ' CB ' ' B' ' 173' ' ' LYS . 70.9 mtp -67.47 -25.85 66.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.454 -0.339 . . . . 64.409999999999997 111.866 -174.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . 0.49 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 26.0 ttpp -62.11 -35.09 77.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.842 0.353 . . . . 54.240000000000002 110.558 176.152 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . 0.602 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 18.8 mm-40 -89.71 -12.11 40.39 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-O 121.661 0.743 . . . . 74.219999999999999 109.88 -175.134 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 179' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' B' ' 175' ' ' SER . 74.7 mt -82.08 -47.82 12.13 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.767 -1.106 . . . . 63.329999999999998 109.173 175.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 7.5 mt -94.27 0.92 55.95 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.764 -0.653 . . . . 72.420000000000002 111.451 -173.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 181' ' ' LYS . . . . . 0.602 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 17.8 ptmt -58.6 -8.44 1.26 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 112.083 0.401 . . . . 74.299999999999997 112.083 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -68.29 -37.01 80.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.021 0.438 . . . . 74.099999999999994 110.411 175.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 183' ' ' VAL . . . . . 0.468 HG11 ' HB3' ' A' ' 29' ' ' ASN . 31.2 m -104.47 -15.29 8.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.15 -0.477 . . . . 62.409999999999997 111.198 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 184' ' ' LEU . . . . . 0.559 HD11 ' HG3' ' B' ' 167' ' ' ARG . 11.1 mp -84.81 136.85 38.53 Favored Pre-proline 0 C--N 1.325 -0.488 0 N-CA-C 109.676 -0.49 . . . . 54.350000000000001 109.676 175.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_exo -61.22 114.74 2.33 Favored 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 122.697 2.265 . . . . 75.219999999999999 111.926 -179.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -114.98 170.41 8.37 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 121.21 0.528 . . . . 74.109999999999999 110.353 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 187' ' ' LYS . . . . . 0.557 ' HD3' ' HB ' ' A' ' 11' ' ' THR . 11.7 mmmm -136.17 -51.15 0.71 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.292 -0.867 . . . . 74.430000000000007 110.468 -178.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.772 -0.632 . . . . 73.209999999999994 110.388 -178.49 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.787 0 N-CA-C 111.211 -0.756 . . . . 71.5 111.211 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.8 p -130.73 143.59 40.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.318 0.58 . . . . 65.439999999999998 111.727 -174.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 47.0 tp -128.34 138.44 52.38 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.145 -1.058 . . . . 74.129999999999995 108.145 171.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 22.5 ptm -73.46 85.05 1.51 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.184 0.516 . . . . 75.519999999999996 111.472 -175.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -173.13 -172.07 0.79 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.604 -0.726 . . . . 64.420000000000002 109.133 177.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -99.62 117.02 33.09 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.942 0.401 . . . . 74.219999999999999 110.815 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 129.65 127.72 2.96 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.847 -0.615 . . . . 61.420000000000002 112.037 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -100.68 132.53 46.03 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 110.229 -0.285 . . . . 73.099999999999994 110.229 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 5.2 p -121.15 116.49 49.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.435 0.636 . . . . 72.530000000000001 111.081 -178.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 95.0 mt -94.62 151.93 18.91 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.644 -0.707 . . . . 74.140000000000001 109.813 175.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.6 t -166.95 179.62 5.16 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.485 -0.325 . . . . 63.32 110.53 -177.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.574 HD13 ' N ' ' A' ' 13' ' ' ALA . 2.4 tm? -71.89 143.16 49.46 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.312 -0.625 . . . . 72.329999999999998 109.312 177.591 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.742 ' HA ' ' HA ' ' A' ' 17' ' ' SER . . . 71.11 32.86 2.17 Favored 'General case' 0 CA--C 1.511 -0.536 0 O-C-N 123.841 0.713 . . . . 73.430000000000007 111.483 178.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 15' ' ' ASP . . . -66.59 90.53 0.16 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.937 -0.574 . . . . 42.119999999999997 110.616 176.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.402 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 9.4 m-20 80.52 -44.11 0.24 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.512 -1.222 . . . . 73.230000000000004 112.286 171.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.9 mp -91.06 -28.9 17.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.703 -0.226 . . . . 71.150000000000006 111.191 -175.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.742 ' HA ' ' HA ' ' A' ' 13' ' ' ALA . 23.0 t 66.5 94.33 0.07 Allowed 'General case' 0 C--O 1.233 0.189 0 CA-C-O 122.066 0.936 . . . . 45.140000000000001 110.869 -176.123 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.5 m -91.01 77.73 6.05 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.867 -1.06 . . . . 72.349999999999994 110.066 178.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -153.55 171.94 17.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.793 -0.639 . . . . 75.340000000000003 109.867 -179.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.852 ' HB ' ' HB2' ' B' ' 103' ' ' LEU . 16.8 p -92.4 158.43 16.07 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.799 0.333 . . . . 44.439999999999998 111.036 178.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -161.37 -178.35 6.6 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.045 -0.525 . . . . 74.239999999999995 110.8 -176.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.417 ' OD1' HG22 ' A' ' 23' ' ' ILE . 4.9 t70 -142.83 -167.66 2.58 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 107.873 -1.158 . . . . 72.340000000000003 107.873 175.351 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.417 HG22 ' OD1' ' A' ' 22' ' ' ASP . 12.2 tt -80.52 120.84 32.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.218 0.532 . . . . 71.409999999999997 110.615 -179.095 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.588 ' H ' HD22 ' B' ' 144' ' ' LEU . 27.7 m -81.7 173.24 12.51 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.001 -0.545 . . . . 64.230000000000004 109.777 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.477 ' HD3' ' HA ' ' A' ' 25' ' ' LYS . 31.6 mmtm -128.2 99.63 5.53 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.751 0.786 . . . . 72.349999999999994 112.116 178.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.739 ' H ' ' NE2' ' A' ' 26' ' ' GLN . 0.0 OUTLIER -81.06 123.18 28.17 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 114.191 -1.368 . . . . 73.219999999999999 107.826 172.582 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 76.8 m95 -84.93 -170.06 2.95 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 121.592 0.71 . . . . 73.430000000000007 111.297 -173.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 47.5 m -72.51 -55.58 6.74 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.832 -1.076 . . . . 55.130000000000003 110.835 -175.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.555 HD22 HG21 ' B' ' 183' ' ' VAL . 47.1 t30 -109.92 80.35 1.3 Allowed 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 121.124 0.488 . . . . 75.030000000000001 110.983 -178.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.439 HG23 ' CD2' ' A' ' 31' ' ' PHE . 9.9 m -98.35 -26.87 3.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.855 -0.611 . . . . 32.409999999999997 109.566 171.069 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.583 ' HB2' ' HB3' ' A' ' 41' ' ' PRO . 11.6 p90 -158.11 18.19 0.24 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.246 -0.888 . . . . 52.329999999999998 109.536 173.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.526 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 9.4 t30 -64.87 -54.61 28.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.22 -0.9 . . . . 74.319999999999993 111.548 -170.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.486 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 47.7 mm -57.32 -41.67 78.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 CA-C-O 121.03 0.443 . . . . 72.129999999999995 111.377 -176.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.849 HD12 HD21 ' B' ' 149' ' ' LEU . 80.0 mt -66.59 -37.38 84.79 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.0 -0.545 . . . . 75.319999999999993 110.646 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 35' ' ' ARG . 20.5 ttt85 -64.47 -40.56 95.93 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.202 -0.454 . . . . 74.120000000000005 110.687 178.233 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 4.6 mm-40 -72.0 -27.59 62.84 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.991 -0.549 . . . . 74.420000000000002 111.671 -177.019 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -100.9 4.29 42.54 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.877 0.37 . . . . 70.109999999999999 111.034 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 22.2 t70 61.66 69.68 0.63 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.406 -0.815 . . . . 61.340000000000003 111.487 177.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.566 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 7.6 m-85 -107.22 -7.39 16.8 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.231 -0.895 . . . . 65.049999999999997 109.882 172.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 68.51 93.73 0.05 OUTLIER Pre-proline 0 C--O 1.232 0.173 0 CA-C-N 114.81 -1.086 . . . . 64.049999999999997 111.128 -177.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.583 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 67.5 Cg_endo -75.29 166.27 29.19 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.774 2.316 . . . . 75.420000000000002 111.444 175.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.743 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 13.9 tptt -114.61 176.57 4.99 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 119.596 -0.842 . . . . 75.400000000000006 112.63 -177.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 53.9 t80 165.47 107.28 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 114.478 -1.237 . . . . 75.430000000000007 107.871 -167.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.679 ' H ' HG11 ' B' ' 147' ' ' VAL . 74.4 mt -127.53 -13.23 5.45 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.761 0.282 . . . . 71.439999999999998 111.761 -172.223 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 22.3 m -95.41 109.94 22.05 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.121 -0.326 . . . . 42.439999999999998 110.121 -178.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 32.1 mp0 -72.99 95.46 2.0 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.055 0.455 . . . . 73.540000000000006 110.371 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.417 HG21 ' H ' ' B' ' 144' ' ' LEU . 11.1 t -65.32 157.41 5.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.482 -0.781 . . . . 75.150000000000006 109.063 175.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.428 ' O ' ' HB3' ' B' ' 142' ' ' LYS . 0.0 OUTLIER -84.12 133.14 34.64 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.02 -0.733 . . . . 75.519999999999996 109.02 -174.562 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.832 HD21 HD12 ' B' ' 134' ' ' LEU . 41.2 tp -75.25 87.96 2.51 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.282 0.563 . . . . 52.409999999999997 110.384 -175.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 1.003 ' HB2' HG23 ' A' ' 59' ' ' THR . . . -97.14 96.36 8.39 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.03 -0.986 . . . . 65.219999999999999 110.216 177.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.421 ' HB2' ' HB3' ' B' ' 139' ' ' PHE . 53.7 p90 -111.81 167.61 10.23 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.071 -0.513 . . . . 70.030000000000001 110.289 -179.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -97.03 122.91 40.54 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.304 -0.407 . . . . 61.219999999999999 111.031 -178.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 46.0 t -132.95 107.5 8.32 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.164 -0.471 . . . . 72.219999999999999 110.0 176.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 68.07 23.61 8.03 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.284 0.476 . . . . 74.450000000000003 112.284 174.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 104.25 -19.03 44.08 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.277 -0.963 . . . . 62.439999999999998 112.428 177.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.468 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 9.7 pt-20 -108.4 138.96 43.83 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.183 0.515 . . . . 74.25 110.723 179.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.0 mm -77.31 124.22 35.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.738 -0.665 . . . . 74.129999999999995 109.6 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.468 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 26.2 mmmt -103.78 90.57 3.68 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.816 -0.438 . . . . 63.229999999999997 109.816 -179.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 1.003 HG23 ' HB2' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -81.39 105.64 12.73 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.927 -0.579 . . . . 71.099999999999994 111.309 -177.784 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -110.48 133.11 53.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.304 -0.407 . . . . 72.099999999999994 110.805 178.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.3 p -79.63 -18.69 50.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.946 -0.57 . . . . 64.209999999999994 111.443 -178.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -152.95 172.71 16.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.167 -0.47 . . . . 53.340000000000003 110.588 -178.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -84.88 -12.59 53.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.111 -0.495 . . . . 75.530000000000001 111.612 -176.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -74.97 -42.66 57.16 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.975 -0.75 . . . . 71.439999999999998 108.975 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.584 ' HA ' ' HE2' ' A' ' 68' ' ' LYS . 15.0 m -65.99 -37.07 85.02 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.407 -0.815 . . . . 75.140000000000001 110.137 177.159 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.525 HD11 HD11 ' B' ' 134' ' ' LEU . 6.0 tt -68.19 -38.3 81.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.82 -0.627 . . . . 74.209999999999994 109.784 178.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.667 ' HG3' HD22 ' A' ' 84' ' ' LEU . 54.8 ttp180 -51.41 -38.76 55.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.076 -0.965 . . . . 75.239999999999995 111.02 -179.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.584 ' HE2' ' HA ' ' A' ' 65' ' ' SER . 49.8 mtmt -64.94 -51.36 62.27 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.72 -0.673 . . . . 72.099999999999994 110.785 178.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -64.52 -42.11 95.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.353 -0.839 . . . . 62.25 111.36 -175.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.19 -33.1 75.2 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.207 -0.451 . . . . 73.209999999999994 111.234 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.1 m -74.38 -22.73 59.05 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.673 0.273 . . . . 74.129999999999995 111.374 -178.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -98.83 5.98 47.12 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.283 0.563 . . . . 53.310000000000002 110.459 177.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.7 mmmt -108.0 109.41 20.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.421 -0.809 . . . . 71.319999999999993 109.334 172.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.0 p -51.18 -35.98 38.89 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.469 0.544 . . . . 75.349999999999994 112.469 -174.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 41.2 t -78.13 -56.35 4.54 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.674 0.274 . . . . 65.030000000000001 110.807 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 78.0 mtp -64.24 -21.38 66.56 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.871 0.367 . . . . 64.409999999999997 111.513 -174.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.406 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 88.5 tttt -59.6 -25.64 64.79 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.845 -0.616 . . . . 74.310000000000002 111.106 179.253 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.518 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 32.4 mt-10 -104.93 5.49 32.85 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.233 0.54 . . . . 74.019999999999996 110.629 -178.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.538 ' HB3' HG21 ' B' ' 133' ' ' ILE . 10.6 mp -91.55 -52.09 4.94 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.42 -0.809 . . . . 63.200000000000003 109.447 173.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -81.2 -10.48 59.61 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.511 -0.768 . . . . 61.340000000000003 111.256 -176.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.518 ' HD3' ' HA ' ' A' ' 78' ' ' GLU . 64.8 pttt -59.83 -18.46 44.09 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 111.975 0.361 . . . . 63.310000000000002 111.975 -176.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -66.2 -36.51 83.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.968 0.413 . . . . 70.329999999999998 110.636 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 29.2 m -110.12 4.34 8.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.239 0.543 . . . . 74.329999999999998 110.45 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.667 HD22 ' HG3' ' A' ' 67' ' ' ARG . 45.0 tp -138.36 104.37 7.84 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.599 -0.728 . . . . 74.099999999999994 110.661 -175.155 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.44 111.22 3.16 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.79 2.327 . . . . 60.450000000000003 111.443 178.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 80.1 mm-40 -66.93 103.46 1.15 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.103 -0.499 . . . . 70.239999999999995 111.567 -176.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? 65.49 19.38 11.54 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.2 -0.909 . . . . 71.109999999999999 112.498 175.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 . . . . . 0 C--N 1.317 -0.816 0 CA-C-N 116.647 -0.251 . . . . 75.510000000000005 110.559 178.721 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 N-CA-C 112.135 -0.386 . . . . 64.409999999999997 112.135 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 9.8 p -160.98 154.22 3.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 110.077 -0.342 . . . . 73.329999999999998 110.077 179.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' LEU . . . . . 0.852 ' HB2' ' HB ' ' A' ' 20' ' ' THR . 29.0 tp -73.54 170.57 14.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.039 0.447 . . . . 54.329999999999998 110.961 -179.042 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' MET . . . . . 0.483 ' N ' ' HG ' ' B' ' 103' ' ' LEU . 20.2 ptm -79.36 8.23 6.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.859 -0.61 . . . . 75.25 111.056 178.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -77.43 139.94 39.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.968 -0.56 . . . . 64.430000000000007 109.681 178.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -69.1 122.7 19.29 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.97 0.414 . . . . 62.530000000000001 110.574 -176.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 113.28 82.66 1.16 Allowed Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 111.087 -0.805 . . . . 60.219999999999999 111.087 -174.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -99.95 90.35 4.38 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.926 0.393 . . . . 73.319999999999993 111.587 -174.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 94.0 t -103.56 128.15 56.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 116.135 -0.484 . . . . 72.120000000000005 109.753 174.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 91.2 mt -84.06 138.89 32.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.308 0.575 . . . . 72.099999999999994 111.285 -177.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 11.0 t -100.75 174.61 5.97 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.236 -0.893 . . . . 72.439999999999998 109.654 178.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . 0.499 HD13 ' N ' ' B' ' 113' ' ' ALA . 3.4 tm? -66.16 138.74 57.92 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.75 -0.833 . . . . 74.400000000000006 108.75 173.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 113' ' ' ALA . . . . . 0.583 ' HB1' ' HA ' ' B' ' 117' ' ' SER . . . 64.11 39.69 7.51 Favored 'General case' 0 CA--C 1.512 -0.496 0 O-C-N 123.604 0.565 . . . . 62.229999999999997 110.804 178.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.51 92.32 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.646 -0.707 . . . . 52.350000000000001 111.476 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 30.8 t70 82.88 -34.96 0.08 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.227 -1.351 . . . . 72.530000000000001 112.829 168.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 7.4 mp -95.98 -40.11 9.43 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.883 -0.327 . . . . 65.140000000000001 110.321 -178.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.583 ' HA ' ' HB1' ' B' ' 113' ' ' ALA . 33.1 t 63.36 94.2 0.05 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.378 -0.828 . . . . 64.439999999999998 110.602 -178.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 15.6 m -57.07 94.62 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.351 -1.295 . . . . 70.310000000000002 111.599 178.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -176.45 -174.45 0.59 Allowed 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.842 -0.617 . . . . 73.200000000000003 109.813 -178.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 37.2 m -118.99 108.15 14.4 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 110.041 -0.355 . . . . 74.530000000000001 110.041 176.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -109.08 66.72 0.64 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.295 0.569 . . . . 73.329999999999998 112.195 -176.032 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -121.37 88.39 2.93 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.419 0.628 . . . . 72.109999999999999 109.664 173.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . 0.501 HG23 ' HE3' ' B' ' 125' ' ' LYS . 8.8 tt -133.3 128.87 56.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.377 -0.829 . . . . 72.219999999999999 109.427 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 15.6 m -87.11 84.31 7.31 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.403 0.621 . . . . 60.229999999999997 110.806 -172.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . 0.501 ' HE3' HG23 ' B' ' 123' ' ' ILE . 0.0 OUTLIER -134.08 24.46 3.89 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.262 -0.881 . . . . 74.329999999999998 110.025 177.721 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -85.63 -171.57 3.67 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.183 -0.917 . . . . 71.099999999999994 110.239 179.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -133.35 142.42 48.41 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 108.987 -0.746 . . . . 72.329999999999998 108.987 178.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 45.0 m -65.1 -29.55 70.42 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.261 0.553 . . . . 53.439999999999998 109.607 170.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -77.64 104.35 8.12 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.58 -0.737 . . . . 75.310000000000002 109.583 173.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.463 ' C ' ' H ' ' B' ' 132' ' ' ASN . 11.2 m -128.5 -149.8 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 115.447 -0.797 . . . . 74.209999999999994 110.404 -179.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 131' ' ' PHE . . . . . 0.438 ' H ' ' HB ' ' B' ' 130' ' ' VAL . 10.7 p90 -72.04 26.98 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.129 -0.487 . . . . 63.219999999999999 111.93 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.465 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 64.4 t30 -57.97 -53.73 54.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.028 0.442 . . . . 71.329999999999998 110.617 -176.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 133' ' ' ILE . . . . . 0.538 HG21 ' HB3' ' A' ' 79' ' ' LEU . 49.1 mm -60.55 -43.71 95.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.787 -0.642 . . . . 73.040000000000006 111.549 -177.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.832 HD12 HD21 ' A' ' 49' ' ' LEU . 80.8 mt -67.46 -24.3 65.6 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.263 -0.426 . . . . 75.049999999999997 111.266 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -73.63 -46.05 49.19 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.122 0.486 . . . . 61.299999999999997 110.062 177.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 136' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 26.7 mm-40 -65.45 -33.24 75.49 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.472 -0.785 . . . . 75.340000000000003 110.97 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -99.04 5.56 47.02 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.546 -0.297 . . . . 61.43 111.432 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 52.37 70.59 0.55 Allowed 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.55 0.944 . . . . 64.340000000000003 113.55 175.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 139' ' ' PHE . . . . . 0.447 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 28.1 m-85 -99.77 0.99 42.78 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.832 -0.622 . . . . 74.430000000000007 109.645 169.133 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 61.75 89.94 0.1 OUTLIER Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 114.842 -1.072 . . . . 74.129999999999995 111.472 -173.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.417 ' HA ' ' CD1' ' A' ' 49' ' ' LEU . 22.4 Cg_exo -65.94 143.54 73.2 Favored 'Trans proline' 0 N--CA 1.463 -0.318 0 C-N-CA 122.632 2.221 . . . . 74.019999999999996 110.695 172.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 142' ' ' LYS . . . . . 0.708 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 17.2 tptt -87.81 173.74 8.79 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 119.658 -0.817 . . . . 73.109999999999999 111.652 -176.098 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 143' ' ' PHE . . . . . 0.404 ' H ' ' HG3' ' B' ' 142' ' ' LYS . 42.7 t80 166.86 114.83 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.106 -1.072 . . . . 63.420000000000002 108.106 -166.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . 0.588 HD22 ' H ' ' A' ' 24' ' ' SER . 96.0 mt -136.61 -46.96 0.61 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.999 0.428 . . . . 63.43 111.324 -176.119 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 31.3 m -66.52 114.41 5.47 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.313 -0.858 . . . . 54.43 111.584 -175.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -79.09 95.2 5.49 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.299 -0.63 . . . . 71.030000000000001 109.299 175.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 147' ' ' VAL . . . . . 0.679 HG11 ' H ' ' A' ' 44' ' ' LEU . 5.1 t -69.24 169.93 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.919 -0.582 . . . . 72.519999999999996 109.962 -179.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . 0.59 ' HB3' ' HA ' ' B' ' 161' ' ' SER . 0.0 OUTLIER -85.52 129.38 34.83 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.553 -0.536 . . . . 74.219999999999999 109.553 -175.758 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.849 HD21 HD12 ' A' ' 34' ' ' LEU . 39.1 tp -76.03 98.18 4.24 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.243 -0.89 . . . . 73.430000000000007 110.743 -173.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.976 ' HB2' HG23 ' B' ' 159' ' ' THR . . . -102.25 102.45 12.85 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.112 -0.949 . . . . 62.210000000000001 110.213 177.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 151' ' ' PHE . . . . . 0.58 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 37.6 p90 -125.89 166.65 16.5 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.84 -0.618 . . . . 60.240000000000002 110.13 -178.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -87.04 115.52 24.48 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.183 0.516 . . . . 74.25 110.802 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 153' ' ' CYS . . . . . 0.493 ' HB3' ' CG ' ' B' ' 158' ' ' LYS . 45.7 t -134.13 122.86 23.48 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.845 -0.616 . . . . 75.329999999999998 110.183 177.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.1 t70 70.23 8.63 6.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.233 -0.894 . . . . 72.299999999999997 111.956 174.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 111.53 -9.11 28.32 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.267 -0.968 . . . . 22.239999999999998 112.959 176.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -124.24 160.99 26.73 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.673 -0.491 . . . . 75.230000000000004 109.673 175.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 47.2 mm -80.12 119.53 29.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.737 -0.468 . . . . 71.099999999999994 109.737 175.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 158' ' ' LYS . . . . . 0.493 ' CG ' ' HB3' ' B' ' 153' ' ' CYS . 30.7 mmmt -98.39 98.32 9.56 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.876 -0.416 . . . . 63.409999999999997 109.876 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . 0.976 HG23 ' HB2' ' B' ' 150' ' ' ALA . 0.2 OUTLIER -84.06 102.78 12.76 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.268 -0.424 . . . . 71.530000000000001 110.997 179.83 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -99.6 114.59 27.72 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.348 -0.387 . . . . 71.409999999999997 110.85 178.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . 0.59 ' HA ' ' HB3' ' B' ' 148' ' ' LYS . 5.3 p -76.69 -33.46 58.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.976 -0.557 . . . . 64.310000000000002 110.167 176.098 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -116.37 149.5 39.25 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.604 -0.726 . . . . 72.409999999999997 109.684 176.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -90.19 -9.21 48.96 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.13 0.49 . . . . 74.400000000000006 110.327 -178.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -63.93 -49.6 71.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.629 -0.714 . . . . 75.310000000000002 110.183 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 10.7 m -66.43 -36.1 81.96 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.88 -0.6 . . . . 72.010000000000005 110.753 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 3.9 tt -60.29 -43.36 96.34 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.069 0.461 . . . . 61.340000000000003 110.131 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 15.9 ttp180 -60.83 -23.38 65.05 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.373 -0.83 . . . . 64.420000000000002 110.899 -175.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -88.32 -43.24 11.68 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.184 0.516 . . . . 62.520000000000003 110.207 176.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 169' ' ' PHE . . . . . 0.43 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 59.1 t80 -62.81 -39.3 93.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.39 -0.823 . . . . 75.420000000000002 111.051 -178.032 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -67.1 -29.09 68.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.059 -0.519 . . . . 53.409999999999997 111.532 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 22.9 t -75.6 -32.61 60.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.758 0.314 . . . . 73.299999999999997 111.112 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -82.79 -16.09 49.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.907 0.385 . . . . 71.510000000000005 110.651 179.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 173' ' ' LYS . . . . . 0.409 ' HA ' ' HD2' ' B' ' 173' ' ' LYS . 25.7 mmmt -81.31 117.92 22.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.225 -0.443 . . . . 74.439999999999998 110.281 174.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.1 p -54.16 -44.84 71.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.129 -0.487 . . . . 73.319999999999993 111.89 -178.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 4.5 p -71.45 -50.73 28.82 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.957 -0.565 . . . . 74.439999999999998 111.658 -178.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 82.3 mtp -73.61 -16.77 61.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.321 -0.4 . . . . 51.399999999999999 112.077 -172.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . 0.441 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 47.4 tttp -62.8 -26.11 68.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.307 -0.406 . . . . 73.409999999999997 110.91 -178.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . 0.402 ' HA ' ' HD3' ' B' ' 181' ' ' LYS . 5.1 mm-40 -94.33 -8.19 39.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.434 0.635 . . . . 72.239999999999995 109.917 -176.295 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 179' ' ' LEU . . . . . 0.486 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 11.2 mp -87.64 -54.88 4.04 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.029 -0.987 . . . . 74.040000000000006 109.844 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -81.03 -14.25 58.06 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.207 -0.906 . . . . 73.040000000000006 112.19 -173.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 181' ' ' LYS . . . . . 0.446 ' HA ' ' O ' ' B' ' 184' ' ' LEU . 64.9 pttt -57.46 -19.2 22.63 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.347 0.499 . . . . 71.109999999999999 112.347 -176.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -58.51 -36.39 73.73 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.061 0.458 . . . . 65.109999999999999 110.783 177.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 183' ' ' VAL . . . . . 0.555 HG21 HD22 ' A' ' 29' ' ' ASN . 26.9 m -119.32 11.77 6.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.223 0.535 . . . . 74.049999999999997 110.367 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 184' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' B' ' 181' ' ' LYS . 55.6 tp -143.04 86.8 9.04 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.736 -0.666 . . . . 73.099999999999994 110.534 -175.171 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 185' ' ' PRO . . . . . 0.725 ' HB2' ' HB3' ' B' ' 188' ' ' GLU . 16.6 Cg_exo -69.08 150.41 72.31 Favored 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 122.903 2.402 . . . . 71.030000000000001 111.485 178.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 70.6 mm-40 -82.57 107.71 15.42 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.874 0.368 . . . . 72.0 111.443 -172.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? 53.73 40.72 31.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.259 -0.882 . . . . 75.349999999999994 112.047 178.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 188' ' ' GLU . . . . . 0.725 ' HB3' ' HB2' ' B' ' 185' ' ' PRO . 35.4 tt0 . . . . . 0 C--O 1.251 1.155 0 CA-C-N 114.66 -1.155 . . . . 72.140000000000001 109.039 177.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.689 0 N-CA-C 112.24 -0.344 . . . . 32.119999999999997 112.24 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 28.3 m -128.5 173.59 13.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.781 0.324 . . . . 65.319999999999993 110.349 178.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 93.4 mt -84.67 131.18 34.62 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.257 -0.429 . . . . 74.409999999999997 110.305 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.1 mmt -95.94 -7.75 35.72 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.301 0.572 . . . . 72.129999999999995 109.664 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -74.0 103.48 4.5 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.682 -0.69 . . . . 54.439999999999998 109.174 176.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -95.86 145.62 25.22 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.998 -0.547 . . . . 45.450000000000003 110.359 -175.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.62 -145.74 6.38 Favored Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.694 -0.765 . . . . 44.32 111.472 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -138.88 134.69 33.61 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 120.618 0.246 . . . . 75.239999999999995 110.445 178.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.2 p -116.93 134.27 61.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.359 -0.382 . . . . 63.219999999999999 110.335 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.8 mp -93.24 89.39 6.39 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.053 0.454 . . . . 64.219999999999999 109.972 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 60.9 m -73.01 113.64 10.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.785 -0.643 . . . . 71.010000000000005 111.033 -178.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.464 HD13 ' N ' ' A' ' 13' ' ' ALA . 1.4 tm? -99.93 134.51 42.74 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.243 -1.021 . . . . 65.019999999999996 108.243 177.046 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.855 ' HB3' ' HA ' ' A' ' 17' ' ' SER . . . -50.27 114.33 1.09 Allowed 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 112.449 0.537 . . . . 73.109999999999999 112.449 -178.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.451 ' O ' ' HB2' ' A' ' 15' ' ' ASP . . . -81.23 104.01 11.4 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.843 -0.617 . . . . 50.549999999999997 110.179 175.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 6.6 m-20 85.02 -14.28 0.61 Allowed 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 114.906 -1.043 . . . . 54.200000000000003 111.489 171.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.9 mp -119.13 37.24 4.19 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.851 -0.796 . . . . 72.25 108.851 176.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.855 ' HA ' ' HB3' ' A' ' 13' ' ' ALA . 19.5 m -48.35 98.77 0.02 OUTLIER 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.031 -0.986 . . . . 72.239999999999995 112.298 -172.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 17.9 m -70.84 78.79 0.62 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.603 -1.181 . . . . 64.450000000000003 111.289 177.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -167.17 103.13 0.53 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.64 -0.709 . . . . 54.009999999999998 109.975 175.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.6 m -132.74 147.67 52.32 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.017 -0.538 . . . . 74.329999999999998 109.976 -178.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 85.7 mt -81.39 -173.29 4.28 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.095 0.474 . . . . 54.509999999999998 111.367 -179.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.632 ' HA ' ' O ' ' B' ' 126' ' ' GLN . 8.6 p-10 -77.43 120.59 22.63 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.661 -0.7 . . . . 63.229999999999997 110.586 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.52 HG12 ' H ' ' A' ' 24' ' ' SER . 14.4 tt -162.49 172.04 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.993 -0.549 . . . . 75.340000000000003 109.865 -175.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.52 ' H ' HG12 ' A' ' 23' ' ' ILE . 1.9 m -56.82 144.54 32.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.207 0.527 . . . . 70.030000000000001 111.298 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.963 ' HD3' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -104.87 69.98 0.9 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.753 0.787 . . . . 64.340000000000003 110.88 -174.342 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.616 ' O ' ' HA ' ' B' ' 122' ' ' ASP . 1.8 mp0 -107.5 149.85 27.49 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.812 -0.631 . . . . 73.310000000000002 111.299 -178.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 51.4 m95 -139.69 125.62 19.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.666 -0.697 . . . . 63.340000000000003 109.412 174.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.603 ' H ' ' HB3' ' B' ' 122' ' ' ASP . 8.5 p -70.04 -32.76 71.06 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.266 0.555 . . . . 74.439999999999998 110.631 178.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -116.9 127.29 54.11 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.574 -0.739 . . . . 61.100000000000001 110.127 177.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.489 ' C ' ' H ' ' A' ' 32' ' ' ASN . 19.4 m -110.66 -156.31 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.846 -0.615 . . . . 72.400000000000006 109.771 176.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.406 ' HB3' HD11 ' B' ' 149' ' ' LEU . 22.1 p90 -73.03 31.18 0.07 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.991 0.424 . . . . 74.049999999999997 111.185 176.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.525 ' O ' ' HB3' ' A' ' 35' ' ' ARG . 48.6 t30 -60.17 -51.13 70.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.703 -0.68 . . . . 70.549999999999997 111.368 -174.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.502 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 48.5 mm -58.78 -47.54 88.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.167 -0.469 . . . . 72.109999999999999 111.469 -177.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.1 mt -60.3 -35.45 75.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.007 0.432 . . . . 63.329999999999998 110.746 177.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.525 ' HB3' ' O ' ' A' ' 32' ' ' ASN . 23.4 ttt-85 -62.38 -49.94 73.53 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.637 -0.711 . . . . 73.340000000000003 110.374 176.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 15.9 mm-40 -66.67 -31.95 72.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.672 -0.695 . . . . 65.340000000000003 111.898 -176.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -98.04 3.62 49.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.771 0.319 . . . . 73.219999999999999 111.159 -177.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 38.2 t70 57.73 62.06 2.22 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.592 0.711 . . . . 73.109999999999999 111.929 175.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.417 ' HB3' ' HB2' ' B' ' 151' ' ' PHE . 23.4 m-85 -89.3 -3.33 58.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.816 -0.629 . . . . 75.510000000000005 110.534 170.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 61.06 67.28 1.47 Allowed Pre-proline 0 CA--C 1.534 0.333 0 CA-C-N 115.624 -0.716 . . . . 75.019999999999996 110.029 -173.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -80.65 168.88 17.4 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.535 2.157 . . . . 65.420000000000002 111.583 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.508 ' HE2' ' HB3' ' B' ' 150' ' ' ALA . 10.7 mptt -90.97 168.84 11.37 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.431 -0.508 . . . . 74.239999999999995 110.866 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.4 ' HD2' ' O ' ' A' ' 44' ' ' LEU . 15.9 p90 -101.21 -166.91 1.36 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.817 -0.629 . . . . 75.120000000000005 111.883 -164.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.4 ' O ' ' HD2' ' A' ' 43' ' ' PHE . 2.5 mm? -80.83 141.75 34.37 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.419 -0.586 . . . . 71.129999999999995 109.419 177.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.601 ' SG ' HG23 ' A' ' 47' ' ' VAL . 6.6 t -82.77 141.34 32.43 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.113 0.482 . . . . 74.239999999999995 111.153 -170.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -86.13 47.07 1.4 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.724 -0.671 . . . . 75.519999999999996 110.404 177.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.601 HG23 ' SG ' ' A' ' 45' ' ' CYS . 45.8 t -78.09 106.5 8.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.109 0.48 . . . . 71.140000000000001 109.875 176.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.37 141.93 16.55 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.357 -0.838 . . . . 73.129999999999995 110.073 178.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.668 ' HB3' ' HD1' ' A' ' 51' ' ' PHE . 10.6 mp -76.09 88.51 3.01 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.719 -0.673 . . . . 71.420000000000002 109.868 178.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.08 59.71 4.59 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.156 0.503 . . . . 65.099999999999994 109.683 175.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.668 ' HD1' ' HB3' ' A' ' 49' ' ' LEU . 52.5 p90 -90.5 166.96 12.94 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.993 -0.548 . . . . 64.329999999999998 110.203 -175.364 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -100.41 123.31 44.47 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 120.981 0.419 . . . . 73.439999999999998 110.697 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.645 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 52.9 t -125.77 112.32 15.92 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.726 -0.67 . . . . 71.140000000000001 109.577 176.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 68.04 21.27 8.84 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.862 -0.608 . . . . 72.219999999999999 111.39 177.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 107.8 -32.75 6.82 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.75 -0.738 . . . . 63.420000000000002 112.433 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.4 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 10.6 pt-20 -98.37 143.87 28.37 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.073 0.463 . . . . 64.120000000000005 110.8 -176.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.2 mm -74.5 118.32 20.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.027 -0.533 . . . . 74.310000000000002 110.289 178.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.412 ' HG2' ' HB3' ' A' ' 53' ' ' CYS . 29.9 mmmt -106.17 107.72 18.87 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.198 -0.667 . . . . 71.400000000000006 109.198 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.535 ' HA ' ' O ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -98.51 112.92 24.8 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.061 -0.518 . . . . 74.329999999999998 111.919 -171.178 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -128.56 139.18 52.43 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.246 -0.433 . . . . 73.340000000000003 110.2 177.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 65.4 p -104.21 -16.69 15.13 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.121 0.486 . . . . 62.210000000000001 110.1 176.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -127.16 150.14 49.64 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.813 -0.63 . . . . 71.219999999999999 111.237 -176.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.0 mt -67.92 -23.39 65.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.712 -0.677 . . . . 75.430000000000007 110.477 177.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -60.63 -48.8 80.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.093 0.473 . . . . 74.540000000000006 110.55 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 9.9 m -68.11 -41.92 81.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.892 -0.594 . . . . 61.130000000000003 110.705 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.4 tp -65.28 -36.11 83.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.941 -0.572 . . . . 74.150000000000006 110.648 -178.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.745 ' HG2' HD11 ' A' ' 84' ' ' LEU . 62.8 mtt180 -53.77 -49.51 68.08 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.222 -0.445 . . . . 73.150000000000006 111.806 178.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 40.7 mtmt -73.06 -28.9 62.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.994 -0.548 . . . . 54.420000000000002 111.353 -173.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.504 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 81.5 t80 -79.21 -43.48 23.77 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.869 0.366 . . . . 72.530000000000001 110.658 178.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.18 -32.28 73.89 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.416 -0.356 . . . . 72.340000000000003 111.61 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.0 p -75.88 -15.5 60.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.555 -0.293 . . . . 70.129999999999995 111.624 -178.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 19.4 pt20 -102.1 -2.12 30.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.183 0.516 . . . . 75.319999999999993 110.106 176.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.645 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 30.2 mmmt -98.49 120.01 38.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.842 -0.617 . . . . 74.450000000000003 110.36 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.2 p -58.85 -40.52 84.53 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.349 -0.387 . . . . 50.009999999999998 111.299 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.0 m -77.43 -31.89 54.23 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.033 -0.53 . . . . 52.350000000000001 111.74 -177.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.452 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 80.0 mtp -94.42 -10.93 30.92 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.862 0.319 . . . . 72.450000000000003 111.862 -174.344 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -59.28 -37.31 77.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.048 0.451 . . . . 72.549999999999997 111.421 -176.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.461 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 61.9 mm-40 -96.69 5.07 51.4 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.3 0.571 . . . . 61.439999999999998 110.548 -175.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.554 ' HB3' HG21 ' B' ' 133' ' ' ILE . 53.6 mt -95.63 -52.29 4.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.172 -0.922 . . . . 74.430000000000007 109.687 177.133 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.416 ' HB3' HD13 ' A' ' 84' ' ' LEU . 4.2 mm? -85.7 -4.81 59.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.529 -0.76 . . . . 71.030000000000001 111.808 -176.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.461 ' HD2' ' HA ' ' A' ' 78' ' ' GLU . 18.4 ptmt -54.68 -18.09 4.17 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.854 0.359 . . . . 74.400000000000006 111.63 177.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -69.12 -44.28 72.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.393 -0.367 . . . . 64.450000000000003 111.386 179.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.603 HG23 HD12 ' A' ' 84' ' ' LEU . 16.1 m -100.46 5.28 10.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-O 120.878 0.37 . . . . 65.109999999999999 111.865 -176.02 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.745 HD11 ' HG2' ' A' ' 67' ' ' ARG . 8.2 mp -117.5 155.23 50.49 Favored Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 108.895 -0.78 . . . . 64.0 108.895 172.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -76.83 67.86 7.32 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.099 1.866 . . . . 55.509999999999998 111.207 176.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.59 HE21 HD22 ' A' ' 84' ' ' LEU . 68.9 mt-30 -114.23 88.83 2.94 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.766 -0.652 . . . . 71.420000000000002 111.479 -177.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -110.49 -47.33 3.29 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.602 -0.888 . . . . 60.219999999999999 108.602 172.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 . . . . . 0 C--N 1.325 -0.484 0 CA-C-N 115.158 -0.928 . . . . 51.420000000000002 110.406 177.493 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.409 0 N-CA-C 112.473 -0.251 . . . . 75.25 112.473 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 34.7 m -83.39 158.06 3.73 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 CA-C-O 120.626 0.251 . . . . 63.340000000000003 110.632 179.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 89.9 mt -114.18 135.69 53.77 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.251 -0.431 . . . . 74.010000000000005 110.461 -178.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 24.6 mmt -95.32 45.45 1.1 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.092 -0.503 . . . . 64.230000000000004 110.902 -177.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -109.82 119.8 40.48 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.097 -0.501 . . . . 60.0 110.474 176.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -138.1 110.22 7.31 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.655 -0.702 . . . . 73.549999999999997 109.577 177.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -134.85 -119.9 1.99 Allowed Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.571 -0.823 . . . . 44.539999999999999 112.162 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -146.3 88.86 1.82 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.702 0.287 . . . . 55.240000000000002 110.664 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 7.1 p -69.72 127.13 31.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.145 -0.479 . . . . 64.439999999999998 109.892 177.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 84.2 mt -76.21 125.95 30.09 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.142 -0.481 . . . . 44.439999999999998 111.393 -172.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 24.2 m -88.01 110.48 20.63 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.048 -0.524 . . . . 73.140000000000001 110.033 177.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . 0.403 ' HA ' HD22 ' B' ' 112' ' ' LEU . 0.6 OUTLIER -140.4 123.02 16.23 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.11 -0.7 . . . . 64.219999999999999 109.11 -178.357 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.59 147.37 49.38 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.234 -0.439 . . . . 41.219999999999999 111.922 -174.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.36 -60.74 2.08 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.946 -0.57 . . . . 41.310000000000002 110.941 177.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -107.9 -19.13 13.62 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.815 0.34 . . . . 72.120000000000005 111.516 -178.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -98.72 41.6 1.13 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.129 -0.693 . . . . 75.329999999999998 109.129 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 2.8 m -77.39 67.29 3.3 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.308 -0.86 . . . . 72.409999999999997 109.975 -172.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 18.5 m -37.6 110.72 0.13 Allowed 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 113.461 -1.7 . . . . 61.520000000000003 112.594 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -158.89 111.56 2.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.27 -0.877 . . . . 74.120000000000005 109.475 176.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 28.5 m -154.7 139.88 17.52 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.817 0.341 . . . . 73.439999999999998 110.91 -175.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . 0.404 ' HB3' ' H ' ' B' ' 122' ' ' ASP . 4.1 mm? -99.34 -158.42 0.67 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.974 -0.557 . . . . 74.319999999999993 110.854 177.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 122' ' ' ASP . . . . . 0.616 ' HA ' ' O ' ' A' ' 26' ' ' GLN . 9.8 p-10 -61.41 131.75 51.25 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.95 -0.568 . . . . 75.340000000000003 111.634 -175.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . 0.6 HG12 ' H ' ' B' ' 124' ' ' SER . 14.9 tt -172.78 176.19 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 115.852 -0.613 . . . . 61.240000000000002 109.863 -179.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.6 ' H ' HG12 ' B' ' 123' ' ' ILE . 14.7 m -67.49 169.0 9.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.388 0.613 . . . . 63.100000000000001 111.122 178.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . 0.754 ' HD3' ' H ' ' B' ' 125' ' ' LYS . 0.0 OUTLIER -125.97 80.27 1.9 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.826 0.822 . . . . 74.209999999999994 110.801 -174.053 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 126' ' ' GLN . . . . . 0.632 ' O ' ' HA ' ' A' ' 22' ' ' ASP . 1.9 mp0 -115.8 129.16 56.33 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.93 -0.577 . . . . 72.219999999999999 111.302 -178.573 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 78.9 m95 -140.78 120.98 13.84 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 108.754 -0.832 . . . . 75.219999999999999 108.754 173.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 19.3 m -68.61 -39.85 80.65 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.897 -0.592 . . . . 73.409999999999997 111.933 -173.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -114.84 111.7 21.63 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.888 -0.325 . . . . 71.129999999999995 111.518 -175.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.582 HG12 ' HD2' ' B' ' 131' ' ' PHE . 41.8 t -131.61 120.89 46.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.042 -0.527 . . . . 74.319999999999993 109.663 175.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 131' ' ' PHE . . . . . 0.582 ' HD2' HG12 ' B' ' 130' ' ' VAL . 20.0 p90 51.21 12.04 0.12 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.898 1.279 . . . . 72.140000000000001 113.881 177.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.499 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 52.0 t30 -55.12 -58.04 9.3 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.746 0.308 . . . . 65.299999999999997 111.632 -173.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 133' ' ' ILE . . . . . 0.554 HG21 ' HB3' ' A' ' 79' ' ' LEU . 49.5 mm -57.36 -42.54 80.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.183 0.516 . . . . 74.519999999999996 111.108 -178.128 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.556 HD12 HD23 ' A' ' 49' ' ' LEU . 86.2 mt -67.63 -26.52 66.28 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.052 -0.522 . . . . 52.100000000000001 111.35 -177.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 46.1 ttt180 -71.73 -46.44 58.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.998 0.428 . . . . 75.430000000000007 109.942 175.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 136' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 16.8 mm-40 -63.05 -27.08 69.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.51 -0.768 . . . . 75.450000000000003 111.358 -177.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -106.17 3.36 27.84 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.411 -0.359 . . . . 70.0 111.305 -177.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 32.9 t70 55.37 65.61 1.44 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.562 0.696 . . . . 55.039999999999999 111.887 177.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -94.03 6.3 48.97 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.827 -0.624 . . . . 71.209999999999994 111.025 172.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 58.44 66.26 2.67 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 116.004 -0.544 . . . . 65.409999999999997 110.485 -175.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.407 ' C ' ' HD2' ' B' ' 142' ' ' LYS . 85.7 Cg_endo -86.76 156.82 8.89 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.772 2.314 . . . . 74.209999999999994 112.691 -176.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 142' ' ' LYS . . . . . 0.407 ' HD2' ' C ' ' B' ' 141' ' ' PRO . 12.7 mptt -120.14 140.95 50.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.942 0.401 . . . . 62.32 110.95 -179.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 93.0 t80 -178.46 103.48 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.081 -0.963 . . . . 60.210000000000001 109.078 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . 0.479 ' HG ' ' HG2' ' B' ' 146' ' ' GLU . 50.4 tp -156.52 104.14 2.17 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.849 -0.426 . . . . 61.310000000000002 109.849 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 145' ' ' CYS . . . . . 0.468 ' HA ' ' SG ' ' A' ' 45' ' ' CYS . 26.5 t -80.41 87.16 5.66 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.322 0.582 . . . . 45.32 110.162 -179.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . 0.479 ' HG2' ' HG ' ' B' ' 144' ' ' LEU . 5.3 mm-40 -85.07 -4.57 59.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.421 -0.809 . . . . 75.400000000000006 110.454 177.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 22.9 t -87.63 119.03 34.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-O 121.921 0.867 . . . . 55.25 111.548 -178.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . 0.515 ' HD3' HG22 ' B' ' 159' ' ' THR . 0.1 OUTLIER -152.76 147.16 25.75 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 113.776 -1.556 . . . . 64.430000000000007 107.304 172.619 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.581 ' O ' ' HA ' ' B' ' 159' ' ' THR . 2.6 mm? -65.23 93.95 0.14 Allowed 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.49 -0.484 . . . . 75.120000000000005 110.719 -175.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.546 ' HA ' ' O ' ' B' ' 158' ' ' LYS . . . -103.27 75.92 1.39 Allowed 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.014 -0.994 . . . . 73.340000000000003 108.75 176.112 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 151' ' ' PHE . . . . . 0.55 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 46.2 p90 -110.64 164.5 12.67 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.274 -0.876 . . . . 74.439999999999998 110.575 -173.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -101.73 116.26 32.34 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.049 0.452 . . . . 73.340000000000003 111.011 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 153' ' ' CYS . . . . . 0.668 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 49.2 t -112.32 107.7 16.63 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.84 -0.618 . . . . 64.540000000000006 109.66 178.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 66.92 6.72 4.83 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 116.093 -0.503 . . . . 73.329999999999998 111.883 176.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 126.56 -29.98 4.35 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.724 -0.75 . . . . 51.25 112.442 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 156' ' ' GLU . . . . . 0.592 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 14.1 pt-20 -91.89 140.37 29.74 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 122.682 -0.304 . . . . 63.030000000000001 110.262 -178.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 44.9 mm -83.38 123.83 39.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.879 0.371 . . . . 63.439999999999998 110.103 177.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 158' ' ' LYS . . . . . 0.592 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 27.0 mmmt -106.35 148.06 28.5 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.149 -0.686 . . . . 61.310000000000002 109.149 179.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . 0.581 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.0 OUTLIER -130.46 124.87 33.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.049 0.452 . . . . 71.530000000000001 111.584 178.449 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 160' ' ' PHE . . . . . 0.412 ' CD2' HD13 ' B' ' 166' ' ' LEU . 90.1 m-85 -132.68 126.84 33.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.587 -0.733 . . . . 74.340000000000003 110.405 176.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.7 -23.1 62.41 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.976 -0.557 . . . . 71.409999999999997 111.495 -179.09 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -150.97 177.25 10.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.851 0.358 . . . . 53.450000000000003 110.471 175.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 76.3 mt -86.65 -7.56 58.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.881 -0.6 . . . . 65.310000000000002 111.736 -175.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 164' ' ' GLN . . . . . 0.501 ' OE1' ' HD3' ' B' ' 167' ' ' ARG . 5.7 tp-100 -78.59 -40.11 35.53 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.991 -0.744 . . . . 75.319999999999993 108.991 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 22.5 t -67.79 -39.24 84.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.435 -0.802 . . . . 73.120000000000005 110.014 175.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . 0.412 HD13 ' CD2' ' B' ' 160' ' ' PHE . 53.0 tp -68.06 -29.87 68.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.875 -0.602 . . . . 75.140000000000001 110.476 177.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . 0.501 ' HD3' ' OE1' ' B' ' 164' ' ' GLN . 58.5 ttt180 -60.46 -28.05 68.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.992 -0.549 . . . . 74.129999999999995 110.908 178.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -79.89 -26.37 40.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.142 -0.481 . . . . 60.119999999999997 111.175 177.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -88.3 -42.37 12.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.159 -0.473 . . . . 61.439999999999998 110.834 -176.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.64 -23.06 67.14 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.092 -0.504 . . . . 74.209999999999994 111.535 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 3.1 p -81.14 -26.28 36.24 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.409 -0.36 . . . . 44.340000000000003 111.826 -178.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -92.73 -14.63 27.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.041 0.448 . . . . 61.210000000000001 110.526 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 173' ' ' LYS . . . . . 0.668 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 29.4 mmmt -85.56 117.34 24.4 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.01 -0.541 . . . . 55.210000000000001 109.822 175.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 11.2 m -59.67 -35.97 75.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.883 0.373 . . . . 63.210000000000001 111.449 -175.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 7.0 p -76.51 -47.83 21.48 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.269 -0.423 . . . . 31.109999999999999 111.102 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.486 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 82.3 mtp -72.31 -18.79 61.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.828 0.347 . . . . 65.439999999999998 111.293 -176.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' B' ' 173' ' ' LYS . 84.0 tttt -58.75 -41.59 86.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.904 -0.589 . . . . 71.209999999999994 111.28 -177.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . 0.615 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 9.2 mm-40 -89.23 -6.76 56.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.601 0.715 . . . . 70.120000000000005 109.647 -174.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 179' ' ' LEU . . . . . 0.502 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 64.3 mt -82.77 -43.1 17.15 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.051 -0.977 . . . . 72.109999999999999 109.971 177.129 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 180' ' ' LEU . . . . . 0.649 ' HB3' HD13 ' B' ' 184' ' ' LEU . 4.3 mm? -95.89 -9.78 30.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.872 -0.604 . . . . 55.140000000000001 112.102 -174.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 181' ' ' LYS . . . . . 0.615 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 17.5 ptmt -56.5 -20.93 22.61 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.841 0.682 . . . . 30.039999999999999 112.841 -175.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -68.66 -40.16 80.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.989 0.423 . . . . 75.530000000000001 111.252 179.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 26.3 m -103.07 -15.58 7.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.081 -0.508 . . . . 75.019999999999996 111.537 -176.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 184' ' ' LEU . . . . . 0.649 HD13 ' HB3' ' B' ' 180' ' ' LEU . 9.9 mp -93.26 154.93 41.43 Favored Pre-proline 0 C--N 1.325 -0.457 0 N-CA-C 109.654 -0.498 . . . . 61.130000000000003 109.654 175.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -68.86 72.66 1.02 Allowed 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.7 2.267 . . . . 75.319999999999993 112.286 178.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -127.75 99.63 5.63 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.419 -0.809 . . . . 72.099999999999994 109.38 175.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 187' ' ' LYS . . . . . 0.523 ' NZ ' ' HB2' ' B' ' 187' ' ' LYS . 7.8 mtmp? -90.05 -4.29 57.46 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.856 -0.611 . . . . 74.510000000000005 110.275 -177.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 188' ' ' GLU . . . . . 0.498 ' OE1' ' HB2' ' B' ' 187' ' ' LYS . 1.9 mp0 . . . . . 0 C--O 1.248 1.006 0 CA-C-N 115.529 -0.759 . . . . 65.019999999999996 109.983 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.819 0 N-CA-C 111.65 -0.58 . . . . 65.019999999999996 111.65 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 31.2 m -86.6 -26.2 6.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.303 0.573 . . . . 71.349999999999994 109.65 177.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 85.6 mt -103.12 158.06 16.56 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.604 -0.725 . . . . 74.239999999999995 109.561 174.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -73.86 -9.72 58.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.195 0.522 . . . . 74.219999999999999 110.764 -178.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -124.36 129.08 50.06 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.683 -0.69 . . . . 53.140000000000001 109.726 177.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.485 ' H ' ' CD ' ' A' ' 6' ' ' GLU . 0.6 OUTLIER -96.85 9.74 40.97 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.147 -0.478 . . . . 72.329999999999998 111.257 -175.899 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -79.15 62.64 3.99 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.892 -0.67 . . . . 61.210000000000001 111.763 176.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -91.22 155.69 18.39 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.833 0.349 . . . . 51.140000000000001 110.908 -178.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.2 m -74.37 152.91 6.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.972 -0.558 . . . . 72.109999999999999 111.295 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.0 pp -101.27 157.89 16.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.934 -0.575 . . . . 74.310000000000002 110.505 177.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.8 t -79.17 161.78 26.21 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.186 -0.461 . . . . 72.120000000000005 110.602 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.419 HD13 ' N ' ' A' ' 13' ' ' ALA . 0.9 OUTLIER -145.9 125.76 13.54 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.754 -0.832 . . . . 71.150000000000006 108.754 179.136 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.965 ' HB3' ' HB3' ' A' ' 17' ' ' SER . . . -137.63 146.69 44.23 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.93 0.395 . . . . 73.519999999999996 110.887 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.65 -33.98 66.95 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.736 -0.665 . . . . 73.409999999999997 111.992 -175.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -82.1 53.13 2.15 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.261 0.467 . . . . 71.219999999999999 112.261 -175.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.1 mt 57.87 19.61 5.91 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 112.62 0.6 . . . . 74.420000000000002 112.62 173.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.965 ' HB3' ' HB3' ' A' ' 13' ' ' ALA . 38.4 t -84.0 -6.57 59.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.142 0.496 . . . . 71.319999999999993 110.503 -179.295 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.4 m -85.96 75.8 9.93 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.0 -0.545 . . . . 72.310000000000002 110.388 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -137.18 93.52 2.83 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.976 -0.557 . . . . 54.039999999999999 110.882 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.6 m -153.98 112.05 3.55 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.923 -0.58 . . . . 71.310000000000002 109.589 177.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.0 tt -140.33 124.07 17.24 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.025 -0.361 . . . . 71.329999999999998 110.025 -176.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -154.16 177.16 11.41 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.846 -0.798 . . . . 73.450000000000003 108.846 177.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.9 tt -75.63 159.9 5.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.91 -0.404 . . . . 62.520000000000003 109.91 -178.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.7 m -66.35 90.78 0.16 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.261 0.553 . . . . 75.409999999999997 110.247 176.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.789 ' HD3' ' H ' ' A' ' 25' ' ' LYS . 0.6 OUTLIER -82.16 24.32 0.66 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.598 -0.728 . . . . 74.230000000000004 111.432 -176.513 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -87.68 -178.16 6.02 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.959 -0.564 . . . . 43.140000000000001 110.504 -177.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 76.2 m95 -61.07 -22.81 64.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.998 -0.546 . . . . 74.430000000000007 112.386 -174.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.0 m 66.86 36.15 4.58 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 122.662 1.22 . . . . 73.329999999999998 107.954 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 -71.16 12.09 0.35 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 113.053 -1.885 . . . . 74.329999999999998 112.488 -171.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.417 HG21 HD12 ' B' ' 163' ' ' LEU . 27.7 m -78.59 -35.52 18.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.594 -0.276 . . . . 70.549999999999997 111.361 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.604 ' HB3' HD11 ' B' ' 149' ' ' LEU . 26.1 p90 -84.45 -12.13 54.9 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 120.723 -0.391 . . . . 70.150000000000006 110.806 -178.435 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.552 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 8.8 t30 -60.54 -46.1 91.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.063 -0.517 . . . . 70.310000000000002 110.156 178.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.518 HG21 ' HB3' ' B' ' 179' ' ' LEU . 45.2 mm -62.66 -35.98 73.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-O 121.22 0.534 . . . . 64.530000000000001 110.439 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 72.0 mt -64.36 -39.18 93.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.758 -0.655 . . . . 63.119999999999997 110.225 178.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 57.3 ttt85 -69.51 -40.95 76.66 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.099 -0.501 . . . . 73.25 110.858 178.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.552 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 5.5 mm-40 -64.48 -31.08 72.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.831 0.348 . . . . 72.109999999999999 111.406 -178.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -100.52 1.35 40.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.02 0.438 . . . . 43.439999999999998 110.824 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 58.79 58.15 3.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.128 -0.942 . . . . 63.130000000000003 112.259 177.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -84.18 -2.86 57.62 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.478 -0.783 . . . . 65.329999999999998 109.388 169.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 60.68 75.09 0.48 Allowed Pre-proline 0 C--O 1.234 0.252 0 CA-C-N 114.912 -1.04 . . . . 74.230000000000004 111.114 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -82.54 159.21 16.86 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.632 2.222 . . . . 74.439999999999998 111.214 176.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.748 ' HD3' ' HB3' ' B' ' 150' ' ' ALA . 3.6 mptp? -75.21 -168.38 0.77 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.418 0.525 . . . . 74.239999999999995 112.418 -177.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 16.7 p90 -99.15 86.06 3.36 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 113.409 0.892 . . . . 75.25 113.409 -161.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.3 mm? 63.79 121.83 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.742 -1.117 . . . . 62.509999999999998 113.115 168.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 12.6 p -78.8 -4.42 49.33 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.358 0.599 . . . . 70.409999999999997 110.476 176.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -102.47 88.43 3.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.706 -0.679 . . . . 75.040000000000006 109.302 178.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.494 HG22 ' CZ ' ' B' ' 143' ' ' PHE . 31.5 t -101.95 127.21 55.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.471 -0.786 . . . . 53.43 109.291 174.031 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.597 ' HD2' ' H ' ' A' ' 48' ' ' LYS . 1.7 mptp? -81.06 140.69 34.97 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.471 -0.937 . . . . 75.430000000000007 108.471 178.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.568 HD21 ' HB3' ' B' ' 131' ' ' PHE . 21.0 tp -92.92 23.27 4.3 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 109.52 -0.548 . . . . 73.120000000000005 109.52 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.673 ' HB3' ' HD3' ' B' ' 142' ' ' LYS . . . -34.3 103.7 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 O-C-N 124.553 1.158 . . . . 64.150000000000006 112.895 -173.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.743 ' HB3' ' HA ' ' B' ' 141' ' ' PRO . 46.8 p90 -132.09 172.04 12.87 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.086 -0.961 . . . . 61.229999999999997 109.969 -178.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -101.46 115.11 29.77 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.277 0.56 . . . . 72.239999999999995 110.871 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.523 ' O ' ' HG2' ' A' ' 56' ' ' GLU . 41.9 t -112.31 99.84 8.33 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.432 -0.804 . . . . 61.049999999999997 110.454 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.6 t70 64.61 15.34 9.63 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.449 0.642 . . . . 73.420000000000002 110.817 176.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.17 -35.41 3.11 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.788 -0.72 . . . . 65.319999999999993 112.801 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.771 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 13.4 pt-20 -88.72 133.31 34.26 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.712 0.292 . . . . 75.120000000000005 110.902 -176.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.401 ' HA ' ' O ' ' A' ' 51' ' ' PHE . 47.9 mm -80.91 120.37 32.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 109.24 -0.652 . . . . 74.530000000000001 109.24 176.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.771 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 28.9 mmmt -111.2 112.27 23.93 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.932 0.396 . . . . 75.200000000000003 111.509 -173.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.468 HG22 ' HB2' ' A' ' 50' ' ' ALA . 1.0 OUTLIER -88.88 104.09 16.61 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.964 -0.562 . . . . 63.299999999999997 110.488 172.818 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.503 ' CD2' HD13 ' A' ' 66' ' ' LEU . 21.4 m-85 -120.32 142.74 48.84 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.054 -0.521 . . . . 75.230000000000004 110.953 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 32.9 p -137.05 -14.26 1.57 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.149 -0.932 . . . . 60.25 109.667 173.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.46 ' HB2' ' OG ' ' A' ' 65' ' ' SER . 9.3 m-20 -98.97 157.71 16.14 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.651 -0.704 . . . . 71.420000000000002 109.265 177.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.5 mp -92.72 -39.5 11.22 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.919 -0.4 . . . . 73.030000000000001 109.919 177.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -55.03 -43.83 74.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.895 -0.593 . . . . 74.299999999999997 111.408 178.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.46 ' OG ' ' HB2' ' A' ' 62' ' ' ASP . 16.9 p -65.42 -52.01 56.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.849 0.357 . . . . 63.109999999999999 110.891 -179.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.503 HD13 ' CD2' ' A' ' 60' ' ' PHE . 63.1 tp -63.47 -34.14 77.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.04 -0.527 . . . . 60.340000000000003 110.705 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.456 ' HG3' HD21 ' A' ' 84' ' ' LEU . 20.3 ttt180 -60.81 -40.16 91.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.786 -0.643 . . . . 74.439999999999998 110.297 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.405 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 46.1 mtmt -71.97 -45.11 62.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.99 -0.55 . . . . 74.219999999999999 110.737 174.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -58.89 -49.76 76.57 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.795 -0.639 . . . . 75.450000000000003 110.949 -175.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.404 ' CB ' HD12 ' A' ' 80' ' ' LEU . . . -57.57 -38.18 74.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.876 0.37 . . . . 63.520000000000003 111.501 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 42.9 m -70.77 -30.52 67.03 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.27 -0.423 . . . . 72.450000000000003 111.462 -177.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 13.1 pt20 -97.12 12.14 33.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.209 0.528 . . . . 74.219999999999999 110.662 178.214 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.445 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 26.2 mmmt -119.07 114.84 23.12 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.83 -0.623 . . . . 72.329999999999998 110.086 175.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.5 m -58.59 -33.42 69.96 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.247 0.546 . . . . 73.430000000000007 110.545 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 12.1 m -78.54 -23.64 46.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.884 -0.598 . . . . 73.329999999999998 111.974 -176.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.447 ' HG3' ' SG ' ' A' ' 53' ' ' CYS . 46.6 mtp -104.94 -18.28 14.24 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.792 0.664 . . . . 61.100000000000001 112.792 -176.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.559 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 81.8 tttt -72.92 -17.37 61.5 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.264 0.554 . . . . 73.329999999999998 110.208 -176.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.572 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 56.5 mm-40 -102.66 4.11 37.86 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.512 -0.767 . . . . 65.329999999999998 109.665 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.597 ' HB3' HG21 ' B' ' 133' ' ' ILE . 71.8 mt -100.61 -44.48 5.83 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.15 -0.932 . . . . 72.019999999999996 109.657 175.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.404 HD12 ' CB ' ' A' ' 70' ' ' ALA . 7.9 mt -97.09 0.02 47.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.862 -0.608 . . . . 74.010000000000005 110.691 -175.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.572 ' HD3' ' HA ' ' A' ' 78' ' ' GLU . 64.4 pttt -56.61 -22.69 35.69 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.195 -0.457 . . . . 74.120000000000005 111.781 178.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -75.73 -56.58 4.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.914 0.387 . . . . 73.450000000000003 110.879 178.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 29.8 m -80.64 -20.47 11.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.076 -0.511 . . . . 73.030000000000001 112.184 -172.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.456 HD21 ' HG3' ' A' ' 67' ' ' ARG . 10.7 mp -101.23 132.97 21.25 Favored Pre-proline 0 C--N 1.326 -0.449 0 N-CA-C 109.222 -0.658 . . . . 62.240000000000002 109.222 172.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 84' ' ' LEU . 32.2 Cg_exo -58.19 98.97 0.09 OUTLIER 'Trans proline' 0 C--O 1.236 0.378 0 C-N-CA 122.738 2.292 . . . . 61.0 112.515 -178.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -144.04 146.76 33.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.796 -0.638 . . . . 65.340000000000003 110.118 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -102.3 -23.48 13.98 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.339 -0.615 . . . . 74.099999999999994 109.339 173.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 115.336 -0.847 . . . . 75.129999999999995 110.564 -179.96 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.407 0 N-CA-C 112.182 -0.367 . . . . 61.420000000000002 112.182 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 22.5 m -105.21 -30.01 2.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 120.898 0.38 . . . . 51.119999999999997 111.121 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 93.9 mt -85.76 142.75 28.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.363 -0.38 . . . . 64.230000000000004 110.784 -178.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -78.46 -41.82 31.63 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.059 -0.719 . . . . 63.329999999999998 109.059 177.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -116.55 130.97 57.05 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.074 -0.966 . . . . 73.430000000000007 108.733 176.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -86.77 36.48 0.71 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.021 0.439 . . . . 74.310000000000002 111.499 -172.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -71.99 70.54 0.98 Allowed Glycine 0 CA--C 1.518 0.243 0 CA-C-N 116.056 -0.52 . . . . 73.519999999999996 112.492 177.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -130.45 -164.3 1.41 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.673 -0.491 . . . . 71.519999999999996 109.673 178.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 9.0 p -124.93 138.74 53.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 120.806 0.336 . . . . 72.030000000000001 110.558 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 6.8 mp -95.66 167.35 11.34 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.337 -0.392 . . . . 63.409999999999997 110.298 -179.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 9.1 t -72.91 161.94 30.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.23 -0.441 . . . . 61.340000000000003 110.4 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 57.7 tp -136.8 130.47 31.92 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.012 0.434 . . . . 61.329999999999998 110.588 -178.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 113' ' ' ALA . . . . . 0.52 ' HB3' ' HB2' ' B' ' 117' ' ' SER . . . -152.13 168.54 24.96 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.971 -0.558 . . . . 72.239999999999995 110.205 178.443 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -98.78 -49.36 4.6 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.185 -0.461 . . . . 62.350000000000001 111.546 -176.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -63.3 -64.33 0.94 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.604 -0.725 . . . . 44.049999999999997 111.239 -171.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -159.93 90.26 0.91 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.631 -0.713 . . . . 64.439999999999998 112.016 -173.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.52 ' HB2' ' HB3' ' B' ' 113' ' ' ALA . 64.1 m -154.82 -40.76 0.09 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.705 -0.679 . . . . 53.329999999999998 109.804 176.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 8.5 m -58.76 111.4 1.26 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.727 -0.669 . . . . 74.439999999999998 110.005 174.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -98.95 166.47 11.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.114 -0.494 . . . . 43.539999999999999 111.266 -176.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 9.8 m -73.86 131.1 41.15 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.631 -0.713 . . . . 75.129999999999995 110.176 177.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -76.96 174.45 10.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.842 0.353 . . . . 71.299999999999997 110.882 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 122' ' ' ASP . . . . . 0.489 ' OD1' HG22 ' B' ' 123' ' ' ILE . 4.5 t70 -155.85 -160.72 1.05 Allowed 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.772 -0.825 . . . . 73.409999999999997 108.772 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . 0.489 HG22 ' OD1' ' B' ' 122' ' ' ASP . 11.0 tt -68.03 132.06 32.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.334 0.588 . . . . 63.109999999999999 111.563 -177.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.402 ' HB2' ' NE2' ' B' ' 126' ' ' GLN . 34.2 p -76.25 132.69 40.03 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.923 -0.58 . . . . 70.329999999999998 110.385 176.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . 0.763 ' HD3' ' H ' ' B' ' 125' ' ' LYS . 0.0 OUTLIER -108.64 77.19 1.07 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.813 0.816 . . . . 73.150000000000006 111.456 -174.195 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 126' ' ' GLN . . . . . 0.402 ' NE2' ' HB2' ' B' ' 124' ' ' SER . 2.3 mp0 -97.73 151.62 19.96 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.749 -0.66 . . . . 70.109999999999999 110.031 179.497 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 31.3 m95 -86.97 42.24 1.01 Allowed 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.633 0.605 . . . . 74.319999999999993 112.633 -169.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 49.4 m 74.62 15.2 3.34 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.813 0.816 . . . . 74.25 110.045 169.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 22.4 p-10 -65.09 -29.9 70.8 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.111 -1.404 . . . . 74.549999999999997 111.809 -176.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 48.6 t -64.71 -55.38 21.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.429 -0.35 . . . . 41.219999999999999 111.645 -178.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 131' ' ' PHE . . . . . 0.568 ' HB3' HD21 ' A' ' 49' ' ' LEU . 33.5 p90 -91.95 4.07 53.8 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.909 -0.316 . . . . 74.140000000000001 111.841 -175.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -63.77 -37.42 87.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.277 0.56 . . . . 71.209999999999994 109.979 175.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 133' ' ' ILE . . . . . 0.597 HG21 ' HB3' ' A' ' 79' ' ' LEU . 22.7 mm -64.33 -34.06 66.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.266 -0.879 . . . . 74.409999999999997 110.751 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 77.1 mt -66.92 -34.9 78.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.789 -0.641 . . . . 73.420000000000002 111.228 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -71.85 -41.27 68.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.909 0.385 . . . . 62.43 110.343 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -59.92 -46.77 88.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.954 -0.566 . . . . 73.319999999999993 111.172 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -92.53 3.18 56.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.139 -0.482 . . . . 74.409999999999997 111.349 -176.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 53.42 71.14 0.52 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.906 0.706 . . . . 63.130000000000003 112.906 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -89.65 -6.21 56.38 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.798 -0.637 . . . . 74.420000000000002 110.331 171.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 58.68 74.96 0.56 Allowed Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 115.486 -0.779 . . . . 24.52 110.81 178.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.743 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 5.0 Cg_exo -74.77 -179.57 5.04 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.36 2.707 . . . . 73.430000000000007 111.801 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 142' ' ' LYS . . . . . 0.673 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 11.5 tptp -89.62 -152.58 0.25 Allowed 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 119.899 -0.72 . . . . 64.109999999999999 110.812 -178.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 143' ' ' PHE . . . . . 0.494 ' CZ ' HG22 ' A' ' 47' ' ' VAL . 9.6 p90 -79.62 176.78 9.4 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 120.973 0.416 . . . . 74.219999999999999 111.356 -170.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . 0.686 ' H ' HD22 ' B' ' 144' ' ' LEU . 1.5 mm? -62.51 128.42 35.94 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.46 -0.791 . . . . 63.030000000000001 111.518 -172.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 16.3 t -96.27 14.49 24.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.601 0.715 . . . . 73.049999999999997 109.227 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 -79.85 39.58 0.43 Allowed 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.495 -0.775 . . . . 73.420000000000002 110.508 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 89.5 t -78.65 122.18 33.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.868 -0.605 . . . . 71.310000000000002 111.098 -176.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . 0.47 ' HD2' ' H ' ' B' ' 148' ' ' LYS . 0.0 OUTLIER -125.02 152.31 44.43 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 107.921 -1.14 . . . . 71.140000000000001 107.921 173.537 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.738 ' HB3' ' HD1' ' B' ' 151' ' ' PHE . 3.7 mm? -51.32 -51.45 54.29 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.212 0.32 . . . . 74.030000000000001 111.742 -175.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.748 ' HB3' ' HD3' ' A' ' 42' ' ' LYS . . . 47.32 36.67 4.99 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 123.976 0.797 . . . . 72.530000000000001 111.673 176.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 151' ' ' PHE . . . . . 0.738 ' HD1' ' HB3' ' B' ' 149' ' ' LEU . 28.5 p90 -87.66 167.68 13.67 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.867 -0.606 . . . . 73.099999999999994 109.992 -177.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -96.87 121.34 38.63 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.174 -0.466 . . . . 73.209999999999994 110.294 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 153' ' ' CYS . . . . . 0.45 ' HB2' ' CE2' ' B' ' 151' ' ' PHE . 48.7 t -122.06 113.2 19.2 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.795 -0.639 . . . . 74.519999999999996 109.635 176.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.1 t70 68.63 16.46 9.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.613 -0.721 . . . . 63.32 111.127 174.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 116.71 -32.25 5.59 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.568 -0.825 . . . . 42.310000000000002 112.827 178.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 156' ' ' GLU . . . . . 0.487 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 13.4 pt-20 -97.87 157.68 15.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.831 0.348 . . . . 75.349999999999994 110.67 -177.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.9 mm -92.23 123.55 44.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.388 -0.369 . . . . 73.129999999999995 110.389 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 158' ' ' LYS . . . . . 0.487 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 26.5 mmmt -106.59 103.82 13.36 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.987 0.422 . . . . 74.129999999999995 110.89 -177.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.17 96.25 10.48 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.084 0.468 . . . . 63.32 111.687 -179.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -110.34 123.82 50.54 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.962 -0.563 . . . . 73.409999999999997 110.046 174.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 16.2 m -93.8 -26.4 16.97 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.216 -0.661 . . . . 72.040000000000006 109.216 174.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 162' ' ' ASP . . . . . 0.438 ' HA ' HG21 ' B' ' 123' ' ' ILE . 5.0 p-10 -102.77 153.64 19.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.282 -0.872 . . . . 74.310000000000002 109.48 177.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . 0.417 HD12 HG21 ' A' ' 30' ' ' VAL . 2.9 mm? -87.73 -20.09 26.7 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.744 0.307 . . . . 64.450000000000003 110.809 -176.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -64.11 -47.6 79.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.322 -0.399 . . . . 73.319999999999993 110.805 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 15.7 m -65.9 -35.46 80.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.549 -0.296 . . . . 53.43 110.97 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 65.3 tp -66.44 -43.4 85.72 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.02 0.438 . . . . 74.310000000000002 110.136 177.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . 0.49 ' HG3' ' CD2' ' B' ' 184' ' ' LEU . 68.4 ttt180 -62.12 -41.5 98.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.868 -0.606 . . . . 64.239999999999995 110.471 178.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -66.48 -41.65 88.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.996 -0.547 . . . . 61.420000000000002 110.887 177.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 169' ' ' PHE . . . . . 0.412 ' O ' ' HG2' ' B' ' 172' ' ' GLN . 69.6 t80 -62.69 -46.3 88.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 74.049999999999997 110.666 -179.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 170' ' ' ALA . . . . . 0.42 ' CB ' HD12 ' B' ' 180' ' ' LEU . . . -61.48 -30.42 70.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.29 -0.413 . . . . 74.400000000000006 111.518 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 20.4 m -82.75 -12.3 57.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.775 0.322 . . . . 72.010000000000005 111.652 -175.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 14.0 pt20 -106.77 -1.99 22.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.436 0.636 . . . . 75.439999999999998 109.454 175.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -110.25 103.4 12.07 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.073 -0.967 . . . . 55.299999999999997 109.525 177.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 19.9 m -56.87 -32.11 65.5 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.9 0.381 . . . . 72.340000000000003 110.984 -177.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 6.2 m -66.11 -40.98 91.13 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.047 -0.524 . . . . 42.240000000000002 111.045 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 76.5 mtp -88.28 -21.15 24.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.392 -0.367 . . . . 44.299999999999997 111.077 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . 0.502 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 85.6 tttt -65.68 -23.09 66.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.308 0.575 . . . . 72.099999999999994 110.269 -179.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -95.59 -8.62 34.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.509 -0.769 . . . . 71.200000000000003 109.881 -178.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 179' ' ' LEU . . . . . 0.518 ' HB3' HG21 ' A' ' 33' ' ' ILE . 89.8 mt -94.04 -52.0 4.6 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 114.853 -1.067 . . . . 71.25 109.482 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 180' ' ' LEU . . . . . 0.42 HD12 ' CB ' ' B' ' 170' ' ' ALA . 6.0 mt -87.75 -12.45 45.16 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.791 -0.641 . . . . 63.109999999999999 112.368 -171.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 181' ' ' LYS . . . . . 0.502 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 64.2 pttt -62.15 -12.01 17.48 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.44 -0.504 . . . . 63.310000000000002 111.786 -178.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -70.03 -40.44 75.17 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.101 0.477 . . . . 74.010000000000005 110.445 175.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 25.9 m -104.65 -13.23 9.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.939 -0.573 . . . . 64.319999999999993 111.094 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 184' ' ' LEU . . . . . 0.49 ' CD2' ' HG3' ' B' ' 167' ' ' ARG . 9.1 mp -99.96 119.33 59.8 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 115.92 -0.582 . . . . 71.230000000000004 109.774 175.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -62.53 102.23 0.28 Allowed 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.779 2.319 . . . . 60.030000000000001 112.332 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -142.0 130.68 22.74 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.783 -0.644 . . . . 74.430000000000007 109.843 178.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 10.1 mtmp? -97.81 18.81 14.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.383 0.611 . . . . 73.140000000000001 110.357 178.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 . . . . . 0 C--O 1.25 1.127 0 CA-C-N 115.058 -0.974 . . . . 74.450000000000003 109.813 173.677 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.75 0 N-CA-C 112.3 -0.32 . . . . 64.109999999999999 112.3 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.496 HG13 HD22 ' A' ' 3' ' ' LEU . 14.8 p -119.48 -22.05 4.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.912 0.387 . . . . 55.43 110.765 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.496 HD22 HG13 ' A' ' 2' ' ' VAL . 2.7 mm? -83.23 162.38 21.22 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.229 -0.286 . . . . 52.340000000000003 110.229 177.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 95.1 mmm -96.2 67.81 2.6 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.997 0.427 . . . . 72.540000000000006 110.917 -176.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -169.51 152.96 4.93 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.608 -0.723 . . . . 74.019999999999996 109.826 178.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -127.13 170.33 12.49 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.801 0.334 . . . . 64.549999999999997 111.633 -176.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 136.07 106.37 0.82 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.061 -0.59 . . . . 73.019999999999996 111.742 -177.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -86.98 88.47 7.71 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.153 0.501 . . . . 73.109999999999999 111.567 -176.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 58.6 t -99.73 143.14 14.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.694 -0.685 . . . . 74.340000000000003 109.568 177.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -55.93 131.51 47.34 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.106 0.479 . . . . 74.409999999999997 110.507 178.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 50.9 m -119.64 143.99 47.4 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.939 -0.573 . . . . 72.430000000000007 110.823 -174.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.634 HD11 ' HB3' ' A' ' 18' ' ' SER . 57.0 tp -112.59 135.65 53.06 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.314 -0.403 . . . . 54.450000000000003 110.491 178.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.469 ' HB3' ' HB2' ' A' ' 17' ' ' SER . . . -97.45 161.18 13.91 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.18 -0.464 . . . . 74.019999999999996 111.216 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.45 97.42 8.38 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.932 -0.576 . . . . 51.43 110.329 176.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 71.32 -27.33 0.17 Allowed 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.076 1.35 . . . . 72.340000000000003 113.417 167.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 85.8 mt -80.33 4.67 17.1 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.208 0.447 . . . . 70.129999999999995 112.208 -179.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.469 ' HB2' ' HB3' ' A' ' 13' ' ' ALA . 50.9 m -145.78 -29.44 0.42 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.779 0.323 . . . . 34.020000000000003 111.609 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.634 ' HB3' HD11 ' A' ' 12' ' ' LEU . 3.6 p -78.2 -26.86 47.71 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.917 0.389 . . . . 60.210000000000001 110.74 178.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -134.06 176.17 8.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.937 -0.574 . . . . 62.119999999999997 109.828 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 34.4 m -149.69 134.51 17.79 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 110.131 -0.322 . . . . 73.239999999999995 110.131 178.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -68.95 156.45 38.55 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.287 -0.415 . . . . 64.109999999999999 110.564 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -59.21 118.45 5.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 44.100000000000001 110.83 -178.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 6.2 tp -76.17 122.33 30.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.989 -0.55 . . . . 52.0 111.126 -178.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.2 t -133.87 167.74 20.03 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.696 -0.684 . . . . 63.420000000000002 109.33 177.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.439 ' HA ' ' HD2' ' A' ' 25' ' ' LYS . 29.8 mmmt -114.94 -15.92 11.74 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.828 0.346 . . . . 73.140000000000001 110.786 -179.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.624 ' HG3' HG23 ' B' ' 183' ' ' VAL . 30.5 mm-40 -109.96 104.51 13.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.957 -0.565 . . . . 75.200000000000003 109.708 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 23.1 m95 -90.9 -68.73 0.77 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.141 -0.481 . . . . 63.530000000000001 110.631 -174.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.5 m -127.94 28.46 5.56 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.897 -0.592 . . . . 71.310000000000002 110.757 -177.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -73.79 -5.23 39.59 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.593 0.711 . . . . 72.329999999999998 110.26 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.583 HG22 HD13 ' B' ' 163' ' ' LEU . 10.9 t -69.05 154.57 8.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.564 -0.744 . . . . 72.349999999999994 109.527 176.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.46 ' HB3' HD22 ' B' ' 149' ' ' LEU . 18.4 p90 58.77 -13.45 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 125.158 1.383 . . . . 74.230000000000004 114.653 176.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.437 ' H ' ' C ' ' A' ' 30' ' ' VAL . 9.7 t30 -57.33 -46.42 83.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.035 0.445 . . . . 54.039999999999999 111.023 -178.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.527 HG22 HD21 ' A' ' 37' ' ' ASN . 48.8 mm -64.56 -43.53 96.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.937 -0.574 . . . . 75.439999999999998 110.887 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.762 HD12 HD21 ' B' ' 149' ' ' LEU . 85.5 mt -65.25 -17.94 64.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 74.430000000000007 111.617 -178.078 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -79.93 -34.38 38.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.113 0.482 . . . . 74.310000000000002 110.115 175.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -71.88 -46.17 58.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.753 -0.658 . . . . 64.120000000000005 111.293 -176.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.527 HD21 HG22 ' A' ' 33' ' ' ILE . 11.9 p30 -91.15 -8.0 49.93 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.866 -0.606 . . . . 74.049999999999997 110.753 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.1 t0 55.39 73.33 0.43 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.174 -0.921 . . . . 70.25 112.077 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -86.02 12.91 8.46 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.129 -0.942 . . . . 75.409999999999997 110.241 170.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.566 ' O ' ' HA ' ' B' ' 151' ' ' PHE . 1.1 tm-20 66.54 73.28 0.39 Allowed Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 115.62 -0.718 . . . . 72.420000000000002 110.215 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -76.88 161.31 33.34 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 123.352 2.702 . . . . 71.510000000000005 111.959 -178.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.553 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 10.8 tptt -121.61 144.37 48.79 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 120.195 -0.602 . . . . 72.310000000000002 112.438 -176.045 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -164.71 96.72 0.75 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.432 -1.258 . . . . 64.409999999999997 109.284 -175.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.902 ' H ' HG11 ' B' ' 147' ' ' VAL . 6.1 mp -101.3 -5.34 25.58 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.973 0.416 . . . . 73.340000000000003 110.184 179.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.653 ' H ' HG21 ' B' ' 147' ' ' VAL . 11.3 t 70.26 25.33 4.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.893 -1.049 . . . . 73.019999999999996 110.658 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -80.36 76.98 7.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.008 -0.542 . . . . 74.140000000000001 109.813 176.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.742 HG12 ' H ' ' A' ' 48' ' ' LYS . 2.3 t -91.21 -155.46 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 109.208 -0.664 . . . . 62.210000000000001 109.208 -178.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.742 ' H ' HG12 ' A' ' 47' ' ' VAL . 0.2 OUTLIER -111.23 129.06 56.08 Favored 'General case' 0 CA--C 1.506 -0.738 0 C-N-CA 120.156 -0.617 . . . . 74.430000000000007 109.505 -175.78 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.999 HD21 HD12 ' B' ' 134' ' ' LEU . 47.2 tp -79.54 80.4 5.92 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 109.383 -0.599 . . . . 74.439999999999998 109.383 175.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.761 ' H ' ' HB2' ' B' ' 142' ' ' LYS . . . -88.4 77.06 8.2 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.514 -0.766 . . . . 63.140000000000001 110.146 178.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.575 ' HD1' ' HG ' ' A' ' 49' ' ' LEU . 43.7 p90 -93.77 168.76 10.79 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.638 -0.71 . . . . 73.340000000000003 110.919 -174.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.47 ' HE3' ' CD1' ' A' ' 57' ' ' ILE . 4.5 tppp? -96.78 114.08 25.68 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.999 -0.546 . . . . 63.420000000000002 110.368 -178.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.482 ' SG ' ' HE1' ' A' ' 69' ' ' PHE . 48.7 t -121.57 112.57 18.64 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.141 -0.481 . . . . 52.130000000000003 110.66 179.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.5 t70 68.88 0.98 2.94 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.298 -0.865 . . . . 74.540000000000006 112.456 171.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 127.98 -13.62 6.37 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.182 -1.009 . . . . 43.310000000000002 112.91 178.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.605 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 11.9 pt-20 -118.09 144.78 45.35 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.072 0.463 . . . . 75.219999999999999 110.272 177.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.47 ' CD1' ' HE3' ' A' ' 52' ' ' LYS . 41.0 mm -75.16 126.07 35.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.866 -0.607 . . . . 72.519999999999996 109.767 177.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.605 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 30.9 mmmt -114.17 117.51 31.4 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.187 -0.301 . . . . 75.239999999999995 110.187 -178.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.56 105.54 16.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.111 0.481 . . . . 70.140000000000001 111.458 178.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.444 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 25.5 m-85 -123.29 151.42 42.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.034 -0.53 . . . . 74.299999999999997 111.424 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.4 t -158.89 19.06 0.2 Allowed 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.075 -1.083 . . . . 54.43 108.075 173.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -129.88 117.05 19.55 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 114.809 -1.087 . . . . 75.310000000000002 109.373 -173.162 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.482 HD11 HD13 ' A' ' 84' ' ' LEU . 51.6 tp -65.38 -37.57 87.39 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.633 0.254 . . . . 74.230000000000004 110.535 179.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 44.5 tt0 -59.47 -50.39 74.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.09 0.471 . . . . 72.340000000000003 111.019 177.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.4 m -66.51 -42.09 87.85 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.101 -0.5 . . . . 71.129999999999995 110.881 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 36.4 tp -65.48 -33.17 75.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.271 -0.422 . . . . 63.009999999999998 110.714 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.576 ' HA ' HD21 ' A' ' 84' ' ' LEU . 54.3 ttp180 -57.95 -40.38 80.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.328 -0.396 . . . . 74.120000000000005 110.659 177.023 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -69.88 -40.61 75.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.081 -0.509 . . . . 74.299999999999997 111.228 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.575 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 33.9 t80 -74.66 -45.19 46.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 71.430000000000007 111.068 -176.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.48 -28.36 67.79 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.753 0.311 . . . . 74.340000000000003 111.028 -177.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 31.6 t -63.92 -29.32 70.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.137 -0.483 . . . . 32.310000000000002 111.18 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.575 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 13.5 pt20 -95.9 0.95 52.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.167 0.508 . . . . 60.340000000000003 110.199 -179.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.48 ' HD3' ' HA ' ' A' ' 73' ' ' LYS . 43.3 mmtt -102.74 111.38 23.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.944 -0.571 . . . . 71.340000000000003 111.067 -178.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.8 m -53.99 -35.53 61.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.019 -0.537 . . . . 61.229999999999997 111.228 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.2 p -81.8 -56.88 3.7 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.236 0.541 . . . . 74.099999999999994 111.28 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.517 ' HA ' HD12 ' A' ' 79' ' ' LEU . 74.9 mtp -66.23 -24.0 66.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.674 -0.694 . . . . 73.120000000000005 112.312 -173.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.415 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 45.4 tttm -61.9 -33.99 75.22 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.858 0.361 . . . . 65.129999999999995 110.989 179.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -87.76 -14.06 40.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.572 0.701 . . . . 63.340000000000003 109.517 -174.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.517 HD12 ' HA ' ' A' ' 76' ' ' MET . 84.8 mt -82.26 -48.19 11.52 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.746 -1.116 . . . . 71.439999999999998 109.302 175.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.445 ' O ' ' HB3' ' A' ' 84' ' ' LEU . 4.3 mm? -79.31 -24.3 42.92 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.145 -0.934 . . . . 60.43 112.077 -177.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.482 ' HA ' ' HG3' ' A' ' 86' ' ' GLN . 64.2 pttt -57.85 -16.84 13.06 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.486 0.55 . . . . 51.43 112.486 -174.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -81.1 -45.43 16.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.856 0.36 . . . . 70.230000000000004 111.178 -177.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 11.5 m -106.99 -2.19 9.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.225 0.536 . . . . 64.420000000000002 111.169 -174.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.758 HD12 ' HD2' ' A' ' 85' ' ' PRO . 40.6 tp -127.43 132.14 24.18 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 115.716 -0.675 . . . . 70.409999999999997 109.82 -176.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.758 ' HD2' HD12 ' A' ' 84' ' ' LEU . 76.6 Cg_exo -51.47 113.88 1.33 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 123.189 2.593 . . . . 63.210000000000001 113.079 179.209 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.482 ' HG3' ' HA ' ' A' ' 81' ' ' LYS . 83.6 mm-40 -127.92 -148.34 0.38 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.263 -0.881 . . . . 75.040000000000006 109.406 176.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.51 ' HD2' ' H ' ' A' ' 87' ' ' LYS . 3.2 mptp? -70.44 -29.52 66.12 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.245 -0.65 . . . . 62.450000000000003 109.245 173.136 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 16.0 mp0 . . . . . 0 C--O 1.235 0.305 0 CA-C-N 115.395 -0.82 . . . . 50.100000000000001 110.907 176.646 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.362 0 N-CA-C 111.802 -0.519 . . . . 42.25 111.802 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 26.8 m -74.84 -23.32 17.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.57 0.7 . . . . 64.25 109.949 176.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' LEU . . . . . 0.594 HD13 ' N ' ' B' ' 104' ' ' MET . 1.6 tm? -132.59 150.61 52.13 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.652 -1.24 . . . . 72.409999999999997 107.652 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' MET . . . . . 0.594 ' N ' HD13 ' B' ' 103' ' ' LEU . 90.1 mmm -77.94 79.91 4.4 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.313 0.578 . . . . 71.549999999999997 110.364 -178.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -170.67 -167.43 0.58 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.682 -1.229 . . . . 72.409999999999997 107.682 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -93.04 157.58 16.23 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.795 0.331 . . . . 75.329999999999998 110.374 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -86.61 -129.62 2.63 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.743 -0.741 . . . . 54.450000000000003 112.191 -179.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -146.21 146.94 30.98 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 110.324 -0.25 . . . . 63.130000000000003 110.324 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 40.7 t -74.91 -48.63 32.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.251 0.548 . . . . 75.430000000000007 110.267 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -155.33 145.31 21.59 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.331 -0.849 . . . . 72.450000000000003 109.837 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 86.9 m -148.49 128.73 13.77 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.578 0.228 . . . . 64.099999999999994 110.834 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 31.8 tp -67.34 122.0 16.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.054 -0.521 . . . . 62.229999999999997 110.23 175.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -74.05 107.04 6.01 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.972 -0.558 . . . . 74.040000000000006 111.484 -177.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -80.3 -3.67 50.32 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.616 -0.72 . . . . 71.349999999999994 110.8 -179.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -92.31 11.02 27.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.913 -0.585 . . . . 60.109999999999999 109.96 176.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 98.8 mt 69.09 87.16 0.12 Allowed 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.179 -0.919 . . . . 75.400000000000006 111.356 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 8.8 t -123.28 -39.49 2.46 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.539 -0.755 . . . . 75.319999999999993 109.058 175.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -32.86 64.47 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.449 -0.796 . . . . 74.219999999999999 110.859 177.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -121.34 132.54 54.84 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.257 -0.429 . . . . 63.109999999999999 110.833 -179.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 2.6 m -108.91 160.43 16.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.807 -0.633 . . . . 72.450000000000003 109.664 178.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -65.99 157.5 30.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.914 0.387 . . . . 72.299999999999997 110.915 177.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -66.46 126.57 29.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.924 -0.58 . . . . 75.5 111.093 -177.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . 0.513 HG13 ' H ' ' B' ' 125' ' ' LYS . 7.7 tp -93.03 135.81 26.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.856 -0.611 . . . . 60.210000000000001 110.636 -178.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 6.5 m -114.78 2.42 14.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.014 0.435 . . . . 71.230000000000004 110.231 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . 0.513 ' H ' HG13 ' B' ' 123' ' ' ILE . 31.6 mmmt 70.41 -36.18 0.35 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.081 -0.963 . . . . 72.340000000000003 112.498 -179.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 21.2 mm-40 -86.95 143.12 27.52 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.66 -0.496 . . . . 74.019999999999996 109.66 179.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 75.0 m95 -112.92 -166.99 1.13 Allowed 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.03 0.443 . . . . 65.129999999999995 110.295 -176.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 18.0 m -84.17 35.56 0.54 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.586 -0.734 . . . . 73.010000000000005 111.556 -174.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -86.89 7.22 28.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.643 0.735 . . . . 64.010000000000005 110.232 -178.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.427 HG12 ' N ' ' B' ' 131' ' ' PHE . 5.2 t -73.56 166.8 2.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.414 -0.812 . . . . 54.340000000000003 109.252 177.001 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 131' ' ' PHE . . . . . 0.656 ' HD1' HD22 ' A' ' 49' ' ' LEU . 57.2 m-85 73.41 -37.71 0.39 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.502 0.721 . . . . 71.25 112.13 177.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -55.11 -36.75 66.03 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.352 0.501 . . . . 72.129999999999995 112.352 -176.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 133' ' ' ILE . . . . . 0.467 HG21 ' HB3' ' A' ' 79' ' ' LEU . 40.6 mm -58.0 -50.7 77.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.922 0.391 . . . . 55.439999999999998 110.797 177.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.999 HD12 HD21 ' A' ' 49' ' ' LEU . 40.3 mt -69.35 -9.07 51.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.037 -0.528 . . . . 72.519999999999996 111.558 -178.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -82.34 -30.1 30.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.848 0.356 . . . . 71.120000000000005 110.109 176.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -73.62 -53.87 9.47 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.269 0.556 . . . . 60.240000000000002 110.324 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 137' ' ' ASN . . . . . 0.543 ' OD1' ' HA ' ' B' ' 134' ' ' LEU . 16.1 p30 -80.48 -14.04 58.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.233 -0.894 . . . . 74.329999999999998 111.606 -177.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 11.5 t70 55.85 70.91 0.59 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.754 0.787 . . . . 62.25 110.403 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 139' ' ' PHE . . . . . 0.494 ' O ' ' HB2' ' B' ' 140' ' ' GLU . 1.8 m-85 -86.15 26.63 1.0 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.181 -0.918 . . . . 73.319999999999993 110.462 178.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 140' ' ' GLU . . . . . 0.528 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 12.4 mm-40 70.36 61.34 0.5 Allowed Pre-proline 0 N--CA 1.464 0.258 0 O-C-N 123.951 0.782 . . . . 72.040000000000006 110.529 -177.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.434 ' HD3' ' N ' ' B' ' 140' ' ' GLU . 6.5 Cg_exo -72.8 139.77 31.07 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.722 2.281 . . . . 52.149999999999999 112.073 -175.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 142' ' ' LYS . . . . . 0.761 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 13.6 mptt -111.86 135.96 51.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.952 0.406 . . . . 75.209999999999994 111.328 -178.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -162.75 90.32 0.7 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.932 -1.031 . . . . 74.230000000000004 108.508 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . 0.623 ' H ' HG11 ' A' ' 47' ' ' VAL . 3.0 mm? -86.6 -92.13 0.1 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 110.011 -0.366 . . . . 72.409999999999997 110.011 179.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 13.1 t -173.84 22.16 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.438 0.637 . . . . 74.519999999999996 109.953 177.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . 0.507 ' HB2' HG13 ' A' ' 47' ' ' VAL . 29.4 mt-10 -85.28 100.43 11.79 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.826 -0.624 . . . . 62.109999999999999 110.156 -178.179 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 147' ' ' VAL . . . . . 0.902 HG11 ' H ' ' A' ' 44' ' ' LEU . 1.7 t -125.48 -149.31 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.831 -0.622 . . . . 65.439999999999998 109.392 -177.083 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . 0.601 ' H ' HG12 ' B' ' 147' ' ' VAL . 1.3 mptt -113.5 122.91 48.71 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 108.662 -0.866 . . . . 62.119999999999997 108.662 177.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.762 HD21 HD12 ' A' ' 34' ' ' LEU . 65.9 tp -80.26 84.86 5.85 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.636 0.731 . . . . 72.519999999999996 109.147 174.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.553 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -94.76 115.72 27.86 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 114.811 -1.086 . . . . 43.340000000000003 109.082 176.666 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 151' ' ' PHE . . . . . 0.566 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 44.8 p90 -130.78 164.78 24.39 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.084 -0.507 . . . . 73.420000000000002 110.716 -179.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -87.52 123.2 32.17 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.131 -0.486 . . . . 73.420000000000002 110.012 179.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 153' ' ' CYS . . . . . 0.591 ' SG ' ' HE3' ' B' ' 173' ' ' LYS . 38.1 t -133.69 104.58 6.4 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.342 -0.39 . . . . 73.409999999999997 110.546 178.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 15.0 t70 70.21 14.02 7.65 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.259 -0.882 . . . . 73.25 111.948 172.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 124.54 -29.72 4.9 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.424 -0.893 . . . . 71.540000000000006 112.953 176.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 156' ' ' GLU . . . . . 0.446 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 15.4 pt-20 -106.68 150.85 25.83 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 122.553 -0.38 . . . . 74.530000000000001 110.644 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 44.6 mm -84.77 127.34 39.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.555 -0.535 . . . . 74.120000000000005 109.555 177.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 158' ' ' LYS . . . . . 0.533 ' O ' ' HA ' ' B' ' 150' ' ' ALA . 29.2 mmmt -107.52 112.05 24.63 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.498 -0.319 . . . . 75.019999999999996 110.557 -177.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . 0.526 HG22 ' HB2' ' B' ' 150' ' ' ALA . 0.8 OUTLIER -86.35 103.54 15.02 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.921 0.391 . . . . 74.319999999999993 110.988 176.777 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 160' ' ' PHE . . . . . 0.446 ' HD2' HD13 ' B' ' 166' ' ' LEU . 20.4 m-30 -120.66 116.56 25.54 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.173 -0.467 . . . . 73.329999999999998 111.197 178.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 8.0 t -109.64 10.53 24.91 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.354 -0.98 . . . . 74.099999999999994 108.354 171.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -122.09 121.62 37.35 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 114.863 -1.062 . . . . 71.239999999999995 110.104 -177.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . 0.583 HD13 HG22 ' A' ' 30' ' ' VAL . 63.0 tp -65.96 -35.48 80.71 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.925 -0.398 . . . . 63.539999999999999 109.925 177.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -62.29 -42.29 99.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.941 -0.572 . . . . 74.219999999999999 110.813 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 43.6 m -67.15 -43.5 82.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.215 -0.448 . . . . 75.109999999999999 110.645 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . 0.446 HD13 ' HD2' ' B' ' 160' ' ' PHE . 64.5 tp -65.35 -38.0 88.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.253 -0.431 . . . . 73.329999999999998 110.532 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . 0.423 ' HG3' ' HG ' ' B' ' 184' ' ' LEU . 36.6 ttp180 -58.37 -41.08 83.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.341 -0.391 . . . . 51.43 110.55 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 168' ' ' LYS . . . . . 0.402 ' HB2' ' HE3' ' B' ' 168' ' ' LYS . 40.0 mtmt -65.19 -51.97 57.76 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.01 -0.541 . . . . 74.129999999999995 110.886 177.078 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 169' ' ' PHE . . . . . 0.408 ' CE1' ' HE2' ' B' ' 173' ' ' LYS . 22.4 t80 -65.97 -44.8 83.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.296 -0.865 . . . . 71.219999999999999 111.266 -171.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.57 -30.52 71.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.374 -0.375 . . . . 62.329999999999998 111.511 -179.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 25.6 t -77.67 -20.47 53.67 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.495 -0.321 . . . . 52.229999999999997 111.111 -177.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -100.07 1.68 42.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.247 0.546 . . . . 62.439999999999998 110.618 178.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 173' ' ' LYS . . . . . 0.591 ' HE3' ' SG ' ' B' ' 153' ' ' CYS . 60.8 mmtt -102.18 118.11 36.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.57 -0.741 . . . . 71.400000000000006 109.58 173.131 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 4.2 p -59.01 -43.12 91.5 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.14 0.495 . . . . 40.219999999999999 111.007 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 4.5 m -69.6 -32.87 71.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.815 -0.63 . . . . 60.439999999999998 111.687 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.511 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 77.1 mtp -96.82 -10.85 25.76 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.698 0.258 . . . . 63.420000000000002 111.698 -172.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -56.58 -40.85 75.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.25 -0.432 . . . . 74.329999999999998 111.723 -177.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . 0.603 ' HA ' ' HD3' ' B' ' 181' ' ' LYS . 31.9 mt-10 -94.51 -0.31 54.74 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.262 0.553 . . . . 71.519999999999996 110.622 -173.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 179' ' ' LEU . . . . . 0.497 HD22 HD22 ' A' ' 37' ' ' ASN . 83.8 mt -83.21 -51.01 7.85 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.465 -0.789 . . . . 74.239999999999995 109.496 176.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 180' ' ' LEU . . . . . 0.625 ' HB3' HD13 ' B' ' 184' ' ' LEU . 3.7 mm? -92.01 1.54 57.13 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.775 -0.648 . . . . 72.120000000000005 111.481 -175.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 181' ' ' LYS . . . . . 0.603 ' HD3' ' HA ' ' B' ' 178' ' ' GLU . 63.8 pttt -65.19 -2.35 2.88 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.714 0.635 . . . . 73.209999999999994 112.714 -176.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -79.48 -31.0 42.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.357 0.599 . . . . 63.210000000000001 109.939 174.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 183' ' ' VAL . . . . . 0.624 HG23 ' HG3' ' A' ' 26' ' ' GLN . 5.3 p -107.23 -21.25 5.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.46 -0.791 . . . . 61.43 110.006 177.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 184' ' ' LEU . . . . . 0.625 HD13 ' HB3' ' B' ' 180' ' ' LEU . 10.1 mp -88.62 113.21 54.65 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 115.998 -0.547 . . . . 63.420000000000002 109.927 174.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -63.17 114.64 2.56 Favored 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 122.735 2.29 . . . . 72.340000000000003 112.461 -177.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -89.76 -168.93 2.28 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.918 -0.583 . . . . 64.030000000000001 110.314 177.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 187' ' ' LYS . . . . . 0.426 ' N ' ' HD2' ' B' ' 187' ' ' LYS . 2.6 mptp? -84.86 -25.11 28.24 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.825 -0.625 . . . . 73.010000000000005 110.173 -179.033 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 . . . . . 0 C--O 1.248 1.026 0 CA-C-N 115.562 -0.744 . . . . 64.329999999999998 109.903 177.834 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.874 ' HA2' ' SG ' ' A' ' 45' ' ' CYS . . . . . . . . 0 N--CA 1.48 1.597 0 N-CA-C 111.829 -0.509 . . . . 73.030000000000001 111.829 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 18.9 m -54.04 -36.73 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 CA-C-O 121.232 0.539 . . . . 61.420000000000002 110.725 178.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.568 HD12 ' HA ' ' A' ' 28' ' ' SER . 93.9 mt -136.43 137.46 40.48 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.492 -0.929 . . . . 75.25 108.492 173.06 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 68.7 mtm -118.01 21.8 12.6 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.973 0.416 . . . . 73.150000000000006 110.553 -175.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -55.96 119.94 6.63 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.347 -0.842 . . . . 65.25 111.413 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.412 ' H ' ' HG2' ' A' ' 6' ' ' GLU . 5.5 pt-20 -89.0 84.98 6.61 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.439 -0.801 . . . . 73.310000000000002 110.161 178.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -84.84 -141.74 5.5 Favored Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 115.56 -0.745 . . . . 22.129999999999999 112.496 -178.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -140.98 -171.0 3.16 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 120.852 0.358 . . . . 62.009999999999998 110.754 -177.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.414 ' HB ' ' H ' ' A' ' 10' ' ' LEU . 19.4 m -94.13 -150.91 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.743 -0.662 . . . . 74.510000000000005 110.054 177.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.414 ' H ' ' HB ' ' A' ' 9' ' ' VAL . 6.4 mp -70.69 87.82 0.69 Allowed 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.759 -0.46 . . . . 73.420000000000002 109.759 176.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 53.2 m -94.26 107.74 19.66 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.292 0.568 . . . . 54.340000000000003 111.241 -177.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.504 HD21 ' HA ' ' A' ' 16' ' ' LEU . 1.7 tt -94.77 125.6 39.53 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.24 -1.022 . . . . 73.409999999999997 108.24 174.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.71 ' HB3' ' O ' ' A' ' 16' ' ' LEU . . . -74.98 -165.22 0.36 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.398 -0.364 . . . . 63.5 111.702 -176.003 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.83 -77.39 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.837 0.68 . . . . 71.209999999999994 112.837 -173.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -83.03 -54.28 5.18 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.519 -0.919 . . . . 70.510000000000005 108.519 177.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.71 ' O ' ' HB3' ' A' ' 13' ' ' ALA . 4.7 mp -145.59 176.91 9.26 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 106.641 -1.614 . . . . 54.100000000000001 106.641 172.252 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.431 ' HA ' ' HB3' ' A' ' 13' ' ' ALA . 48.9 m -76.91 45.48 0.43 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.933 0.873 . . . . 64.340000000000003 110.125 177.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.439 ' H ' ' C ' ' A' ' 16' ' ' LEU . 29.6 t -120.22 118.62 30.96 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.356 -1.293 . . . . 62.240000000000002 109.216 -178.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -152.94 175.9 12.44 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.629 -0.26 . . . . 53.240000000000002 110.666 -177.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.8 m -66.63 139.41 57.87 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.472 -0.566 . . . . 72.120000000000005 109.472 175.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 21' ' ' LEU . 3.9 mm? -47.51 130.37 13.8 Favored 'General case' 0 N--CA 1.464 0.264 0 O-C-N 123.58 0.55 . . . . 75.310000000000002 112.018 -175.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -97.39 -167.6 1.56 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.385 -0.825 . . . . 74.219999999999999 110.914 -174.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 12.8 tt -97.73 -22.15 5.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 112.318 0.488 . . . . 74.549999999999997 112.318 -171.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.0 m -106.05 128.89 54.16 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.179 0.514 . . . . 71.299999999999997 112.069 -172.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.438 ' HD3' ' HA ' ' A' ' 25' ' ' LYS . 21.9 mmtm -117.86 98.77 6.52 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.567 0.698 . . . . 62.350000000000001 110.4 173.419 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.709 ' H ' ' NE2' ' A' ' 26' ' ' GLN . 0.0 OUTLIER -81.06 113.44 19.25 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 114.674 -1.148 . . . . 70.349999999999994 109.366 179.754 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 25.8 t-105 -115.08 35.07 4.5 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.688 0.756 . . . . 73.219999999999999 109.624 -179.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.568 ' HA ' HD12 ' A' ' 3' ' ' LEU . 3.4 m -77.44 31.5 0.15 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.378 -0.828 . . . . 73.140000000000001 111.209 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.407 ' ND2' HG21 ' B' ' 183' ' ' VAL . 8.7 t30 -79.8 85.96 5.41 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.105 0.478 . . . . 71.329999999999998 110.846 -176.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 58.3 t -125.97 -62.52 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.718 -0.674 . . . . 65.0 109.639 175.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.573 ' HB3' HD11 ' B' ' 149' ' ' LEU . 13.0 p90 -103.43 5.99 37.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.623 -0.717 . . . . 75.120000000000005 111.475 -177.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.616 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 9.2 t30 -59.3 -61.13 2.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.323 -0.399 . . . . 70.25 111.217 -174.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.551 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 1.7 mp -53.45 -41.59 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.44 -0.345 . . . . 65.109999999999999 111.508 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.1 mt -60.06 -40.49 89.66 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.13 -0.487 . . . . 73.319999999999993 111.27 178.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -67.83 -43.39 79.68 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 116.605 -0.27 . . . . 74.209999999999994 110.799 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.616 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 4.8 mm-40 -63.5 -38.93 93.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 62.420000000000002 111.005 -177.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -92.23 1.17 57.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 64.209999999999994 111.032 -178.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 56.77 53.45 8.28 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.608 -0.724 . . . . 72.099999999999994 112.371 177.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -81.37 -11.34 59.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.856 -0.611 . . . . 63.439999999999998 109.629 171.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 60.25 81.85 0.24 Allowed Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 114.506 -1.225 . . . . 72.349999999999994 111.734 176.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.576 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 20.9 Cg_exo -66.27 164.28 28.72 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.719 2.279 . . . . 74.299999999999997 110.969 175.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 1.129 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -78.58 -67.39 0.75 Allowed 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 119.595 -0.842 . . . . 64.0 110.476 -176.347 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.421 ' C ' ' H ' ' A' ' 45' ' ' CYS . 89.0 m-85 -128.82 143.38 50.89 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 108.966 -0.753 . . . . 73.120000000000005 108.966 175.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.431 HD22 ' H ' ' A' ' 44' ' ' LEU . 2.2 mm? -78.58 38.48 0.31 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.053 0.454 . . . . 72.239999999999995 109.834 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.874 ' SG ' ' HA2' ' A' ' 1' ' ' GLY . 5.0 t 61.66 25.29 15.22 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.824 0.821 . . . . 74.299999999999997 109.655 -173.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.6 147.98 22.51 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.836 -1.075 . . . . 74.25 109.235 176.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 29.6 m -137.0 151.35 27.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-O 121.196 0.522 . . . . 71.219999999999999 111.003 -178.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.415 ' HD2' ' H ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -140.94 136.28 32.07 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.406 -0.816 . . . . 75.540000000000006 109.396 175.423 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.689 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 11.0 mp -72.61 92.35 1.51 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.339 -0.391 . . . . 74.239999999999995 110.293 178.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.631 ' HA ' ' O ' ' A' ' 58' ' ' LYS . . . -87.56 70.25 9.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.966 -0.561 . . . . 53.520000000000003 109.834 175.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.689 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 45.3 p90 -100.92 169.29 9.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.622 -0.717 . . . . 72.239999999999995 110.527 -177.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -105.65 121.72 44.57 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.477 -0.328 . . . . 73.150000000000006 111.391 -176.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.559 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 48.5 t -110.18 103.62 12.34 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.109 -0.496 . . . . 63.340000000000003 109.891 175.136 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 65.01 12.81 8.21 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.676 0.621 . . . . 73.239999999999995 112.676 174.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.45 -28.94 4.9 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.402 -0.904 . . . . 63.130000000000003 112.482 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.424 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 12.0 pt-20 -95.54 131.92 41.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.015 0.436 . . . . 74.209999999999994 110.721 -179.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 50.0 mm -75.26 129.64 36.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.103 -0.499 . . . . 71.239999999999995 110.375 177.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.631 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 28.0 mmmt -113.05 155.36 25.0 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.078 -0.712 . . . . 61.219999999999999 109.078 178.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.4 p -128.45 108.82 10.86 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.001 0.429 . . . . 74.540000000000006 110.889 175.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.468 ' CD2' HD13 ' A' ' 66' ' ' LEU . 87.2 m-85 -121.17 123.69 42.9 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.94 -0.573 . . . . 64.099999999999994 111.27 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.7 p -116.82 -17.27 10.51 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.396 -0.82 . . . . 74.310000000000002 109.527 174.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -106.97 127.3 53.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.472 -0.786 . . . . 70.340000000000003 110.526 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.5 tt -65.35 -44.06 88.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.996 -0.547 . . . . 72.420000000000002 110.328 -176.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.548 ' O ' ' HG3' ' A' ' 68' ' ' LYS . 47.9 tp60 -58.55 -41.48 85.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.095 -0.502 . . . . 75.099999999999994 110.84 -177.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.7 m -62.91 -45.76 90.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.12 -0.491 . . . . 74.310000000000002 111.011 178.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.468 HD13 ' CD2' ' A' ' 60' ' ' PHE . 55.2 tp -70.35 -31.8 69.24 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 75.430000000000007 110.888 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.432 ' HG2' ' HG ' ' A' ' 84' ' ' LEU . 3.4 tmm_? -62.79 -29.22 70.54 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.173 -0.467 . . . . 72.310000000000002 110.378 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.548 ' HG3' ' O ' ' A' ' 64' ' ' GLN . 91.5 mttt -70.02 -46.16 65.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.352 0.596 . . . . 61.140000000000001 110.599 176.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -67.28 -48.8 66.6 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.186 -0.915 . . . . 73.530000000000001 110.956 -176.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.1 -26.69 67.58 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.17 -0.468 . . . . 72.219999999999999 111.636 -177.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 35.9 t -75.97 -23.53 55.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.559 -0.291 . . . . 63.149999999999999 111.472 -178.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -102.82 2.01 34.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.328 0.585 . . . . 74.340000000000003 110.299 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.559 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 28.2 mmmt -103.5 101.12 11.0 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.216 -0.902 . . . . 73.340000000000003 109.751 175.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.4 p -55.83 -33.32 64.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.04 0.448 . . . . 71.129999999999995 111.07 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.455 ' O ' HD13 ' A' ' 79' ' ' LEU . 3.0 m -62.34 -45.64 92.3 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.727 -0.669 . . . . 72.530000000000001 110.937 177.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 82.0 mtp -90.95 -13.51 33.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.159 -0.473 . . . . 74.120000000000005 111.482 -174.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.638 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 33.6 ttpt -75.24 -9.05 58.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.778 0.323 . . . . 62.049999999999997 110.709 -176.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -99.06 -5.06 31.0 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.904 0.859 . . . . 73.540000000000006 109.492 174.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.714 ' HB3' HG21 ' B' ' 133' ' ' ILE . 10.7 mp -97.62 -55.92 2.67 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.442 -1.254 . . . . 74.340000000000003 109.42 176.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.811 ' HB3' HD13 ' A' ' 84' ' ' LEU . 3.8 mm? -81.19 -7.79 59.63 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 114.806 -1.088 . . . . 74.420000000000002 112.111 -176.254 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.638 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 64.8 pttt -55.05 -20.22 9.03 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.812 0.339 . . . . 75.400000000000006 111.729 178.012 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -69.24 -33.69 73.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.348 -0.387 . . . . 74.219999999999999 111.219 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.531 HG12 ' CZ2' ' B' ' 127' ' ' TRP . 27.0 m -115.9 -8.3 12.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.018 0.377 . . . . 54.140000000000001 112.018 -175.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.811 HD13 ' HB3' ' A' ' 80' ' ' LEU . 8.3 mp -96.75 138.14 21.39 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.464 -0.334 . . . . 61.240000000000002 110.823 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 84' ' ' LEU . 18.9 Cg_exo -66.38 107.44 1.2 Allowed 'Trans proline' 0 C--O 1.235 0.36 0 C-N-CA 122.71 2.273 . . . . 71.5 111.289 174.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.415 HE21 ' HB3' ' A' ' 84' ' ' LEU . 84.2 mm-40 -122.26 176.91 5.6 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.23 0.538 . . . . 70.349999999999994 110.78 -176.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -116.84 -45.84 2.76 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.218 -0.901 . . . . 73.239999999999995 109.835 175.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 . . . . . 0 C--O 1.235 0.312 0 CA-C-N 115.896 -0.593 . . . . 63.43 110.288 -178.994 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 N-CA-C 111.987 -0.445 . . . . 73.25 111.987 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 29.6 m -111.97 154.34 13.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.722 0.296 . . . . 45.509999999999998 110.621 179.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.38 129.54 39.1 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.51 -0.552 . . . . 73.5 109.51 179.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 10.3 mtm -84.17 85.46 7.35 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.652 -0.703 . . . . 72.430000000000007 110.789 -174.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -115.96 143.87 44.85 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.299 -0.41 . . . . 74.120000000000005 110.758 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -119.86 138.32 53.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.178 -0.465 . . . . 73.340000000000003 110.224 177.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -137.03 -118.37 1.72 Allowed Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.696 -0.764 . . . . 61.409999999999997 112.528 -178.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -117.3 143.79 45.56 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.874 0.368 . . . . 64.319999999999993 110.973 -178.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.408 ' HB ' ' H ' ' B' ' 110' ' ' LEU . 16.7 m -85.33 -158.87 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.599 -0.728 . . . . 71.209999999999994 110.816 178.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 110' ' ' LEU . . . . . 0.62 ' H ' HD12 ' B' ' 110' ' ' LEU . 5.7 mp -55.16 103.79 0.1 Allowed 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 110.14 -0.319 . . . . 61.43 110.14 177.187 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 26.4 m -119.65 129.71 54.71 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.419 -0.355 . . . . 70.030000000000001 111.21 -175.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . 0.439 HD23 ' N ' ' B' ' 113' ' ' ALA . 3.6 tt -91.07 132.7 35.86 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.941 -0.763 . . . . 55.149999999999999 108.941 175.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 113' ' ' ALA . . . . . 0.666 ' HB3' ' O ' ' B' ' 116' ' ' LEU . . . -73.67 -68.06 0.54 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.379 -0.373 . . . . 64.099999999999994 111.72 -175.571 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -144.62 -69.0 0.3 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.974 0.416 . . . . 74.430000000000007 110.674 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -105.03 -38.61 6.53 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 107.965 -1.124 . . . . 62.219999999999999 107.965 173.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.666 ' O ' ' HB3' ' B' ' 113' ' ' ALA . 5.4 mp -128.65 -170.47 2.27 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 107.035 -1.469 . . . . 75.019999999999996 107.035 169.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.447 ' HA ' ' CB ' ' B' ' 113' ' ' ALA . 44.6 m -96.29 53.78 1.36 Allowed 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.003 0.906 . . . . 65.409999999999997 109.322 173.593 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 16.5 t -82.11 96.82 7.91 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 114.587 -1.188 . . . . 74.120000000000005 110.167 -178.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -122.1 140.15 52.87 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.309 -0.405 . . . . 64.049999999999997 110.639 -179.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 1.4 m -66.57 -70.48 0.24 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.423 0.63 . . . . 51.240000000000002 110.706 -179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . 0.404 ' HA ' HD13 ' B' ' 121' ' ' LEU . 3.3 mm? -128.46 134.33 48.71 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 114.935 -1.03 . . . . 74.340000000000003 109.725 176.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -88.38 146.77 25.08 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 110.012 -0.366 . . . . 64.310000000000002 110.012 177.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 13.6 tt -79.06 -19.82 12.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.299 -0.41 . . . . 70.129999999999995 111.544 -175.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 14.4 m -87.36 100.52 12.78 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.984 0.421 . . . . 53.409999999999997 111.212 -175.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . 0.73 ' HD3' ' H ' ' B' ' 125' ' ' LYS . 0.3 OUTLIER -94.34 9.81 36.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.515 0.674 . . . . 51.32 109.594 172.394 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -79.32 130.7 35.71 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.291 -1.003 . . . . 60.020000000000003 108.291 173.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 127' ' ' TRP . . . . . 0.531 ' CZ2' HG12 ' A' ' 83' ' ' VAL . 29.0 t-105 -103.84 -93.16 0.34 Allowed 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.432 -0.507 . . . . 74.200000000000003 110.717 -173.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . 0.412 ' H ' ' HB3' ' B' ' 127' ' ' TRP . 41.8 m 52.25 24.12 2.69 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.01 0.433 . . . . 72.219999999999999 111.9 -179.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -80.81 83.26 6.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.245 -0.434 . . . . 74.140000000000001 110.913 -174.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 57.4 t -128.31 -64.12 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.945 -0.57 . . . . 53.299999999999997 110.859 -179.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 29.7 p90 -63.44 -20.7 65.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.588 -0.733 . . . . 73.439999999999998 111.569 -177.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.439 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 30.0 t30 -58.13 -54.55 45.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.855 -0.612 . . . . 70.400000000000006 111.079 -179.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 133' ' ' ILE . . . . . 0.714 HG21 ' HB3' ' A' ' 79' ' ' LEU . 4.1 mp -62.0 -40.57 87.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.138 0.494 . . . . 73.409999999999997 110.651 -177.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 89.9 mt -64.27 -31.38 72.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.928 -0.578 . . . . 64.340000000000003 111.142 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 54.2 ttt-85 -70.52 -45.02 66.36 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.113 0.482 . . . . 72.010000000000005 110.359 177.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 136' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 14.6 mm-40 -66.25 -33.08 74.94 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.587 -0.733 . . . . 73.120000000000005 111.58 -176.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -100.22 7.99 44.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.707 0.289 . . . . 74.430000000000007 111.22 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 56.16 68.16 0.9 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.718 -0.673 . . . . 73.140000000000001 112.639 175.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 139' ' ' PHE . . . . . 0.432 ' O ' ' HB2' ' A' ' 51' ' ' PHE . 11.4 m-85 -97.96 1.86 48.4 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.996 -0.547 . . . . 75.150000000000006 110.377 173.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 66.81 71.57 0.44 Allowed Pre-proline 0 CA--C 1.534 0.362 0 O-C-N 123.886 0.741 . . . . 74.5 110.696 -178.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -74.18 160.3 42.7 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.648 2.232 . . . . 61.119999999999997 111.689 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 142' ' ' LYS . . . . . 0.442 ' HB3' ' H ' ' B' ' 143' ' ' PHE . 11.4 mptt -108.36 -156.23 0.58 Allowed 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.151 0.426 . . . . 71.310000000000002 112.151 -176.109 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 143' ' ' PHE . . . . . 0.442 ' H ' ' HB3' ' B' ' 142' ' ' LYS . 17.7 m-85 -50.4 123.23 8.23 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.308 -0.86 . . . . 74.219999999999999 112.343 -171.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -83.88 57.22 4.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.954 -0.566 . . . . 72.25 109.636 174.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 8.2 t 68.71 8.76 6.94 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.133 -0.94 . . . . 74.420000000000002 110.738 -176.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -103.21 108.64 19.92 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.736 -0.665 . . . . 65.340000000000003 109.442 177.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 147' ' ' VAL . . . . . 0.451 ' CG1' ' HA ' ' A' ' 45' ' ' CYS . 5.9 p -148.25 162.46 6.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 C-N-CA 120.909 -0.316 . . . . 74.120000000000005 110.566 -174.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -95.09 150.57 20.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.206 0.527 . . . . 54.439999999999998 110.648 -177.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.573 HD11 ' HB3' ' A' ' 31' ' ' PHE . 23.5 tp -98.2 15.11 25.43 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.402 -0.817 . . . . 74.439999999999998 109.02 172.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.706 ' HB2' HG22 ' B' ' 159' ' ' THR . . . -34.61 104.11 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 O-C-N 124.317 1.011 . . . . 65.140000000000001 113.242 -173.29 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 151' ' ' PHE . . . . . 0.576 ' HB3' ' HA ' ' A' ' 41' ' ' PRO . 50.5 p90 -119.04 174.23 6.43 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 114.921 -1.036 . . . . 73.549999999999997 109.543 -177.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -100.56 123.45 44.79 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.146 0.498 . . . . 70.409999999999997 111.578 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 153' ' ' CYS . . . . . 0.553 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 49.8 t -124.8 116.59 22.53 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.399 -0.819 . . . . 74.5 109.229 174.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 63.29 17.58 10.36 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.462 -0.335 . . . . 72.040000000000006 111.469 178.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 110.44 -29.59 8.96 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.641 -0.79 . . . . 73.200000000000003 112.714 178.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 156' ' ' GLU . . . . . 0.637 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 12.7 pt-20 -93.79 146.66 23.71 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.051 0.453 . . . . 64.150000000000006 110.677 -177.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.7 mm -85.06 120.17 35.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.227 -0.442 . . . . 61.409999999999997 110.162 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 158' ' ' LYS . . . . . 0.637 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 28.4 mmmt -102.54 120.03 39.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.458 -0.337 . . . . 74.310000000000002 110.267 -178.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . 0.706 HG22 ' HB2' ' B' ' 150' ' ' ALA . 2.5 p -95.69 110.52 22.64 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.118 -0.492 . . . . 61.420000000000002 112.164 -176.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 160' ' ' PHE . . . . . 0.588 ' CD2' HD13 ' B' ' 166' ' ' LEU . 61.5 m-85 -132.65 151.94 51.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.709 -0.678 . . . . 73.040000000000006 110.192 176.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 13.2 p -134.03 14.11 3.92 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.049 -0.523 . . . . 71.400000000000006 110.006 176.154 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -146.96 144.59 29.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.757 -0.656 . . . . 74.019999999999996 110.598 -176.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . 0.447 HD13 ' O ' ' B' ' 163' ' ' LEU . 2.6 tm? -78.19 -34.28 49.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.456 . . . . 75.519999999999996 110.679 -175.304 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -67.17 -46.77 73.0 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.688 0.28 . . . . 74.030000000000001 110.496 -178.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 41.8 m -61.42 -39.12 89.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.359 -0.382 . . . . 62.520000000000003 110.86 177.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . 0.588 HD13 ' CD2' ' B' ' 160' ' ' PHE . 62.5 tp -71.47 -31.83 67.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.423 -0.353 . . . . 71.340000000000003 110.858 179.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 21.5 ttm180 -57.5 -39.35 76.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.356 -0.384 . . . . 74.310000000000002 110.543 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -60.11 -51.95 67.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.942 -0.572 . . . . 75.219999999999999 110.591 177.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 169' ' ' PHE . . . . . 0.434 ' CZ ' ' HE2' ' B' ' 158' ' ' LYS . 73.9 t80 -66.16 -43.6 86.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.261 -0.881 . . . . 74.319999999999993 111.074 -176.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -59.9 -40.89 90.3 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.121 -0.491 . . . . 63.149999999999999 111.977 -177.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 12.8 t -78.54 -21.32 48.95 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.759 0.281 . . . . 73.030000000000001 111.759 -174.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -93.96 -13.53 26.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.193 0.521 . . . . 72.109999999999999 110.617 179.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 173' ' ' LYS . . . . . 0.553 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 27.7 mmmt -88.59 117.16 27.35 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.042 -0.526 . . . . 75.109999999999999 110.28 176.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 1.5 m -51.42 -46.26 62.89 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 123.449 0.468 . . . . 62.020000000000003 110.96 -179.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 5.4 m -67.26 -43.87 80.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.897 -0.592 . . . . 63.520000000000003 111.556 -179.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.429 ' HA ' HD12 ' B' ' 179' ' ' LEU . 73.5 mtp -80.09 -22.39 42.27 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.779 0.323 . . . . 73.519999999999996 111.712 -174.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . 0.455 ' HE2' ' HB3' ' B' ' 177' ' ' LYS . 33.8 ttpt -58.37 -38.94 78.28 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.02 -0.536 . . . . 75.450000000000003 110.851 -177.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -86.1 -3.23 58.91 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.644 0.735 . . . . 63.450000000000003 110.063 -174.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 179' ' ' LEU . . . . . 0.551 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 78.1 mt -94.48 -42.13 9.01 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 114.89 -1.05 . . . . 74.239999999999995 109.667 179.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 180' ' ' LEU . . . . . 0.631 ' HB3' HD13 ' B' ' 184' ' ' LEU . 4.0 mm? -96.38 -9.84 29.04 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.608 -0.724 . . . . 54.219999999999999 111.929 -176.29 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 181' ' ' LYS . . . . . 0.44 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 65.5 pttt -55.52 -17.61 5.7 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.838 0.681 . . . . 51.100000000000001 112.838 -177.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -70.9 -38.53 73.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.859 0.361 . . . . 43.229999999999997 110.687 179.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 183' ' ' VAL . . . . . 0.407 HG21 ' ND2' ' A' ' 29' ' ' ASN . 31.5 m -107.67 -10.35 10.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.259 -0.428 . . . . 54.43 111.365 -176.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 184' ' ' LEU . . . . . 0.631 HD13 ' HB3' ' B' ' 180' ' ' LEU . 9.3 mp -99.6 147.21 33.06 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.272 -0.422 . . . . 64.239999999999995 110.316 177.498 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -69.2 96.24 0.54 Allowed 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 122.576 2.184 . . . . 52.420000000000002 112.413 178.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 -116.85 133.63 55.77 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.889 -0.782 . . . . 73.420000000000002 108.889 178.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -104.52 -52.25 2.93 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.101 -0.499 . . . . 73.239999999999995 111.238 -173.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 . . . . . 0 C--O 1.245 0.841 0 CA-C-O 118.217 -0.897 . . . . 71.310000000000002 110.287 -178.612 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.657 0 N-CA-C 111.593 -0.603 . . . . 53.020000000000003 111.593 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.7 p -126.44 -22.8 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 121.354 0.597 . . . . 70.010000000000005 109.824 177.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 88.0 mt -102.74 -174.83 2.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.602 -0.726 . . . . 74.030000000000001 109.926 177.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 19.3 ptp -130.19 80.63 1.96 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.575 0.702 . . . . 74.030000000000001 110.419 176.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -94.68 132.07 39.8 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.602 -0.726 . . . . 65.040000000000006 109.983 176.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -123.63 136.3 54.42 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.931 -0.577 . . . . 72.230000000000004 109.72 179.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -92.12 -152.85 29.24 Favored Glycine 0 N--CA 1.44 -1.039 0 C-N-CA 120.536 -0.84 . . . . 71.439999999999998 111.907 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -161.65 169.41 21.63 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 110.262 -0.273 . . . . 75.319999999999993 110.262 -177.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 61.7 t -76.61 115.43 18.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.165 -0.47 . . . . 74.219999999999999 109.829 175.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.708 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.7 OUTLIER -90.4 106.96 18.85 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.115 0.484 . . . . 70.219999999999999 110.567 -178.573 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 31.8 m -144.4 112.57 6.4 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.139 -0.482 . . . . 74.540000000000006 110.231 178.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 31.5 tp -78.37 127.98 32.98 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.287 -0.415 . . . . 75.340000000000003 110.817 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.751 ' CB ' ' HA ' ' A' ' 17' ' ' SER . . . 58.23 55.25 5.21 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 115.19 -0.914 . . . . 71.010000000000005 112.452 174.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.41 ' O ' ' HB3' ' A' ' 15' ' ' ASP . . . -80.98 90.68 5.97 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 115.65 -0.705 . . . . 75.400000000000006 109.855 173.107 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.41 ' HB3' ' O ' ' A' ' 14' ' ' ALA . 25.1 t70 78.31 -47.09 0.44 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.876 -1.057 . . . . 64.450000000000003 111.664 174.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.6 mt -76.89 -32.89 57.75 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.867 0.365 . . . . 75.329999999999998 111.008 -178.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.751 ' HA ' ' CB ' ' A' ' 13' ' ' ALA . 17.4 m 56.61 36.04 27.02 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.602 -0.727 . . . . 63.219999999999999 111.356 -177.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.3 t 60.33 101.7 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.739 -1.118 . . . . 53.409999999999997 111.136 -174.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.51 -13.19 49.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.251 0.548 . . . . 33.409999999999997 110.017 177.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 23.8 m -78.35 144.67 35.79 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.494 -0.776 . . . . 74.140000000000001 110.029 176.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 21' ' ' LEU . 4.1 mm? -69.22 116.53 9.76 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.995 0.426 . . . . 74.430000000000007 110.856 -178.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -70.18 134.06 47.72 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.679 -0.691 . . . . 63.25 110.721 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 13.9 tt -82.14 135.06 25.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.139 -0.482 . . . . 72.420000000000002 110.719 -178.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.2 m -60.97 126.32 26.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.951 -0.568 . . . . 70.129999999999995 110.914 179.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.571 ' HD2' ' H ' ' A' ' 25' ' ' LYS . 2.2 mptp? -87.41 1.88 52.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.071 0.462 . . . . 32.32 110.114 -178.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -63.79 132.98 52.59 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.364 -0.835 . . . . 74.420000000000002 110.253 -176.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -86.18 84.98 7.35 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.731 -0.668 . . . . 71.109999999999999 111.538 -172.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.6 m 53.8 69.41 0.71 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.612 -0.722 . . . . 64.099999999999994 111.235 176.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -97.05 17.07 17.84 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.772 -0.649 . . . . 72.409999999999997 110.119 -176.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 17.0 m -59.17 130.97 23.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.624 -0.716 . . . . 75.230000000000004 110.947 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.47 ' HB2' ' HB3' ' A' ' 41' ' ' PRO . 22.6 p90 51.42 12.01 0.14 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.77 1.228 . . . . 62.219999999999999 113.918 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.486 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 9.4 t30 -66.35 -53.09 40.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.878 0.37 . . . . 71.109999999999999 110.307 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.564 HG21 ' HB3' ' B' ' 179' ' ' LEU . 45.8 mm -58.07 -43.7 85.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.87 -0.604 . . . . 63.149999999999999 110.616 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.657 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 64.7 mt -60.3 -42.06 94.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.695 -0.684 . . . . 73.349999999999994 111.252 179.358 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -64.61 -42.43 95.54 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.408 -0.36 . . . . 75.400000000000006 110.185 -179.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 38.8 mm-40 -65.75 -32.81 74.56 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.257 -0.429 . . . . 72.540000000000006 111.32 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -99.67 7.16 45.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.947 0.403 . . . . 54.350000000000001 111.064 -178.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 56.65 54.63 7.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.433 -0.803 . . . . 75.400000000000006 112.278 177.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.657 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 7.9 m-85 -84.45 -7.94 59.12 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.13 -0.693 . . . . 73.200000000000003 109.13 168.271 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 64.15 88.14 0.12 Allowed Pre-proline 0 N--CA 1.455 -0.18 0 CA-C-N 114.633 -1.167 . . . . 72.120000000000005 111.685 179.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.47 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 51.1 Cg_endo -70.28 148.36 61.51 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.56 2.174 . . . . 75.420000000000002 111.362 175.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.633 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 3.6 tptp -85.85 -177.25 6.3 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 119.848 -0.741 . . . . 74.409999999999997 110.846 -179.306 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.677 ' HA ' HG11 ' B' ' 147' ' ' VAL . 12.7 t80 177.83 -33.23 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.847 -0.615 . . . . 52.450000000000003 110.059 -167.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.24 106.76 0.19 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.356 -0.838 . . . . 53.439999999999998 109.403 178.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.411 ' HB2' ' HB ' ' B' ' 147' ' ' VAL . 1.7 t -163.84 175.28 10.59 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.754 -0.832 . . . . 75.120000000000005 108.754 -173.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.504 ' H ' ' CD ' ' A' ' 46' ' ' GLU . 0.1 OUTLIER -86.57 53.73 2.91 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.657 0.741 . . . . 72.109999999999999 109.861 176.608 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.514 HG22 ' HB3' ' B' ' 145' ' ' CYS . 57.3 t -61.11 139.45 20.38 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 CA-C-N 115.217 -0.901 . . . . 75.450000000000003 109.466 176.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.586 ' O ' ' HB3' ' B' ' 142' ' ' LYS . 3.8 mptt -72.65 164.16 26.94 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 109.099 -0.704 . . . . 73.340000000000003 109.099 178.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.786 HD21 HD12 ' B' ' 134' ' ' LEU . 46.2 tp -111.26 78.87 1.15 Allowed 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 109.225 -0.657 . . . . 74.200000000000003 109.225 169.501 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.867 ' H ' ' HB2' ' B' ' 142' ' ' LYS . . . -90.95 83.33 5.64 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.196 -0.911 . . . . 74.209999999999994 109.506 176.051 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.538 ' HD1' ' HG ' ' A' ' 49' ' ' LEU . 31.2 p90 -103.53 170.94 7.64 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.427 -0.806 . . . . 65.530000000000001 109.732 -178.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -98.24 127.51 44.22 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 120.324 -0.55 . . . . 71.329999999999998 110.177 177.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.5 ' SG ' ' HE2' ' A' ' 69' ' ' PHE . 29.8 t -133.5 108.81 8.86 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.895 -0.593 . . . . 72.040000000000006 109.567 175.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 70.82 27.06 3.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.321 -0.854 . . . . 52.32 110.627 176.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 103.68 -36.48 4.32 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.482 -0.866 . . . . 71.340000000000003 112.771 177.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.469 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 10.7 pt-20 -91.77 148.95 21.86 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.211 0.529 . . . . 75.230000000000004 110.673 -178.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 50.7 mm -86.16 127.27 40.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.481 -0.781 . . . . 65.030000000000001 109.652 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.68 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 29.2 mmmt -112.58 128.26 56.31 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.421 -0.354 . . . . 55.32 110.331 -176.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.33 109.37 21.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.007 0.432 . . . . 70.239999999999995 111.189 179.15 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.68 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 35.5 m-85 -118.82 148.4 42.9 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.129 -0.487 . . . . 73.530000000000001 110.472 178.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 11.7 p -138.17 6.58 2.6 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.184 -0.462 . . . . 43.229999999999997 110.939 176.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -142.43 144.01 32.88 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.879 -0.415 . . . . 73.409999999999997 109.879 179.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.472 HD13 ' O ' ' A' ' 63' ' ' LEU . 1.4 tm? -72.11 -32.33 66.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.25 -0.432 . . . . 72.219999999999999 110.244 -179.355 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.43 ' NE2' HH21 ' A' ' 67' ' ' ARG . 7.0 tp60 -64.8 -44.98 88.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.97 0.414 . . . . 50.310000000000002 110.355 -178.066 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.4 m -64.69 -38.32 90.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.789 -0.641 . . . . 62.020000000000003 110.181 178.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.484 ' HA ' ' CE2' ' A' ' 60' ' ' PHE . 47.3 tp -70.83 -36.17 72.78 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.764 -0.653 . . . . 73.430000000000007 111.178 -177.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.43 HH21 ' NE2' ' A' ' 64' ' ' GLN . 56.8 ttp85 -54.48 -45.62 73.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.09 0.471 . . . . 72.420000000000002 111.2 178.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 39.0 mtmt -66.23 -38.6 88.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.983 -0.553 . . . . 72.239999999999995 111.076 -176.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.5 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 55.8 t80 -74.44 -39.32 62.64 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.239 0.542 . . . . 73.230000000000004 110.443 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.69 -23.89 66.18 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.013 -0.539 . . . . 73.400000000000006 111.449 179.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.1 t -74.94 -38.84 61.66 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.522 -0.308 . . . . 73.129999999999995 111.128 -179.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 20.6 pt20 -74.8 -28.2 60.62 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.006 0.431 . . . . 55.130000000000003 110.237 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.435 ' HB3' ' HE3' ' A' ' 73' ' ' LYS . 25.8 mmmt -79.23 109.9 13.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.942 -0.572 . . . . 73.109999999999999 110.68 176.192 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.5 p -61.53 -29.75 70.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.376 -0.374 . . . . 71.209999999999994 111.737 -176.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.7 p -76.4 -45.57 31.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.951 0.405 . . . . 63.219999999999999 110.973 178.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 81.2 mtp -71.42 -26.32 62.7 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.34 -0.391 . . . . 51.439999999999998 110.634 -178.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.536 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 26.1 ttpp -56.44 -29.3 61.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.906 -0.588 . . . . 74.540000000000006 111.081 177.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -96.36 -4.69 41.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.292 0.568 . . . . 73.140000000000001 110.641 -176.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.596 ' HB3' ' CG2' ' B' ' 133' ' ' ILE . 84.3 mt -91.97 -46.95 7.55 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.314 -0.857 . . . . 64.219999999999999 109.421 177.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.78 -11.6 53.12 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.318 -0.856 . . . . 53.240000000000002 111.693 -177.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.536 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 62.6 pttt -60.17 -18.59 49.04 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.372 0.508 . . . . 72.409999999999997 112.372 -177.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.53 -44.53 86.58 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.128 0.489 . . . . 61.450000000000003 110.399 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.592 HG11 ' ND2' ' B' ' 129' ' ' ASN . 23.1 m -98.46 -11.1 8.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.83 -0.623 . . . . 71.540000000000006 111.107 -177.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.9 mt -110.0 94.26 17.22 Favored Pre-proline 0 C--N 1.325 -0.497 0 N-CA-C 109.334 -0.617 . . . . 72.430000000000007 109.334 174.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -69.01 104.2 1.16 Allowed 'Trans proline' 0 C--O 1.235 0.334 0 C-N-CA 122.804 2.336 . . . . 72.150000000000006 112.168 -178.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -90.39 86.44 6.46 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.342 0.592 . . . . 73.420000000000002 111.676 -175.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 52.8 mttp -104.9 -56.92 2.1 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.492 -0.776 . . . . 50.32 109.325 169.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 . . . . . 0 C--N 1.324 -0.529 0 CA-C-N 115.701 -0.682 . . . . 75.409999999999997 110.461 179.112 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 N-CA-C 111.969 -0.453 . . . . 75.239999999999995 111.969 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 27.9 m -90.8 2.41 7.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.035 0.445 . . . . 63.350000000000001 111.007 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 85.0 mt -95.36 108.63 20.83 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.901 -0.59 . . . . 63.340000000000003 109.613 177.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 19.0 ptp -82.13 79.96 8.49 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.614 0.721 . . . . 64.150000000000006 111.841 -174.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -176.91 124.12 0.15 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.069 -0.969 . . . . 75.019999999999996 109.814 176.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -90.79 123.07 34.06 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.175 -0.466 . . . . 71.209999999999994 110.145 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -81.74 95.85 1.74 Allowed Glycine 0 N--CA 1.442 -0.958 0 CA-C-N 115.836 -0.62 . . . . 61.32 112.178 -176.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -82.91 158.59 22.58 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 110.041 -0.355 . . . . 60.509999999999998 110.041 176.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 30.6 m -81.3 147.09 6.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-O 120.825 0.345 . . . . 73.319999999999993 110.639 179.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 110' ' ' LEU . . . . . 0.742 ' H ' HD23 ' B' ' 110' ' ' LEU . 2.5 pt? -94.54 131.59 40.11 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.179 0.514 . . . . 73.150000000000006 110.713 -177.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 24.6 m -103.46 112.41 25.3 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.024 -0.534 . . . . 74.439999999999998 109.814 176.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 40.7 tp -67.21 115.08 6.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.166 -0.47 . . . . 72.209999999999994 110.327 176.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . 56.35 -152.39 0.38 Allowed 'General case' 0 C--N 1.331 -0.234 0 O-C-N 123.89 0.744 . . . . 70.25 110.959 -179.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -175.23 -62.2 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.635 -0.876 . . . . 72.450000000000003 108.635 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -153.99 29.53 0.46 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.141 -0.936 . . . . 75.129999999999995 108.768 173.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 99.7 mt -137.94 -8.99 1.58 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.205 -0.907 . . . . 72.239999999999995 111.392 -177.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 42.4 m 56.87 25.56 10.59 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.106 0.563 . . . . 61.509999999999998 112.301 -176.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 49.1 m 65.87 139.59 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.526 0.679 . . . . 44.210000000000001 112.509 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -95.23 10.92 34.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.958 -0.564 . . . . 53.039999999999999 110.367 178.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 15.0 m -96.73 135.58 38.46 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.795 -0.639 . . . . 64.219999999999999 110.668 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -86.86 136.13 33.08 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.918 0.39 . . . . 65.010000000000005 110.635 178.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.82 146.1 54.79 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.788 -0.642 . . . . 71.019999999999996 111.35 -178.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 13.1 tt -91.08 133.06 33.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 109.931 -0.396 . . . . 63.140000000000001 109.931 176.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 13.2 m -66.89 115.7 6.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.417 -0.356 . . . . 70.329999999999998 111.528 -174.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . 0.495 ' HD2' ' H ' ' B' ' 125' ' ' LYS . 1.5 mptp? -83.82 -2.27 56.04 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.362 0.601 . . . . 62.219999999999999 109.841 177.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -92.68 97.38 10.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.437 -0.801 . . . . 73.140000000000001 110.168 -178.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 34.2 m95 -72.94 -45.88 55.63 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.663 -0.699 . . . . 75.219999999999999 110.449 -177.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 68.0 m -82.94 43.52 0.86 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.9 -0.591 . . . . 71.200000000000003 111.426 -176.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . 0.592 ' ND2' HG11 ' A' ' 83' ' ' VAL . 28.7 t-20 -102.88 -26.87 12.96 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.636 0.255 . . . . 70.040000000000006 110.602 176.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.417 HG12 ' CD2' ' B' ' 131' ' ' PHE . 32.8 t -57.47 117.05 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 73.129999999999995 110.692 -177.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 131' ' ' PHE . . . . . 0.51 ' HB3' HD22 ' A' ' 49' ' ' LEU . 22.1 p90 52.67 10.63 0.15 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.955 1.302 . . . . 54.520000000000003 113.426 -178.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.472 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 8.9 t30 -69.98 -44.31 69.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.522 0.201 . . . . 72.239999999999995 110.844 -177.296 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 133' ' ' ILE . . . . . 0.596 ' CG2' ' HB3' ' A' ' 79' ' ' LEU . 50.3 mm -58.24 -43.54 86.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.395 0.617 . . . . 64.310000000000002 110.414 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.786 HD12 HD21 ' A' ' 49' ' ' LEU . 61.1 mt -67.4 -29.98 69.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.616 -0.72 . . . . 53.240000000000002 110.711 178.194 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -71.82 -41.56 68.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.988 -0.551 . . . . 74.510000000000005 110.1 178.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 136' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 11.1 mm-40 -66.7 -37.17 84.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.922 -0.581 . . . . 74.239999999999995 111.461 179.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -96.42 -0.64 48.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.468 -0.333 . . . . 74.129999999999995 111.36 -176.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 38.4 t70 58.34 69.24 0.75 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.648 0.737 . . . . 65.420000000000002 112.043 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 139' ' ' PHE . . . . . 0.564 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 3.2 m-85 -97.54 7.34 46.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.529 -0.759 . . . . 70.25 109.501 170.745 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 140' ' ' GLU . . . . . 0.413 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 33.7 tt0 62.14 79.15 0.28 Allowed Pre-proline 0 C--N 1.332 -0.177 0 CA-C-N 114.61 -1.177 . . . . 74.549999999999997 111.046 -176.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.51 156.34 66.53 Favored 'Trans proline' 0 N--CA 1.464 -0.242 0 C-N-CA 122.388 2.059 . . . . 74.049999999999997 110.33 173.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 142' ' ' LYS . . . . . 0.867 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 23.3 tptt -83.2 174.32 10.87 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 119.296 -0.962 . . . . 73.319999999999993 110.548 -178.075 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 143' ' ' PHE . . . . . 0.471 ' HA ' HG11 ' A' ' 47' ' ' VAL . 58.2 t80 -168.36 -33.79 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.688 -0.687 . . . . 74.200000000000003 110.279 -170.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 56.7 tp -62.97 95.31 0.08 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.206 -0.906 . . . . 75.439999999999998 111.087 179.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 145' ' ' CYS . . . . . 0.514 ' HB3' HG22 ' A' ' 47' ' ' VAL . 49.1 t -154.79 159.13 40.4 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.734 -0.667 . . . . 53.310000000000002 109.29 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -90.15 81.45 6.15 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.433 0.635 . . . . 75.040000000000006 110.791 -177.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 147' ' ' VAL . . . . . 0.677 HG11 ' HA ' ' A' ' 43' ' ' PHE . 3.0 p -96.92 152.02 4.02 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.366 -0.834 . . . . 72.129999999999995 108.983 173.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . 0.508 ' HD2' ' H ' ' B' ' 148' ' ' LYS . 0.0 OUTLIER -81.86 132.29 35.27 Favored 'General case' 0 CA--C 1.509 -0.618 0 C-N-CA 120.006 -0.678 . . . . 63.409999999999997 109.341 -176.031 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.65 ' HG ' ' HD1' ' B' ' 151' ' ' PHE . 56.5 tp -75.11 83.52 2.32 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.263 0.554 . . . . 70.230000000000004 109.678 177.314 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.633 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -91.5 76.9 5.8 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.289 -0.869 . . . . 60.109999999999999 109.863 177.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 151' ' ' PHE . . . . . 0.65 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 42.3 p90 -94.01 167.87 11.32 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.52 -0.764 . . . . 73.310000000000002 110.323 -176.122 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -99.58 113.89 26.59 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 121.248 0.547 . . . . 61.240000000000002 110.66 179.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 153' ' ' CYS . . . . . 0.59 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 44.1 t -110.22 102.47 11.14 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.507 -0.769 . . . . 74.310000000000002 110.098 179.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 15.0 t70 68.91 17.93 8.59 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 115.545 -0.752 . . . . 73.010000000000005 111.234 175.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 122.26 -34.73 3.72 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.204 -0.998 . . . . 63.409999999999997 112.882 177.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -94.61 150.16 20.51 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.624 0.249 . . . . 64.109999999999999 110.611 -178.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.9 mm -84.23 131.39 34.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 109.899 -0.408 . . . . 74.049999999999997 109.899 175.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 158' ' ' LYS . . . . . 0.606 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 31.8 mmmt -120.98 129.81 53.57 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.032 -0.358 . . . . 74.349999999999994 110.032 178.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.83 107.14 17.88 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.102 0.477 . . . . 63.299999999999997 111.85 -176.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 160' ' ' PHE . . . . . 0.606 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 42.6 m-85 -120.47 135.54 55.03 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.18 -0.463 . . . . 75.319999999999993 110.78 178.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 31.4 p -120.7 10.12 10.92 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.103 0.478 . . . . 53.140000000000001 110.461 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -144.2 138.76 28.29 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.829 -0.623 . . . . 73.420000000000002 110.543 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . 0.409 HD22 ' HA ' ' B' ' 163' ' ' LEU . 1.8 tm? -74.77 -39.31 61.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.864 -0.607 . . . . 63.509999999999998 110.275 -176.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -60.8 -45.67 93.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.086 0.469 . . . . 61.32 110.64 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . 0.578 ' HA ' ' HE2' ' B' ' 168' ' ' LYS . 23.8 m -60.71 -38.21 84.29 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.815 -0.629 . . . . 73.230000000000004 110.63 176.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 53.3 tp -70.55 -32.08 69.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.093 -0.503 . . . . 70.109999999999999 111.091 -178.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -59.45 -38.27 80.29 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.666 0.27 . . . . 71.329999999999998 110.504 177.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 168' ' ' LYS . . . . . 0.578 ' HE2' ' HA ' ' B' ' 165' ' ' SER . 56.9 mtmt -61.6 -46.58 89.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.274 0.559 . . . . 63.140000000000001 110.588 177.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 169' ' ' PHE . . . . . 0.518 ' O ' ' HG2' ' B' ' 172' ' ' GLN . 66.9 t80 -66.67 -43.41 84.57 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.406 -0.816 . . . . 72.530000000000001 110.327 -179.465 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -60.8 -36.13 78.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.002 -0.545 . . . . 74.430000000000007 111.2 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 45.3 m -74.62 -22.25 59.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.487 -0.324 . . . . 65.439999999999998 111.849 -176.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . 0.518 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 13.7 pt20 -95.54 -7.73 37.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.091 0.472 . . . . 70.549999999999997 110.454 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 173' ' ' LYS . . . . . 0.59 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 30.1 mmmt -96.86 119.56 35.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.858 -0.61 . . . . 72.540000000000006 110.138 179.18 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 24.1 m -56.51 -37.59 70.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.99 0.424 . . . . 64.239999999999995 110.805 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 11.2 p -76.02 -49.83 16.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.678 -0.692 . . . . 73.519999999999996 111.521 -178.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.519 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 81.1 mtp -74.57 -22.3 59.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.092 -0.504 . . . . 74.340000000000003 111.996 -173.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -62.63 -25.91 68.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.136 0.493 . . . . 63.409999999999997 111.014 -178.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -103.27 8.31 38.33 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.612 0.72 . . . . 74.450000000000003 110.544 -177.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 179' ' ' LEU . . . . . 0.564 ' HB3' HG21 ' A' ' 33' ' ' ILE . 97.3 mt -103.31 -49.36 3.74 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.049 -0.978 . . . . 74.439999999999998 110.28 176.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 180' ' ' LEU . . . . . 0.528 ' HB3' HD12 ' B' ' 184' ' ' LEU . 4.0 mm? -85.05 -17.91 35.97 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.671 -0.695 . . . . 72.140000000000001 112.312 -174.1 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 59.2 pttt -64.26 -20.55 66.13 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.69 0.281 . . . . 73.340000000000003 111.665 -174.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -67.92 -47.99 67.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.977 0.418 . . . . 74.120000000000005 110.548 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 183' ' ' VAL . . . . . 0.439 HG23 ' HG ' ' B' ' 184' ' ' LEU . 31.4 m -91.82 -21.58 6.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.955 -0.566 . . . . 71.340000000000003 111.279 -177.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 184' ' ' LEU . . . . . 0.528 HD12 ' HB3' ' B' ' 180' ' ' LEU . 87.7 mt -110.08 101.91 49.1 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 109.147 -0.686 . . . . 62.420000000000002 109.147 176.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.06 109.17 0.34 Allowed 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 123.226 2.617 . . . . 42.049999999999997 112.84 -174.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -120.16 96.27 5.09 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.855 -0.611 . . . . 63.299999999999997 110.33 176.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -106.15 -58.26 1.94 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.153 -0.684 . . . . 62.100000000000001 109.153 175.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 . . . . . 0 C--O 1.245 0.83 0 CA-C-N 115.386 -0.825 . . . . 53.149999999999999 109.604 178.869 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.544 0 N-CA-C 112.363 -0.295 . . . . 64.450000000000003 112.363 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.512 HG22 HD22 ' A' ' 3' ' ' LEU . 7.3 p -73.12 -38.54 55.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.69 -0.485 . . . . 61.140000000000001 109.69 176.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.512 HD22 HG22 ' A' ' 2' ' ' VAL . 2.9 mm? -128.0 103.63 7.34 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.598 -0.89 . . . . 73.239999999999995 108.598 171.405 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 80.5 mtp -80.97 -64.4 1.2 Allowed 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.198 -0.456 . . . . 72.310000000000002 110.837 -173.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -125.3 161.47 26.88 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.183 -0.462 . . . . 72.230000000000004 110.275 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -164.76 102.01 0.79 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.433 -0.58 . . . . 41.340000000000003 109.433 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -148.04 99.75 0.2 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.66 -0.781 . . . . 62.299999999999997 112.747 -177.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -86.78 118.0 25.9 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.727 0.298 . . . . 31.43 110.706 178.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.9 t -90.92 127.1 43.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 120.79 0.328 . . . . 73.140000000000001 110.769 -178.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -88.27 143.64 26.91 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.508 -0.553 . . . . 63.530000000000001 109.508 176.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 60.9 m -152.53 126.46 9.04 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.804 0.335 . . . . 64.349999999999994 111.483 -178.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.424 HD23 ' H ' ' A' ' 13' ' ' ALA . 0.5 OUTLIER -150.23 148.15 28.55 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.408 -0.59 . . . . 73.420000000000002 109.408 176.328 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.435 ' HB3' ' CB ' ' A' ' 17' ' ' SER . . . -94.63 116.67 29.04 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.822 0.344 . . . . 73.049999999999997 110.354 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.486 ' O ' ' HB2' ' A' ' 18' ' ' SER . . . -69.18 -57.38 5.45 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.945 -0.571 . . . . 62.329999999999998 111.966 -176.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -99.72 -22.1 15.52 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.905 -0.318 . . . . 74.120000000000005 111.419 -173.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 75.7 mt -96.85 15.78 21.14 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.036 0.384 . . . . 70.329999999999998 112.036 -176.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.435 ' CB ' ' HB3' ' A' ' 13' ' ' ALA . 15.1 t -160.23 -52.65 0.05 Allowed 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 121.097 -0.241 . . . . 70.439999999999998 110.974 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.881 ' HB3' ' HE3' ' B' ' 177' ' ' LYS . 30.0 m -74.42 113.14 11.31 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.038 0.447 . . . . 63.520000000000003 112.145 -176.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -155.9 -151.2 0.33 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.738 -0.664 . . . . 53.219999999999999 109.395 175.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.1 m -152.37 96.75 2.2 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.631 -0.507 . . . . 54.219999999999999 109.631 172.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 66.8 mt -105.3 -37.63 6.79 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.116 -0.493 . . . . 75.349999999999994 111.921 -176.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -104.14 175.3 5.53 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.659 -0.701 . . . . 71.510000000000005 110.418 -174.089 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 5.6 tp -106.58 118.02 53.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.477 0.656 . . . . 73.310000000000002 111.384 -176.114 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.473 ' HB3' ' HA ' ' B' ' 184' ' ' LEU . 5.4 m -65.25 138.98 58.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.555 -0.748 . . . . 70.420000000000002 110.452 177.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.511 ' HD2' ' N ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -118.83 13.47 13.18 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.438 0.533 . . . . 75.340000000000003 112.438 -174.522 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.586 ' HB2' ' O ' ' B' ' 183' ' ' VAL . 2.8 mp0 -99.49 146.12 26.72 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.818 -0.438 . . . . 72.519999999999996 109.818 176.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 12.6 t-105 -115.93 12.17 15.67 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.212 0.449 . . . . 63.439999999999998 112.212 -170.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.4 p -81.78 32.68 0.37 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.348 0.594 . . . . 73.430000000000007 111.46 -177.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -90.57 1.26 56.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.964 -0.562 . . . . 73.420000000000002 110.132 -174.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.0 m -71.15 83.54 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 112.355 0.502 . . . . 70.219999999999999 112.355 -177.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.604 ' HB3' HD13 ' B' ' 149' ' ' LEU . 36.0 p90 48.89 12.28 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 125.223 1.409 . . . . 75.329999999999998 114.549 175.265 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -67.28 -57.17 7.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.839 0.352 . . . . 75.010000000000005 111.618 -175.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.498 HG21 ' HB3' ' B' ' 179' ' ' LEU . 48.7 mm -62.38 -37.81 79.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.367 0.603 . . . . 73.030000000000001 111.136 -177.245 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.4 mt -59.2 -33.15 70.62 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.332 -0.849 . . . . 64.510000000000005 111.551 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 51.4 ttt180 -68.56 -46.87 68.33 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.07 0.462 . . . . 71.219999999999999 110.406 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -69.04 -27.68 65.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.396 -0.82 . . . . 75.439999999999998 111.645 -173.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -106.61 6.83 30.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.548 -0.296 . . . . 71.340000000000003 111.19 -177.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.2 t70 58.55 69.89 0.69 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 115.494 -0.776 . . . . 75.530000000000001 111.919 175.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -98.76 3.13 47.48 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.697 -0.683 . . . . 74.420000000000002 111.037 172.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 58.02 71.37 1.06 Allowed Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 115.943 -0.571 . . . . 73.409999999999997 110.783 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -87.31 166.7 7.92 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.616 2.211 . . . . 61.520000000000003 112.505 -178.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.779 ' HB2' ' HA ' ' B' ' 149' ' ' LEU . 0.2 OUTLIER -105.93 -167.12 1.27 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.333 -0.394 . . . . 73.209999999999994 110.413 177.319 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 32.6 p90 -132.61 179.11 6.34 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.251 0.463 . . . . 74.109999999999999 112.251 -170.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.632 ' HA ' HG11 ' B' ' 147' ' ' VAL . 3.3 mm? -97.92 142.21 29.94 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.218 -1.03 . . . . 73.219999999999999 108.218 169.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 11.6 t -130.95 -151.68 0.48 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.772 0.32 . . . . 74.209999999999994 110.735 -170.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -135.86 144.44 45.62 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 109.101 -0.703 . . . . 73.540000000000006 109.101 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.769 HG11 HD13 ' B' ' 144' ' ' LEU . 1.9 t -91.88 129.26 42.81 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-O 121.516 0.674 . . . . 73.530000000000001 110.106 172.189 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.448 ' HD2' ' O ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -128.66 129.21 45.52 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.995 -1.002 . . . . 53.140000000000001 109.59 178.226 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.79 ' HA ' ' HB2' ' B' ' 142' ' ' LYS . 0.2 OUTLIER -75.71 90.96 2.87 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 120.492 -0.483 . . . . 75.409999999999997 109.815 178.21 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.16 90.58 1.58 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.506 -0.77 . . . . 62.210000000000001 109.348 173.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.437 ' HA ' ' O ' ' B' ' 140' ' ' GLU . 53.9 p90 -107.16 166.84 10.33 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.525 -0.761 . . . . 63.229999999999997 110.514 -177.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.82 ' HE2' ' HA2' ' A' ' 55' ' ' GLY . 82.3 tttt -105.93 113.0 26.28 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.628 -0.715 . . . . 72.030000000000001 109.928 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.619 ' SG ' ' HE3' ' A' ' 73' ' ' LYS . 53.6 t -100.13 93.54 5.77 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.9 -0.591 . . . . 62.32 110.032 -179.248 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.9 t70 70.91 -9.09 0.87 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.664 0.745 . . . . 74.519999999999996 111.609 176.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.82 ' HA2' ' HE2' ' A' ' 52' ' ' LYS . . . 150.39 -27.25 1.09 Allowed Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.677 -0.692 . . . . 64.010000000000005 112.276 -178.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 53' ' ' CYS . 11.7 pt-20 -91.88 130.06 37.72 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.743 0.306 . . . . 75.530000000000001 110.695 -179.055 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.6 mm -80.9 122.38 36.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.682 -0.488 . . . . 74.209999999999994 109.682 177.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.598 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 30.6 mmmt -120.62 131.08 54.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.449 -0.342 . . . . 73.019999999999996 110.444 -177.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.1 p -101.09 113.73 27.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.068 0.461 . . . . 73.5 111.311 177.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.598 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 22.6 m-85 -120.85 139.48 53.11 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.892 -0.595 . . . . 71.340000000000003 110.825 178.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.4 t -120.85 -24.24 5.71 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.833 -0.803 . . . . 60.439999999999998 108.833 176.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -101.38 137.3 39.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.261 -0.881 . . . . 51.210000000000001 109.658 179.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.7 mt -83.25 -31.55 26.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.958 0.408 . . . . 64.140000000000001 110.701 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -69.39 -36.84 77.18 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.467 -0.333 . . . . 74.329999999999998 110.312 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.1 m -70.61 -32.71 70.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.032 0.444 . . . . 65.400000000000006 110.331 176.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.482 ' HA ' ' CE2' ' A' ' 60' ' ' PHE . 3.5 tm? -67.82 -42.16 81.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.719 -0.673 . . . . 62.409999999999997 109.721 177.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -33.6 70.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.466 -0.788 . . . . 74.530000000000001 110.128 -179.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -65.43 -47.84 74.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.651 -0.704 . . . . 70.439999999999998 111.057 176.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -63.35 -40.28 96.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.666 -0.697 . . . . 65.120000000000005 110.886 -175.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.8 -22.88 66.0 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.486 -0.325 . . . . 63.530000000000001 111.155 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.1 m -76.05 -20.73 57.5 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.302 -0.408 . . . . 73.540000000000006 111.673 -178.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -100.01 3.19 44.07 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.197 0.522 . . . . 75.409999999999997 110.724 178.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.619 ' HE3' ' SG ' ' A' ' 53' ' ' CYS . 70.6 mmtt -108.5 109.68 21.0 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.665 -0.698 . . . . 64.540000000000006 110.184 178.358 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.9 m -58.35 -32.41 68.51 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.823 0.344 . . . . 75.109999999999999 111.131 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.446 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 8.1 m -76.36 -37.96 56.52 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.304 -0.407 . . . . 71.409999999999997 111.251 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.578 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 77.4 mtp -86.35 -22.33 26.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.881 0.372 . . . . 71.040000000000006 111.566 -175.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -62.25 -30.0 70.8 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.994 -0.548 . . . . 62.439999999999998 111.981 -175.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -103.92 3.47 33.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.552 0.691 . . . . 72.329999999999998 110.319 -178.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 75' ' ' SER . 63.9 mt -86.52 -51.35 6.23 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.352 -0.84 . . . . 73.230000000000004 108.761 170.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.85 -7.66 56.98 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.88 -1.055 . . . . 73.0 111.393 -177.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.464 ' HB2' ' HE3' ' A' ' 81' ' ' LYS . 19.0 ptmt -57.85 -19.12 26.7 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.115 0.413 . . . . 71.329999999999998 112.115 -177.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -74.12 -43.77 56.31 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.998 -0.281 . . . . 62.009999999999998 110.773 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.438 ' O ' ' HB2' ' B' ' 126' ' ' GLN . 32.7 m -91.41 -20.16 6.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.084 0.469 . . . . 63.450000000000003 110.909 -179.441 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 40.9 mt -101.39 101.6 17.83 Favored Pre-proline 0 C--N 1.326 -0.453 0 N-CA-C 108.991 -0.744 . . . . 75.230000000000004 108.991 175.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -61.34 112.42 1.41 Allowed 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 123.086 2.524 . . . . 64.310000000000002 113.711 -171.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 -99.33 121.58 41.29 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 108.608 -0.886 . . . . 64.239999999999995 108.608 174.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.727 ' HD2' ' HB2' ' B' ' 122' ' ' ASP . 24.8 mtpt -61.78 -55.89 25.25 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.374 -0.83 . . . . 75.239999999999995 111.891 -171.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 . . . . . 0 C--N 1.324 -0.521 0 CA-C-N 116.65 -0.25 . . . . 75.430000000000007 110.501 -178.875 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 N-CA-C 111.973 -0.451 . . . . 43.140000000000001 111.973 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 8.2 p -135.76 137.81 48.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.897 0.38 . . . . 62.539999999999999 110.8 -179.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -80.21 101.37 8.81 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.354 -0.61 . . . . 74.010000000000005 109.354 176.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 87.6 mtp -87.92 -54.77 4.07 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.545 -0.752 . . . . 62.299999999999997 111.47 -174.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -94.19 173.41 7.66 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.399 0.619 . . . . 75.430000000000007 111.758 -173.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -136.65 128.38 28.96 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 107.811 -1.181 . . . . 75.129999999999995 107.811 177.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -143.17 86.45 0.18 Allowed Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.11 -1.043 . . . . 71.400000000000006 113.018 -174.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -105.32 94.7 5.36 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.74 -0.467 . . . . 54.539999999999999 109.74 173.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 46.9 t -110.84 111.51 36.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.988 -0.551 . . . . 74.329999999999998 110.316 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -91.59 104.27 16.77 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.242 -0.436 . . . . 64.299999999999997 110.225 -178.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 87.9 m -99.93 113.5 26.11 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.289 0.566 . . . . 74.310000000000002 111.115 -179.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 1.4 tt -141.02 140.43 34.3 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.639 -1.245 . . . . 74.420000000000002 107.639 175.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 113' ' ' ALA . . . . . 0.768 ' HB1' ' HB2' ' B' ' 116' ' ' LEU . . . -62.29 108.67 1.13 Allowed 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 121.079 -0.249 . . . . 34.219999999999999 110.449 177.596 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.97 97.04 0.15 Allowed 'General case' 0 C--N 1.323 -0.547 0 O-C-N 123.45 0.469 . . . . 31.34 111.017 -177.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 31.8 t70 84.48 -21.91 0.23 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.355 -1.293 . . . . 75.239999999999995 110.887 170.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.768 ' HB2' ' HB1' ' B' ' 113' ' ' ALA . 51.1 mt -69.08 -52.95 23.13 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.596 -0.729 . . . . 73.319999999999993 110.125 177.184 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.58 ' HB3' ' HB3' ' B' ' 113' ' ' ALA . 47.1 t -103.12 -28.15 12.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.989 -0.551 . . . . 71.239999999999995 110.738 -179.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 41.7 p -78.32 77.37 4.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.243 0.544 . . . . 72.420000000000002 110.603 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -143.93 -179.05 6.24 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.669 -0.696 . . . . 31.32 109.939 179.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 49.6 m -108.78 112.28 24.47 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.167 -0.679 . . . . 64.400000000000006 109.167 174.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 76.3 mt -103.59 -61.3 1.44 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.363 0.601 . . . . 75.109999999999999 112.598 -170.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 122' ' ' ASP . . . . . 0.727 ' HB2' ' HD2' ' A' ' 87' ' ' LYS . 1.8 t70 -105.6 -162.8 0.89 Allowed 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.132 -0.94 . . . . 74.400000000000006 111.152 -170.731 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . 0.574 HG13 ' H ' ' B' ' 124' ' ' SER . 11.2 tp -92.91 173.09 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.019 -0.537 . . . . 72.209999999999994 110.164 -179.032 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.574 ' H ' HG13 ' B' ' 123' ' ' ILE . 24.2 m -121.88 139.23 53.9 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.427 -0.583 . . . . 74.319999999999993 109.427 179.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -132.81 2.7 3.73 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.723 0.638 . . . . 74.420000000000002 112.723 -175.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 126' ' ' GLN . . . . . 0.438 ' HB2' ' O ' ' A' ' 83' ' ' VAL . 2.8 mp0 -87.91 133.07 34.0 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 110.05 -0.352 . . . . 71.310000000000002 110.05 177.753 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 127' ' ' TRP . . . . . 0.419 ' C ' ' H ' ' B' ' 129' ' ' ASN . 42.5 t-105 -92.34 -2.49 56.35 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.939 -0.573 . . . . 65.25 110.41 -174.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 32.3 t -75.75 19.29 0.21 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.774 -0.648 . . . . 62.210000000000001 111.309 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . 0.419 ' H ' ' C ' ' B' ' 127' ' ' TRP . 27.8 t-20 -81.03 -18.64 46.09 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.23 -0.441 . . . . 72.349999999999994 110.975 -178.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.412 ' O ' HG13 ' B' ' 130' ' ' VAL . 7.5 p -59.69 89.9 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-O 121.65 0.738 . . . . 65.519999999999996 112.876 -173.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 131' ' ' PHE . . . . . 0.672 ' HB3' HD13 ' A' ' 49' ' ' LEU . 24.6 p90 44.38 21.17 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.494 1.517 . . . . 63.450000000000003 114.086 179.367 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -68.31 -61.55 1.79 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.95 0.405 . . . . 71.209999999999994 110.854 -178.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 133' ' ' ILE . . . . . . . . . . . . . 49.0 mm -60.06 -38.44 76.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.902 -0.59 . . . . 74.319999999999993 111.044 -177.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 70.0 mt -56.46 -37.41 70.26 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.545 -0.752 . . . . 73.519999999999996 111.158 177.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -69.45 -42.72 74.56 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.3 -0.409 . . . . 62.439999999999998 110.906 -178.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -69.93 -29.45 66.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.916 -0.584 . . . . 61.240000000000002 111.533 -175.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -98.47 -0.14 44.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.035 0.445 . . . . 60.43 110.677 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 26.4 t70 61.84 64.01 1.06 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.05 -0.977 . . . . 74.530000000000001 111.515 177.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -91.36 2.97 56.01 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.283 -0.871 . . . . 75.540000000000006 110.372 171.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 140' ' ' GLU . . . . . 0.437 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 14.7 tp10 61.71 63.41 2.23 Favored Pre-proline 0 CA--C 1.538 0.49 0 CA-C-N 115.948 -0.569 . . . . 75.150000000000006 111.397 178.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.4 163.47 34.41 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.262 1.975 . . . . 71.230000000000004 111.204 177.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 142' ' ' LYS . . . . . 0.823 ' HA ' ' HE3' ' B' ' 142' ' ' LYS . 0.0 OUTLIER -99.22 -159.57 0.75 Allowed 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.81 -0.356 . . . . 75.239999999999995 111.372 -176.896 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 143' ' ' PHE . . . . . 0.446 ' CD1' ' HB2' ' B' ' 145' ' ' CYS . 5.2 p90 -138.39 160.99 38.1 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 113.081 0.771 . . . . 60.009999999999998 113.081 -165.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . 0.769 HD13 HG11 ' A' ' 47' ' ' VAL . 3.3 mm? -82.83 81.89 8.37 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.149 -0.932 . . . . 55.5 109.28 175.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 145' ' ' CYS . . . . . 0.458 ' H ' HG21 ' A' ' 47' ' ' VAL . 9.1 t -80.69 -160.92 0.34 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.04 -0.527 . . . . 60.420000000000002 110.695 -177.49 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -143.02 148.58 36.99 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 107.626 -1.25 . . . . 74.310000000000002 107.626 -175.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 147' ' ' VAL . . . . . 0.632 HG11 ' HA ' ' A' ' 44' ' ' LEU . 9.0 p -120.29 150.14 23.01 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.221 0 C-N-CA 120.039 -0.664 . . . . 65.230000000000004 109.476 175.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . 0.581 ' HD3' ' H ' ' B' ' 148' ' ' LYS . 0.0 OUTLIER -138.0 144.84 41.28 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.108 -0.496 . . . . 74.420000000000002 110.22 -170.435 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.779 ' HA ' ' HB2' ' A' ' 42' ' ' LYS . 0.5 OUTLIER -78.29 86.2 4.4 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 109.285 -0.635 . . . . 72.519999999999996 109.285 174.525 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -78.56 91.28 4.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.242 -0.89 . . . . 55.240000000000002 109.295 175.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 151' ' ' PHE . . . . . 0.445 ' CE2' ' HB2' ' B' ' 153' ' ' CYS . 52.6 p90 -108.57 164.7 12.12 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.08 -0.509 . . . . 72.109999999999999 110.736 -175.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 152' ' ' LYS . . . . . 0.738 ' HE2' ' HA2' ' B' ' 155' ' ' GLY . 78.0 tttt -92.9 104.92 17.12 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.762 -0.654 . . . . 71.129999999999995 110.015 179.232 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 153' ' ' CYS . . . . . 0.796 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 36.8 t -93.45 92.26 7.54 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.352 -0.84 . . . . 71.219999999999999 110.607 -174.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 16.8 t70 66.44 6.89 4.62 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.762 -0.654 . . . . 74.530000000000001 111.294 174.391 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 155' ' ' GLY . . . . . 0.738 ' HA2' ' HE2' ' B' ' 152' ' ' LYS . . . 138.53 -32.65 2.29 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.966 -0.635 . . . . 73.530000000000001 112.348 -179.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 156' ' ' GLU . . . . . 0.492 ' OE1' ' HD3' ' B' ' 158' ' ' LYS . 16.0 pt-20 -98.06 135.18 40.11 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.502 0.191 . . . . 71.030000000000001 110.665 -177.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 46.7 mm -77.48 120.14 27.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.54 -0.541 . . . . 64.140000000000001 109.54 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 158' ' ' LYS . . . . . 0.524 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 32.3 mmmt -117.17 123.58 47.04 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.81 0.338 . . . . 63.0 110.621 -177.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . 0.495 HG22 ' CG ' ' B' ' 148' ' ' LYS . 0.3 OUTLIER -93.94 107.67 19.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.095 -0.502 . . . . 73.5 111.005 178.567 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 160' ' ' PHE . . . . . 0.524 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 57.3 m-85 -115.13 123.79 49.85 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.329 0.585 . . . . 74.420000000000002 111.482 179.126 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 23.3 t -120.79 10.75 11.01 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 107.665 -1.235 . . . . 71.230000000000004 107.665 171.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -129.7 110.39 11.74 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.36 -1.291 . . . . 63.240000000000002 109.476 -177.322 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -69.52 -32.96 72.11 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.486 -0.324 . . . . 71.120000000000005 111.087 -176.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -68.44 -45.8 71.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.847 0.356 . . . . 73.420000000000002 110.458 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 49.8 m -64.27 -30.78 71.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.215 -0.448 . . . . 55.420000000000002 110.485 176.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . 0.441 ' HA ' ' CE2' ' B' ' 160' ' ' PHE . 61.5 tp -68.1 -39.98 82.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.489 . . . . 64.120000000000005 110.69 177.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -59.55 -38.68 81.72 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.251 -0.431 . . . . 75.25 110.648 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -58.66 -54.84 42.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.294 0.569 . . . . 75.439999999999998 110.575 176.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 169' ' ' PHE . . . . . 0.605 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 57.0 t80 -66.56 -44.86 81.17 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.944 -1.025 . . . . 74.439999999999998 111.584 -172.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.4 -29.49 70.53 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 111.948 0.351 . . . . 73.200000000000003 111.948 -178.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 3.7 t -80.65 -23.55 39.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.754 0.312 . . . . 63.219999999999999 110.96 -175.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -95.27 -15.81 22.91 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.82 0.343 . . . . 71.030000000000001 111.102 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 173' ' ' LYS . . . . . 0.796 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 25.6 mmmt -78.41 116.25 18.68 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.522 -0.547 . . . . 73.239999999999995 109.522 173.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 22.0 t -59.51 -33.87 71.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.356 -0.384 . . . . 54.310000000000002 111.412 -174.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 175' ' ' SER . . . . . 0.43 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 5.1 p -78.97 -40.98 30.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.768 0.318 . . . . 71.420000000000002 111.291 179.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.556 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 70.3 mtp -75.21 -27.29 59.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.566 -0.288 . . . . 71.540000000000006 111.667 -177.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . 0.881 ' HE3' ' HB3' ' A' ' 18' ' ' SER . 45.8 tttm -52.79 -40.26 63.05 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.284 -0.416 . . . . 74.120000000000005 111.625 -178.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -92.33 -2.99 56.04 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.561 0.695 . . . . 64.230000000000004 110.051 -173.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 179' ' ' LEU . . . . . 0.498 ' HB3' HG21 ' A' ' 33' ' ' ILE . 60.1 mt -88.7 -47.72 8.04 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.014 -0.994 . . . . 41.439999999999998 108.92 173.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 180' ' ' LEU . . . . . 0.465 HD13 HG13 ' A' ' 33' ' ' ILE . 4.1 mm? -86.62 -7.94 57.9 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.881 -1.054 . . . . 72.340000000000003 111.689 -176.096 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 181' ' ' LYS . . . . . 0.42 ' HE3' ' HB2' ' B' ' 181' ' ' LYS . 18.1 ptmt -53.21 -23.16 7.95 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.499 0.555 . . . . 72.319999999999993 112.499 -178.866 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -72.41 -40.85 66.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.239 0.543 . . . . 64.310000000000002 110.174 177.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 183' ' ' VAL . . . . . 0.586 ' O ' ' HB2' ' A' ' 26' ' ' GLN . 47.5 t -82.14 -35.71 13.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.77 0.795 . . . . 72.140000000000001 109.934 178.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 184' ' ' LEU . . . . . 0.473 ' HA ' ' HB3' ' A' ' 24' ' ' SER . 30.8 mt -110.54 89.3 8.72 Favored Pre-proline 0 C--N 1.316 -0.85 0 CA-C-N 115.104 -0.953 . . . . 72.430000000000007 109.47 -178.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 185' ' ' PRO . . . . . 0.582 ' HD3' ' O ' ' B' ' 183' ' ' VAL . 21.7 Cg_exo -65.74 91.77 0.24 Allowed 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 122.51 2.14 . . . . 74.420000000000002 111.372 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 186' ' ' GLN . . . . . 0.616 HE22 ' HG3' ' B' ' 177' ' ' LYS . 61.1 mt-30 -81.86 87.47 6.38 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.356 -0.838 . . . . 73.519999999999996 110.167 -179.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -50.52 -47.3 57.46 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 114.793 -1.094 . . . . 71.109999999999999 110.124 178.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 117.875 -1.059 . . . . 74.329999999999998 108.953 171.254 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.711 0 N-CA-C 112.383 -0.287 . . . . 55.119999999999997 112.383 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 47.5 t -102.5 -45.84 10.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 109.395 -0.594 . . . . 52.219999999999999 109.395 176.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 pp -157.12 171.47 20.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.096 -0.956 . . . . 74.310000000000002 109.294 177.18 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 88.9 mmm 58.48 36.91 25.6 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.325 0.583 . . . . 73.120000000000005 109.725 -175.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -103.17 133.15 48.74 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.475 -0.784 . . . . 71.409999999999997 111.854 -170.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -145.71 105.09 3.94 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.222 -0.899 . . . . 55.299999999999997 108.893 172.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -120.89 104.17 0.95 Allowed Glycine 0 N--CA 1.442 -0.903 0 C-N-CA 120.628 -0.796 . . . . 61.530000000000001 112.174 -176.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -86.15 94.74 9.36 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.128 0.49 . . . . 73.140000000000001 110.232 178.039 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 21.8 t -87.38 78.23 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.323 0.582 . . . . 72.510000000000005 110.202 -177.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.5 mp -128.84 157.83 40.41 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.313 -0.858 . . . . 65.340000000000003 108.923 176.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.6 t -145.14 152.98 40.9 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.565 -0.454 . . . . 73.540000000000006 110.52 179.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -146.99 117.13 7.3 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 108.261 -1.014 . . . . 75.340000000000003 108.261 178.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.37 118.35 18.97 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.454 -0.339 . . . . 52.539999999999999 111.149 -176.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.85 98.48 2.0 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.512 -0.551 . . . . 52.229999999999997 109.512 172.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.8 t70 79.92 -43.29 0.26 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 114.957 -1.019 . . . . 70.030000000000001 112.279 173.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.4 mt -52.08 -79.95 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.016 0.747 . . . . 74.230000000000004 113.016 -175.266 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.0 m -81.04 -15.55 55.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.992 0.425 . . . . 74.519999999999996 111.475 -176.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.7 m -88.73 15.29 8.48 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.177 -0.465 . . . . 73.349999999999994 110.725 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -71.48 153.03 42.52 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.953 -0.567 . . . . 72.439999999999998 111.549 -179.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 12.0 t -156.52 164.87 37.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.962 -0.563 . . . . 71.099999999999994 109.558 178.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 43.6 mt -121.71 152.19 39.68 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.165 0.507 . . . . 73.109999999999999 111.166 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -124.44 129.76 51.25 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.63 -0.713 . . . . 75.450000000000003 109.253 175.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.458 ' HA ' ' NE2' ' B' ' 164' ' ' GLN . 11.4 tt -104.0 108.72 25.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-O 121.699 0.762 . . . . 72.549999999999997 110.712 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 45.4 m -129.96 150.49 51.22 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.237 -0.892 . . . . 61.100000000000001 110.941 -178.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.934 ' HD3' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -81.48 86.3 6.35 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.348 -0.842 . . . . 64.230000000000004 110.047 178.596 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 21.1 mm-40 -97.14 178.6 5.2 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.438 -0.801 . . . . 72.25 110.809 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -123.0 -162.74 1.05 Allowed 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 120.707 0.289 . . . . 60.530000000000001 110.464 -176.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.409 ' C ' ' H ' ' A' ' 30' ' ' VAL . 4.7 t -108.24 19.21 20.18 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.027 0.441 . . . . 43.109999999999999 111.168 -173.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.475 ' OD1' ' HB3' ' A' ' 32' ' ' ASN . 64.0 t30 -72.92 6.98 2.25 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.471 0.653 . . . . 63.240000000000002 110.858 178.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.478 HG23 HD22 ' B' ' 166' ' ' LEU . 6.2 p -57.35 -42.65 80.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 CA-C-N 115.479 -0.782 . . . . 74.219999999999999 112.639 -175.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 11.2 p90 -90.87 -13.4 33.75 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.338 0.495 . . . . 73.120000000000005 112.338 -173.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.475 ' HB3' ' OD1' ' A' ' 29' ' ' ASN . 8.1 t30 -73.3 -52.27 14.54 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.999 -0.28 . . . . 74.25 111.073 -175.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.537 HG21 ' HB3' ' B' ' 179' ' ' LEU . 43.3 mm -55.56 -45.33 78.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.22 0.533 . . . . 43.310000000000002 111.338 -178.457 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.032 HD12 HD21 ' B' ' 149' ' ' LEU . 66.2 mt -66.78 -26.87 67.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.809 -0.632 . . . . 42.329999999999998 111.414 -176.332 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.472 ' HB2' ' HG3' ' A' ' 41' ' ' PRO . 1.0 OUTLIER -68.77 -40.34 79.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.785 0.326 . . . . 64.420000000000002 110.39 176.994 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -76.56 -23.82 53.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.106 0.479 . . . . 71.230000000000004 110.8 -177.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -100.54 4.3 43.43 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.017 -0.538 . . . . 71.519999999999996 110.906 -179.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.7 t70 56.11 58.59 4.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.507 -0.77 . . . . 74.209999999999994 111.85 177.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.615 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 5.8 m-85 -96.69 7.15 47.23 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.797 -0.638 . . . . 71.200000000000003 109.578 172.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.458 ' O ' ' HA ' ' B' ' 151' ' ' PHE . 30.7 tt0 61.55 80.03 0.26 Allowed Pre-proline 0 C--N 1.333 -0.117 0 CA-C-N 114.829 -1.078 . . . . 73.219999999999999 110.942 -178.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.472 ' HG3' ' HB2' ' A' ' 35' ' ' ARG . 69.3 Cg_endo -75.31 152.36 39.24 Favored 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.583 2.189 . . . . 73.310000000000002 111.966 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.651 ' H ' HD12 ' B' ' 149' ' ' LEU . 0.2 OUTLIER -108.81 152.07 25.38 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.785 -0.366 . . . . 74.019999999999996 110.675 -179.922 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 1.065 ' HA ' HG11 ' B' ' 147' ' ' VAL . 64.7 m-85 -155.74 -10.47 0.11 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.481 -0.781 . . . . 63.43 111.008 -170.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.406 ' H ' ' H ' ' A' ' 43' ' ' PHE . 7.0 mp -64.11 104.33 0.72 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.412 0.625 . . . . 72.099999999999994 110.543 -177.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.492 ' HB2' ' HB ' ' B' ' 147' ' ' VAL . 35.9 t -135.65 159.63 41.02 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.401 -0.818 . . . . 65.219999999999999 109.825 -175.133 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -66.51 100.59 0.68 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.468 -0.938 . . . . 70.129999999999995 108.468 173.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.891 HG22 ' H ' ' A' ' 48' ' ' LYS . 7.7 p -138.18 -161.87 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 115.183 -0.917 . . . . 75.400000000000006 109.527 -166.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.891 ' H ' HG22 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -105.73 124.74 50.05 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.421 -0.955 . . . . 75.219999999999999 108.421 176.377 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.683 HD11 ' HB3' ' B' ' 141' ' ' PRO . 12.5 tp -74.93 86.49 2.28 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.012 0.434 . . . . 75.239999999999995 109.961 -176.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.541 ' HB2' HG22 ' A' ' 59' ' ' THR . . . -88.17 103.85 16.15 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.488 -0.778 . . . . 63.32 110.255 177.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -125.7 169.89 12.09 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.101 -0.5 . . . . 64.530000000000001 110.088 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.435 ' HE3' HD11 ' A' ' 57' ' ' ILE . 32.2 ttmt -101.71 116.62 33.13 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.333 -0.394 . . . . 75.349999999999994 110.758 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.619 ' O ' ' HG2' ' A' ' 56' ' ' GLU . 52.7 t -116.18 104.12 11.21 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.937 -0.574 . . . . 33.32 110.365 179.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.8 t70 70.24 4.33 4.82 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.854 0.835 . . . . 61.149999999999999 110.805 175.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.12 -31.43 4.27 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.542 -0.753 . . . . 75.299999999999997 112.017 -179.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.619 ' HG2' ' O ' ' A' ' 53' ' ' CYS . 11.7 pt-20 -84.24 131.16 34.77 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.014 0.435 . . . . 74.209999999999994 110.082 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.435 HD11 ' HE3' ' A' ' 52' ' ' LYS . 41.1 mm -82.21 114.81 23.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.486 -0.561 . . . . 74.319999999999993 109.486 178.206 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.427 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 32.1 mmmt -109.63 129.72 55.57 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.23 -0.441 . . . . 73.140000000000001 111.187 -174.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.541 HG22 ' HB2' ' A' ' 50' ' ' ALA . 2.5 p -103.07 118.16 36.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.095 -0.502 . . . . 73.230000000000004 110.593 176.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.463 ' CD2' HD13 ' A' ' 66' ' ' LEU . 49.7 m-85 -129.72 121.36 26.75 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.206 0.527 . . . . 75.439999999999998 110.669 177.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.0 p -95.34 1.81 54.48 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.841 -0.618 . . . . 73.239999999999995 110.599 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -155.2 166.88 32.21 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.543 -0.753 . . . . 74.400000000000006 110.158 -178.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.603 ' HB3' ' HB3' ' B' ' 126' ' ' GLN . 2.8 tm? -87.6 -21.22 25.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.167 -0.469 . . . . 74.299999999999997 109.898 -177.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -62.88 -47.66 82.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.088 -0.506 . . . . 71.519999999999996 110.946 -177.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' A' ' 68' ' ' LYS . 12.2 t -71.31 -34.26 70.43 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.372 -0.376 . . . . 71.239999999999995 110.196 178.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.463 HD13 ' CD2' ' A' ' 60' ' ' PHE . 57.1 tp -68.45 -34.53 76.12 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 120.996 -0.281 . . . . 72.239999999999995 110.457 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.567 ' HG3' HD13 ' A' ' 84' ' ' LEU . 50.8 ttt180 -56.17 -46.33 79.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.231 0.539 . . . . 74.310000000000002 109.914 173.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.487 ' HE2' HD13 ' B' ' 121' ' ' LEU . 15.8 mmmt -57.57 -36.16 71.32 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.058 -0.974 . . . . 64.530000000000001 111.299 177.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.484 ' CE2' ' HE3' ' A' ' 73' ' ' LYS . 58.5 t80 -84.87 -44.19 13.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.742 -0.663 . . . . 74.109999999999999 111.511 -175.519 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.12 -22.21 63.98 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.46 -0.336 . . . . 64.5 111.364 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 14.2 t -74.71 -17.9 60.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.316 -0.402 . . . . 74.400000000000006 111.286 -178.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 13.0 pt20 -101.79 -8.94 21.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.229 0.538 . . . . 74.129999999999995 110.185 176.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.534 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 70.0 mmtt -94.0 104.34 16.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.704 -0.68 . . . . 73.400000000000006 109.631 176.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.5 m -53.42 -32.58 50.36 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.879 0.371 . . . . 75.120000000000005 111.713 -178.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 26.9 m -76.94 -45.13 28.82 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.813 0.339 . . . . 71.109999999999999 111.297 179.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.534 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 61.4 mtp -78.38 -17.09 56.93 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.901 0.382 . . . . 54.329999999999998 111.422 -175.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.475 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 12.9 tmtt? -63.97 -24.15 67.61 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.944 -0.571 . . . . 63.219999999999999 110.593 177.205 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.564 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 28.3 mm-40 -98.24 6.62 47.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.295 0.569 . . . . 52.350000000000001 110.287 -178.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.761 ' HB3' HG21 ' B' ' 133' ' ' ILE . 43.2 mt -100.59 -46.99 5.02 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.226 -0.897 . . . . 65.239999999999995 110.233 178.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -94.92 -0.39 53.99 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.939 -0.573 . . . . 54.030000000000001 111.052 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.564 ' HD2' ' HA ' ' A' ' 78' ' ' GLU . 20.5 ptmt -51.2 -21.31 1.96 Allowed 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.364 0.876 . . . . 75.5 113.364 -178.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -76.25 -46.67 27.03 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.801 0.334 . . . . 72.439999999999998 111.476 -178.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 29.2 m -89.19 -12.58 9.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.263 -0.426 . . . . 74.239999999999995 111.221 -175.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.567 HD13 ' HG3' ' A' ' 67' ' ' ARG . 80.3 mt -106.34 156.87 36.19 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 116.076 -0.511 . . . . 64.450000000000003 109.622 178.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -74.35 58.17 4.34 Favored 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 122.727 2.285 . . . . 70.329999999999998 111.706 177.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.458 ' OE1' ' HA ' ' A' ' 81' ' ' LYS . 96.6 mt-30 -111.78 95.45 5.5 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.963 -1.017 . . . . 71.140000000000001 110.362 -177.552 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 23.3 tttp -138.26 -34.96 0.63 Allowed 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.206 -0.906 . . . . 71.340000000000003 110.137 -178.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 115.833 -0.621 . . . . 42.240000000000002 110.911 177.111 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 N-CA-C 112.079 -0.408 . . . . 31.329999999999998 112.079 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 61.2 t -77.76 -41.74 28.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 121.275 0.56 . . . . 74.409999999999997 109.663 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 3.7 pp -129.86 168.9 15.89 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.345 -0.843 . . . . 64.430000000000007 109.601 177.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 86.9 mmm -92.48 91.0 7.41 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.014 0.435 . . . . 74.230000000000004 111.43 -178.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -98.04 116.31 29.99 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.175 -0.676 . . . . 74.230000000000004 109.175 170.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -101.15 104.73 15.83 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.507 -0.769 . . . . 72.549999999999997 110.194 -176.011 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -118.51 -135.58 5.26 Favored Glycine 0 N--CA 1.446 -0.675 0 CA-C-N 115.764 -0.653 . . . . 32.149999999999999 112.416 -179.072 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -139.21 122.14 16.66 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.82 0.343 . . . . 62.43 110.939 -177.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 43.6 t -87.77 -20.93 7.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.521 0.676 . . . . 55.109999999999999 110.089 178.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 9.1 mp -88.73 153.19 21.29 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.279 -0.873 . . . . 54.210000000000001 110.716 -178.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 7.2 t -151.45 160.2 43.84 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.073 -0.714 . . . . 71.049999999999997 109.073 176.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . 0.412 ' HA ' HD22 ' B' ' 112' ' ' LEU . 0.3 OUTLIER -131.91 127.08 35.69 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.814 -0.439 . . . . 75.340000000000003 109.814 -177.83 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.95 137.8 57.97 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 116.425 -0.352 . . . . 44.140000000000001 110.812 -179.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -98.09 100.14 11.44 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.193 -0.458 . . . . 75.099999999999994 110.511 177.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 16.1 t70 77.5 -32.05 0.17 Allowed 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 114.814 -1.084 . . . . 54.509999999999998 112.395 170.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 4.4 tt -69.05 -80.29 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.568 -0.287 . . . . 63.409999999999997 111.202 -175.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 21.3 m -79.59 -29.86 41.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.676 0.274 . . . . 63.149999999999999 111.463 -175.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 23.1 m -74.51 101.56 4.21 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.876 -0.416 . . . . 63.310000000000002 109.876 177.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -150.59 143.06 24.4 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.146 -0.479 . . . . 61.509999999999998 110.644 -177.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 31.2 m -138.35 125.37 21.33 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.194 -0.457 . . . . 63.350000000000001 109.979 175.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . 0.487 HD13 ' HE2' ' A' ' 68' ' ' LYS . 3.9 mm? -101.24 148.38 25.17 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.236 -0.438 . . . . 74.430000000000007 110.843 -178.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -139.76 146.9 40.09 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.975 -0.557 . . . . 64.030000000000001 110.032 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 12.8 tt -114.03 133.21 60.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.237 -0.438 . . . . 72.519999999999996 110.54 -179.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 63.1 m -147.34 170.85 16.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.15 -0.477 . . . . 73.209999999999994 111.111 -177.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . 0.814 ' HD3' ' H ' ' B' ' 125' ' ' LYS . 0.0 OUTLIER -85.2 81.67 8.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.665 0.745 . . . . 73.120000000000005 110.306 -179.771 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 126' ' ' GLN . . . . . 0.801 HE21 ' HA ' ' B' ' 126' ' ' GLN . 0.0 OUTLIER -94.27 150.99 19.77 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.7 -0.682 . . . . 74.219999999999999 109.841 -179.793 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 38.5 m95 -116.26 -165.17 1.02 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.966 0.412 . . . . 73.209999999999994 111.145 -173.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 25.1 m -100.44 18.15 19.77 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.869 -0.605 . . . . 55.100000000000001 111.575 -172.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -84.13 23.43 1.06 Allowed 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.866 0.841 . . . . 72.420000000000002 110.011 179.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.457 HG23 HD23 ' A' ' 66' ' ' LEU . 2.9 p -74.15 -48.2 38.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.228 -0.896 . . . . 74.219999999999999 112.459 -174.526 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 34.9 p90 -78.52 -14.99 59.08 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 111.791 0.293 . . . . 72.299999999999997 111.791 -173.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.408 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 31.7 t30 -64.25 -58.64 5.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.524 -0.307 . . . . 43.43 111.178 -177.053 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 133' ' ' ILE . . . . . 0.761 HG21 ' HB3' ' A' ' 79' ' ' LEU . 27.3 mm -61.05 -38.95 80.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-O 121.194 0.521 . . . . 42.240000000000002 110.828 -176.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.613 ' HA ' ' HD2' ' B' ' 139' ' ' PHE . 51.6 mt -65.4 -33.28 75.59 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.67 -0.695 . . . . 73.239999999999995 111.235 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 42.2 ttt-85 -65.36 -48.23 73.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.146 0.498 . . . . 61.140000000000001 110.154 175.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 136' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 6.6 mm-40 -61.2 -42.03 97.87 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.149 -0.932 . . . . 72.140000000000001 111.616 -177.009 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -86.46 0.12 54.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.304 -0.407 . . . . 65.510000000000005 110.997 -179.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 15.6 t70 56.66 62.79 2.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.298 -0.864 . . . . 74.540000000000006 112.016 177.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 139' ' ' PHE . . . . . 0.613 ' HD2' ' HA ' ' B' ' 134' ' ' LEU . 75.3 m-85 -91.3 -4.5 55.82 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.06 -0.518 . . . . 73.420000000000002 110.394 169.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 60.1 84.67 0.2 Allowed Pre-proline 0 CA--C 1.529 0.157 0 CA-C-N 115.316 -0.857 . . . . 65.219999999999999 110.859 -176.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.683 ' HB3' HD11 ' A' ' 49' ' ' LEU . 17.6 Cg_exo -67.03 161.96 40.33 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 123.179 2.586 . . . . 72.120000000000005 112.092 177.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 142' ' ' LYS . . . . . 0.474 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 23.4 tptt -105.95 172.19 6.93 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.819 -0.352 . . . . 73.230000000000004 110.133 179.294 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 143' ' ' PHE . . . . . 0.817 ' HA ' HG11 ' A' ' 47' ' ' VAL . 3.2 m-85 -176.56 -35.01 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 122.982 0.513 . . . . 73.299999999999997 110.133 -170.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 9.8 mp -50.45 109.39 0.3 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.045 -0.979 . . . . 73.120000000000005 111.196 -177.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 38.2 t -160.14 -174.95 4.8 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.64 -0.874 . . . . 72.209999999999994 108.64 -177.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -71.29 106.74 3.96 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.686 -0.857 . . . . 74.150000000000006 108.686 174.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 147' ' ' VAL . . . . . 1.065 HG11 ' HA ' ' A' ' 43' ' ' PHE . 12.4 p -135.84 -158.46 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 CA-C-N 114.888 -1.051 . . . . 74.430000000000007 109.236 -168.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . 0.949 ' H ' HG22 ' B' ' 147' ' ' VAL . 0.1 OUTLIER -124.91 127.75 47.57 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.374 -0.602 . . . . 74.510000000000005 109.374 178.586 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 1.032 HD21 HD12 ' A' ' 34' ' ' LEU . 66.4 tp -77.32 92.57 3.92 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.519 -0.764 . . . . 71.310000000000002 110.811 -174.631 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.633 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -95.01 85.75 4.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.677 -0.692 . . . . 71.519999999999996 109.788 175.062 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 151' ' ' PHE . . . . . 0.592 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 45.4 p90 -102.54 171.95 7.14 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.876 -0.602 . . . . 75.310000000000002 110.349 -177.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -103.2 119.56 39.09 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.103 0.478 . . . . 75.140000000000001 110.625 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 153' ' ' CYS . . . . . 0.432 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 23.0 t -113.15 101.22 9.23 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.802 -0.636 . . . . 72.150000000000006 109.618 177.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 65.69 14.69 9.67 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.605 -0.725 . . . . 62.350000000000001 112.115 176.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 128.89 -32.82 3.21 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.103 -1.046 . . . . 70.010000000000005 112.84 177.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -100.2 142.13 32.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.145 0.498 . . . . 71.450000000000003 110.918 -177.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . 0.43 ' HA ' ' O ' ' B' ' 151' ' ' PHE . 49.1 mm -80.3 124.96 38.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.809 -0.632 . . . . 53.43 110.278 178.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 158' ' ' LYS . . . . . 0.448 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 26.7 mmmt -114.34 132.47 56.18 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.888 -0.412 . . . . 61.229999999999997 109.888 179.155 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.4 109.93 21.85 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.902 0.382 . . . . 72.140000000000001 111.667 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 160' ' ' PHE . . . . . 0.448 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 33.9 m-85 -119.8 128.99 54.22 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.047 -0.524 . . . . 73.340000000000003 110.438 177.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 2.9 p -100.85 -16.56 17.21 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.125 -0.489 . . . . 54.140000000000001 111.764 -178.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -139.37 164.44 29.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.924 0.392 . . . . 63.340000000000003 110.786 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . 0.458 HD13 ' O ' ' B' ' 163' ' ' LEU . 3.0 tm? -86.45 -25.29 25.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.763 -0.653 . . . . 73.420000000000002 110.251 -176.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 164' ' ' GLN . . . . . 0.458 ' NE2' ' HA ' ' A' ' 23' ' ' ILE . 51.3 tt0 -60.85 -46.76 89.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.011 0.434 . . . . 64.549999999999997 110.86 -177.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 14.2 m -68.63 -34.43 75.73 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.845 -0.616 . . . . 74.219999999999999 110.373 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . 0.478 HD22 HG23 ' A' ' 30' ' ' VAL . 42.8 tp -71.45 -26.95 62.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.915 -0.584 . . . . 72.209999999999994 110.615 -178.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -56.2 -43.35 78.41 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.664 -0.244 . . . . 70.329999999999998 110.681 177.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 28.0 mtmt -67.36 -43.15 82.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.033 0.444 . . . . 74.540000000000006 110.234 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 169' ' ' PHE . . . . . 0.582 ' O ' ' HG2' ' B' ' 173' ' ' LYS . 70.8 t80 -64.16 -45.9 86.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.516 -0.765 . . . . 72.340000000000003 110.54 -177.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -71.63 -28.62 63.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.101 -0.5 . . . . 61.450000000000003 111.286 -178.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 22.9 t -67.89 -32.89 73.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.622 -0.263 . . . . 63.240000000000002 111.127 -177.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -84.45 -16.04 43.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.872 0.368 . . . . 70.099999999999994 110.403 178.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 173' ' ' LYS . . . . . 0.582 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 31.6 mmmt -83.22 145.72 28.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.151 -0.477 . . . . 75.299999999999997 110.129 178.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 12.7 m -83.67 -44.79 14.14 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.284 0.564 . . . . 53.130000000000003 109.557 176.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 3.2 m -72.54 -40.29 66.86 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.52 -0.764 . . . . 63.229999999999997 111.504 -177.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.446 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 81.6 mtp -85.2 -17.85 35.86 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.391 0.515 . . . . 75.25 112.391 -172.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . 0.537 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 88.0 tttt -63.93 -31.06 72.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.979 0.419 . . . . 44.32 110.795 -178.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . 0.871 ' HA ' ' HD2' ' B' ' 181' ' ' LYS . 51.7 mm-40 -90.08 -0.3 57.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.521 0.677 . . . . 65.420000000000002 110.419 -175.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 179' ' ' LEU . . . . . 0.537 ' HB3' HG21 ' A' ' 33' ' ' ILE . 52.8 mt -94.78 -49.71 5.47 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.024 -0.989 . . . . 64.040000000000006 109.806 -179.244 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 180' ' ' LEU . . . . . 0.61 ' O ' ' HG ' ' B' ' 184' ' ' LEU . 3.4 mm? -88.89 -14.93 35.64 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.531 -0.759 . . . . 72.010000000000005 111.858 -176.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 181' ' ' LYS . . . . . 0.871 ' HD2' ' HA ' ' B' ' 178' ' ' GLU . 20.4 ptmt -53.89 -23.96 14.46 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 111.959 0.355 . . . . 73.510000000000005 111.959 -178.113 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -65.66 -23.75 66.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.022 -0.535 . . . . 71.530000000000001 111.942 -174.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 183' ' ' VAL . . . . . 0.426 HG11 HD22 ' A' ' 29' ' ' ASN . 19.3 m -124.88 3.34 4.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 112.201 0.445 . . . . 64.310000000000002 112.201 -178.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 184' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' B' ' 180' ' ' LEU . 81.9 mt -90.0 147.64 37.72 Favored Pre-proline 0 C--N 1.326 -0.452 0 C-N-CA 121.21 -0.196 . . . . 74.129999999999995 110.874 -179.151 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -69.91 83.39 0.73 Allowed 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.622 2.215 . . . . 60.409999999999997 111.397 173.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -132.59 -137.46 0.19 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.519 -0.764 . . . . 74.150000000000006 110.593 -175.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 62.9 mttp 69.94 25.0 5.0 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 122.003 0.906 . . . . 74.329999999999998 109.673 -176.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 . . . . . 0 C--O 1.249 1.041 0 CA-C-N 114.124 -1.398 . . . . 43.509999999999998 109.102 176.721 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.761 0 N-CA-C 111.861 -0.495 . . . . 64.030000000000001 111.861 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.3 p -85.64 -33.73 7.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.159 0.504 . . . . 72.540000000000006 109.668 177.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 94.4 mt -132.09 119.76 21.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.694 -0.684 . . . . 72.319999999999993 109.432 174.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 24.7 mmt -85.36 -76.08 0.34 Allowed 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.226 -0.443 . . . . 73.400000000000006 111.571 -175.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -178.68 123.44 0.09 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.824 -0.626 . . . . 73.299999999999997 110.092 -174.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -138.34 -17.07 1.18 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.467 0.651 . . . . 74.209999999999994 110.449 -178.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.27 5.25 64.01 Favored Glycine 0 N--CA 1.449 -0.44 0 CA-C-N 115.494 -0.775 . . . . 70.420000000000002 112.344 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.58 87.26 1.63 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.164 0.506 . . . . 43.310000000000002 110.414 176.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.1 p -127.5 132.8 68.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.734 -0.666 . . . . 74.120000000000005 109.418 176.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.408 HD23 ' N ' ' A' ' 10' ' ' LEU . 2.3 pt? -149.25 135.72 19.34 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.239 -0.437 . . . . 73.439999999999998 110.058 -178.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.2 m -90.9 95.76 10.29 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.967 0.413 . . . . 75.310000000000002 110.128 174.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.9 ' HG ' ' HD2' ' A' ' 81' ' ' LYS . 0.3 OUTLIER -79.51 133.64 36.49 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 107.987 -1.116 . . . . 73.230000000000004 107.987 174.641 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.586 ' CB ' ' HB3' ' A' ' 17' ' ' SER . . . -71.02 165.2 23.99 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.014 0.435 . . . . 41.140000000000001 111.161 -175.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -96.2 97.16 9.32 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.073 -0.512 . . . . 52.100000000000001 110.229 174.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.1 t70 74.26 -58.77 0.58 Allowed 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.191 -0.913 . . . . 73.430000000000007 112.819 171.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -69.37 -66.43 0.58 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.344 -0.389 . . . . 73.430000000000007 111.896 -170.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.586 ' HB3' ' CB ' ' A' ' 13' ' ' ALA . 7.8 t -82.39 5.91 18.86 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.92 0.391 . . . . 41.420000000000002 111.648 -170.159 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.6 m -75.21 53.39 0.64 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.302 0.573 . . . . 62.409999999999997 110.534 176.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.95 158.33 30.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.788 -0.642 . . . . 42.210000000000001 110.964 -176.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.431 HG21 HD23 ' A' ' 84' ' ' LEU . 28.6 m -150.14 122.64 8.51 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.156 -0.474 . . . . 63.039999999999999 110.235 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 50.4 tp -147.4 145.84 29.39 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.479 -0.328 . . . . 72.409999999999997 111.523 -178.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.6 t70 72.82 156.18 0.17 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 122.169 0.985 . . . . 63.130000000000003 113.591 170.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.62 ' O ' ' HD3' ' A' ' 25' ' ' LYS . 15.4 tt -149.71 152.47 11.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 106.216 -1.772 . . . . 73.319999999999993 106.216 170.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 45.4 m -76.08 -17.01 59.81 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 118.7 0.682 . . . . 54.229999999999997 111.869 -175.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.62 ' HD3' ' O ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER 39.56 53.49 2.41 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.199 1.0 . . . . 73.030000000000001 113.691 -178.114 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -95.62 4.09 53.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.32 0.581 . . . . 72.109999999999999 109.791 170.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 4.0 m-90 -84.27 92.26 7.94 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.701 -0.681 . . . . 71.409999999999997 110.738 -175.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.3 t -165.76 -52.44 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.08 0.467 . . . . 63.329999999999998 110.413 179.147 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.458 HD22 ' HB ' ' B' ' 183' ' ' VAL . 44.8 t30 -82.93 90.72 7.01 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.173 0.511 . . . . 52.130000000000003 111.354 -175.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.653 HG13 HD21 ' B' ' 163' ' ' LEU . 59.5 t -113.29 -65.95 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 115.636 -0.711 . . . . 74.340000000000003 110.145 175.084 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -107.05 6.78 29.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.972 -0.558 . . . . 70.010000000000005 110.601 -179.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.422 ' HB3' ' OD1' ' A' ' 29' ' ' ASN . 52.4 t30 -61.03 -50.96 71.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.893 -0.594 . . . . 71.239999999999995 110.962 -175.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.488 HG21 ' HB3' ' B' ' 179' ' ' LEU . 28.4 mm -60.59 -39.98 83.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.905 -0.589 . . . . 74.540000000000006 111.411 -178.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.48 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 86.4 mt -68.29 -22.49 64.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.863 -0.608 . . . . 71.510000000000005 110.982 -176.574 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 46.4 ttt-85 -73.32 -42.6 62.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.09 -0.505 . . . . 73.439999999999998 109.914 175.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -72.05 -23.43 61.37 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.925 -0.579 . . . . 64.239999999999995 111.04 -177.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -103.89 6.17 36.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.382 -0.372 . . . . 62.219999999999999 110.731 179.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 52.06 62.27 2.79 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.387 -0.824 . . . . 71.239999999999995 112.816 176.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.484 ' HB3' ' HB2' ' B' ' 151' ' ' PHE . 12.4 m-85 -94.36 -4.8 47.86 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.74 -0.664 . . . . 72.310000000000002 109.794 173.251 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 58.82 74.69 0.58 Allowed Pre-proline 0 C--O 1.232 0.183 0 CA-C-N 115.25 -0.886 . . . . 63.020000000000003 110.195 -174.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -78.58 142.42 18.29 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 123.006 2.471 . . . . 44.109999999999999 112.334 -176.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.702 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 1.4 mptm? -104.27 121.94 44.37 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.072 -0.513 . . . . 75.340000000000003 110.061 177.624 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.587 ' HA ' ' CG1' ' B' ' 147' ' ' VAL . 18.9 t80 -172.19 96.7 0.16 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.859 -0.61 . . . . 61.039999999999999 109.824 -177.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -157.2 124.08 5.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.221 -0.445 . . . . 72.140000000000001 109.908 176.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.443 ' HB3' ' CG2' ' B' ' 147' ' ' VAL . 18.4 p -162.67 122.73 2.35 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.29 -0.414 . . . . 61.299999999999997 110.887 -179.099 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -83.84 66.62 9.2 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.185 0.516 . . . . 50.049999999999997 109.839 175.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 34.6 m -109.06 142.83 20.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.026 -0.534 . . . . 45.039999999999999 110.658 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.564 ' HD3' HG22 ' A' ' 59' ' ' THR . 0.2 OUTLIER -163.13 144.7 9.81 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.242 -0.89 . . . . 63.350000000000001 109.225 -179.458 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.689 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 11.2 mp -70.43 86.57 0.62 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.469 -0.332 . . . . 61.299999999999997 110.491 -178.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.587 ' HA ' ' O ' ' A' ' 58' ' ' LYS . . . -84.98 63.08 7.9 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.629 -0.714 . . . . 54.539999999999999 110.047 175.459 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.689 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 51.8 p90 -95.33 171.57 8.63 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.485 -0.78 . . . . 74.030000000000001 110.077 -177.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -102.51 133.56 47.27 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.324 -0.398 . . . . 74.519999999999996 111.25 -178.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 42.3 t -135.8 114.69 12.11 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.695 -0.684 . . . . 74.5 109.453 175.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 70.34 13.95 7.52 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.143 0.577 . . . . 73.430000000000007 111.308 177.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 110.21 -32.32 6.76 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.682 -0.77 . . . . 74.400000000000006 112.186 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -89.01 156.1 19.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.006 0.432 . . . . 54.340000000000003 110.271 -179.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.1 mm -91.94 124.54 44.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 116.007 -0.542 . . . . 75.549999999999997 110.425 -179.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.587 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 27.4 mmmt -100.82 155.2 18.06 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.872 -0.788 . . . . 73.329999999999998 108.872 177.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.564 HG22 ' HD3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -133.45 102.18 5.43 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.177 0.513 . . . . 61.119999999999997 111.426 177.088 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.544 ' CD2' HD13 ' A' ' 66' ' ' LEU . 84.6 m-85 -108.35 119.83 40.63 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.804 -0.634 . . . . 74.450000000000003 110.448 177.327 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 32.6 t -97.06 -13.57 22.15 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.761 -0.654 . . . . 63.32 110.005 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -130.21 154.54 47.45 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.715 -0.675 . . . . 71.099999999999994 110.296 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.403 HD23 ' O ' ' A' ' 63' ' ' LEU . 10.4 tt -83.23 -24.36 32.37 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.409 -0.589 . . . . 73.430000000000007 109.409 -178.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -54.18 -52.72 60.29 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.443 -0.798 . . . . 60.020000000000003 111.013 -178.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.8 m -69.75 -44.13 70.84 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.96 -0.564 . . . . 72.430000000000007 111.346 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.544 HD13 ' CD2' ' A' ' 60' ' ' PHE . 54.6 tp -65.74 -35.87 81.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.429 -0.35 . . . . 63.100000000000001 111.379 -174.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.428 ' HE ' ' HB3' ' A' ' 67' ' ' ARG . 17.7 ttp180 -58.11 -41.85 84.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.957 0.408 . . . . 73.299999999999997 110.342 176.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -72.4 -32.0 66.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.967 -0.561 . . . . 70.450000000000003 110.688 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.486 ' HA ' HE21 ' A' ' 72' ' ' GLN . 31.6 t80 -65.31 -44.86 86.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.907 -0.588 . . . . 74.109999999999999 109.907 177.392 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.73 -24.57 61.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.192 -0.458 . . . . 53.109999999999999 111.399 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.761 ' HA ' ' HE2' ' A' ' 77' ' ' LYS . 70.4 m -73.42 -18.78 61.1 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.599 -0.273 . . . . 65.450000000000003 111.294 -179.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.486 HE21 ' HA ' ' A' ' 69' ' ' PHE . 29.7 pt20 -106.52 4.1 27.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.367 0.604 . . . . 75.200000000000003 110.194 176.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 56.3 mmtt -105.11 107.58 18.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.599 -0.728 . . . . 71.349999999999994 110.183 177.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.3 t -56.89 -33.0 66.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.976 0.417 . . . . 65.219999999999999 110.598 -178.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.8 p -80.87 -52.12 7.83 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.123 -0.49 . . . . 74.409999999999997 111.293 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.618 ' HA ' HD13 ' A' ' 79' ' ' LEU . 72.9 mtp -67.76 -12.77 61.25 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.843 0.354 . . . . 64.150000000000006 111.578 -177.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.761 ' HE2' ' HA ' ' A' ' 71' ' ' SER . 16.7 mmtt -61.83 -25.96 67.83 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.072 -0.513 . . . . 62.229999999999997 110.513 174.181 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.448 ' O ' ' HE2' ' A' ' 81' ' ' LYS . 3.6 mm-40 -94.95 -5.31 45.02 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.411 0.625 . . . . 74.310000000000002 110.131 -178.581 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.618 HD13 ' HA ' ' A' ' 76' ' ' MET . 8.5 mp -92.43 -56.84 2.89 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.265 -0.88 . . . . 74.430000000000007 110.094 178.1 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.821 ' HB3' HD13 ' A' ' 84' ' ' LEU . 3.7 mm? -83.22 -4.47 58.44 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.023 -0.535 . . . . 62.0 111.752 -174.133 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.9 ' HD2' ' HG ' ' A' ' 12' ' ' LEU . 64.9 pttt -56.46 -18.5 11.57 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.611 0.597 . . . . 74.409999999999997 112.611 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -76.25 -26.03 55.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.76 0.314 . . . . 74.25 111.55 -177.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 7.5 p -116.14 -28.51 2.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.84 0.352 . . . . 71.140000000000001 111.375 -177.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.821 HD13 ' HB3' ' A' ' 80' ' ' LEU . 8.8 mp -72.74 134.83 81.3 Favored Pre-proline 0 C--N 1.328 -0.342 0 N-CA-C 109.76 -0.459 . . . . 64.129999999999995 109.76 177.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 84' ' ' LEU . 38.1 Cg_exo -60.16 94.3 0.1 OUTLIER 'Trans proline' 0 C--O 1.235 0.332 0 C-N-CA 123.068 2.512 . . . . 52.020000000000003 113.409 -176.042 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -121.03 112.96 19.38 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.764 -0.828 . . . . 74.439999999999998 108.764 173.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.463 ' NZ ' ' HB2' ' A' ' 87' ' ' LYS . 8.7 mtmp? -84.96 -21.23 29.65 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.072 0.463 . . . . 65.239999999999995 111.174 -172.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.419 ' OE2' ' HB2' ' A' ' 87' ' ' LYS . 1.2 pm0 . . . . . 0 C--N 1.322 -0.601 0 CA-C-N 115.897 -0.592 . . . . 62.130000000000003 110.889 -179.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.52 0 N-CA-C 112.132 -0.387 . . . . 64.109999999999999 112.132 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.538 HG13 ' HG ' ' B' ' 103' ' ' LEU . 14.2 p -89.53 -25.45 5.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.317 0.58 . . . . 71.109999999999999 110.146 177.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 103' ' ' LEU . . . . . 0.538 ' HG ' HG13 ' B' ' 102' ' ' VAL . 95.6 mt -128.81 129.45 45.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.923 -0.58 . . . . 62.25 110.177 178.465 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 23.3 mmt -100.25 -72.91 0.65 Allowed 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.483 -0.562 . . . . 72.239999999999995 109.483 179.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -136.99 121.65 18.51 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.219 -0.9 . . . . 61.210000000000001 108.75 176.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -97.05 -38.37 9.79 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.434 0.635 . . . . 71.109999999999999 110.357 -177.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -172.6 114.12 0.51 Allowed Glycine 0 C--N 1.312 -0.755 0 CA-C-N 114.928 -1.033 . . . . 54.009999999999998 111.551 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -121.63 96.85 5.24 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.204 0.526 . . . . 41.030000000000001 111.057 -176.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 9.7 p -103.62 136.77 35.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 108.936 -0.764 . . . . 72.25 108.936 174.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 110' ' ' LEU . . . . . 0.474 ' H ' HD23 ' B' ' 110' ' ' LEU . 2.5 pt? -133.16 154.82 50.26 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.953 0.406 . . . . 74.230000000000004 110.931 -175.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 38.5 m -98.68 117.47 33.22 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.865 -0.607 . . . . 55.240000000000002 110.028 176.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . 0.442 HD22 ' HA ' ' B' ' 112' ' ' LEU . 0.3 OUTLIER -160.96 135.94 7.57 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.015 -1.106 . . . . 75.409999999999997 108.015 177.983 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -84.7 176.51 8.51 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.24 0.543 . . . . 70.109999999999999 111.024 -178.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.461 ' O ' ' HB3' ' B' ' 115' ' ' ASP . . . -123.12 95.79 4.75 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.068 -0.515 . . . . 63.340000000000003 110.078 174.116 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 115' ' ' ASP . . . . . 0.461 ' HB3' ' O ' ' B' ' 114' ' ' ALA . 17.0 t70 75.28 -17.03 0.53 Allowed 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.221 -0.899 . . . . 71.540000000000006 112.256 176.256 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.42 HD22 ' HA ' ' B' ' 116' ' ' LEU . 0.5 OUTLIER -71.97 -73.18 0.2 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.751 0.31 . . . . 73.340000000000003 111.238 -175.699 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 26.0 m -106.5 -10.18 16.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.363 -0.381 . . . . 72.140000000000001 111.902 -173.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . 0.463 ' HA ' ' O ' ' B' ' 188' ' ' GLU . 5.4 m -61.17 115.33 3.71 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.178 -0.465 . . . . 34.43 111.578 -173.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -126.23 164.37 21.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.746 -0.661 . . . . 51.399999999999999 110.232 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 4.9 t -85.24 155.0 21.58 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 110.147 -0.316 . . . . 65.530000000000001 110.147 -177.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . 0.407 HD23 ' HB2' ' B' ' 185' ' ' PRO . 21.2 tp -140.91 146.32 37.28 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.91 -0.404 . . . . 62.219999999999999 109.91 -179.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 122' ' ' ASP . . . . . 0.503 ' HA ' ' NH1' ' B' ' 167' ' ' ARG . 33.0 t70 -93.6 112.96 24.95 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.21 0.528 . . . . 70.310000000000002 111.815 -175.535 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 11.8 tt -81.96 144.33 10.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.358 -0.837 . . . . 63.0 109.059 172.094 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 69.6 m -65.62 103.14 0.81 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.398 0.618 . . . . 73.150000000000006 111.24 -176.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . 0.874 ' HD3' ' H ' ' B' ' 125' ' ' LYS . 0.0 OUTLIER -86.74 32.81 0.65 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.325 -0.852 . . . . 64.349999999999994 111.554 -176.718 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -89.02 13.76 12.19 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.807 -0.633 . . . . 61.140000000000001 110.221 176.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 30.0 t-105 -104.08 100.31 10.06 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.069 -0.514 . . . . 61.310000000000002 109.734 -178.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 20.7 t -156.28 -12.77 0.1 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.008 -0.542 . . . . 70.120000000000005 110.831 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . 0.654 ' OD1' ' HB3' ' B' ' 132' ' ' ASN . 34.4 t30 -89.6 124.4 34.52 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.953 0.406 . . . . 74.230000000000004 111.091 -178.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 4.6 p -163.03 -49.22 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 115.579 -0.737 . . . . 73.25 109.251 173.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 45.5 p90 -88.75 -13.62 39.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.062 -0.517 . . . . 65.109999999999999 110.016 175.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.654 ' HB3' ' OD1' ' B' ' 129' ' ' ASN . 8.1 t30 -67.47 -35.43 79.17 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.115 -0.493 . . . . 72.420000000000002 110.137 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 133' ' ' ILE . . . . . 0.535 HD11 HD21 ' B' ' 129' ' ' ASN . 46.4 mm -64.32 -41.03 91.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.204 0.526 . . . . 75.450000000000003 110.231 175.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.419 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 91.4 mt -70.42 -22.06 62.76 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.926 -0.579 . . . . 73.040000000000006 110.363 177.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.54 ' HB3' ' O ' ' B' ' 132' ' ' ASN . 22.6 ttt180 -68.71 -51.54 40.42 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.679 -0.489 . . . . 74.310000000000002 109.679 171.447 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 136' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 69.7 mm-40 -55.36 -48.74 73.8 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.248 -0.887 . . . . 75.540000000000006 111.508 -179.744 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -87.82 0.64 55.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.47 . . . . 72.450000000000003 111.174 -177.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 33.2 t70 52.14 63.46 2.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.643 0.735 . . . . 74.510000000000005 111.95 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 139' ' ' PHE . . . . . 0.419 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 4.0 m-85 -93.16 0.81 57.28 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.485 -0.779 . . . . 74.120000000000005 109.835 174.081 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 74.3 81.97 0.14 Allowed Pre-proline 0 N--CA 1.465 0.294 0 O-C-N 124.328 1.017 . . . . 73.540000000000006 110.679 -176.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -85.27 127.81 3.45 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 122.521 2.147 . . . . 65.099999999999994 112.904 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -119.35 117.2 27.9 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.885 -0.598 . . . . 75.310000000000002 110.017 174.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -170.57 28.94 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.528 0.68 . . . . 73.099999999999994 109.911 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . 0.854 HD23 ' H ' ' B' ' 144' ' ' LEU . 2.0 pt? -80.97 102.63 10.27 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.582 0.706 . . . . 71.439999999999998 109.577 -179.602 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 16.3 p -104.88 109.82 21.95 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.441 -0.799 . . . . 53.299999999999997 111.764 -173.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -78.43 55.47 1.6 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.23 0.538 . . . . 73.340000000000003 109.887 173.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 147' ' ' VAL . . . . . 0.587 ' CG1' ' HA ' ' A' ' 43' ' ' PHE . 40.7 t -120.38 148.89 23.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.782 -0.645 . . . . 74.140000000000001 110.502 -174.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -170.78 136.45 1.18 Allowed 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.543 -0.91 . . . . 73.310000000000002 108.543 175.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.646 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.8 mp -70.0 91.48 0.68 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.268 -0.424 . . . . 71.420000000000002 109.934 -178.376 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.702 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -93.02 61.05 3.39 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.656 -0.498 . . . . 71.530000000000001 109.656 175.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 151' ' ' PHE . . . . . 0.646 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 50.5 p90 -88.93 165.7 14.42 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.661 -0.699 . . . . 73.430000000000007 110.711 -176.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 152' ' ' LYS . . . . . 0.583 ' HE2' ' HA2' ' B' ' 155' ' ' GLY . 57.9 tttt -98.03 115.87 29.09 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.079 -0.51 . . . . 74.120000000000005 110.172 -178.082 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 153' ' ' CYS . . . . . . . . . . . . . 53.6 t -117.68 103.38 9.97 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.236 -0.438 . . . . 60.329999999999998 110.147 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 65.89 29.14 10.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.444 -0.798 . . . . 74.010000000000005 111.374 175.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 155' ' ' GLY . . . . . 0.583 ' HA2' ' HE2' ' B' ' 152' ' ' LYS . . . 108.5 -33.35 6.28 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.525 -0.845 . . . . 31.120000000000001 112.987 176.495 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 156' ' ' GLU . . . . . 0.571 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 10.1 pt-20 -99.6 140.3 34.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.911 0.386 . . . . 65.209999999999994 110.92 -178.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 50.9 mm -76.63 120.56 27.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.045 -0.525 . . . . 75.540000000000006 110.173 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 158' ' ' LYS . . . . . 0.571 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 29.9 mmmt -110.54 110.05 20.62 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.827 -0.435 . . . . 74.219999999999999 109.827 -177.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . 0.466 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.5 OUTLIER -87.82 126.77 35.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.086 0.47 . . . . 55.119999999999997 111.954 -178.75 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -130.27 124.78 33.19 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.783 -0.644 . . . . 74.209999999999994 110.592 177.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 34.3 t -112.51 -5.94 14.0 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.789 -0.642 . . . . 62.240000000000002 109.899 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -137.8 163.37 31.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.031 -0.531 . . . . 65.140000000000001 109.997 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . 0.653 HD21 HG13 ' A' ' 30' ' ' VAL . 91.5 mt -97.92 1.41 48.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.424 -0.353 . . . . 63.140000000000001 111.583 -176.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -82.47 -53.08 6.27 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.371 -0.604 . . . . 72.329999999999998 109.371 178.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 15.1 m -62.96 -38.89 92.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.74 -0.663 . . . . 54.43 110.039 176.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 53.2 tp -67.66 -35.85 79.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.621 -0.718 . . . . 63.520000000000003 110.951 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . 0.503 ' NH1' ' HA ' ' B' ' 122' ' ' ASP . 54.4 ttp180 -61.09 -46.04 92.28 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.989 0.423 . . . . 73.540000000000006 109.944 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -63.38 -41.31 98.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.632 -0.713 . . . . 64.0 110.611 178.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 169' ' ' PHE . . . . . 0.754 ' HA ' HE21 ' B' ' 172' ' ' GLN . 51.7 t80 -65.32 -46.64 79.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.7 -0.682 . . . . 72.120000000000005 110.985 -178.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -66.23 -28.38 68.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.361 -0.381 . . . . 61.119999999999997 111.373 -178.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 40.2 m -75.28 -34.06 61.3 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.52 -0.309 . . . . 72.129999999999995 111.305 -178.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . 0.754 HE21 ' HA ' ' B' ' 169' ' ' PHE . 29.6 pt20 -81.97 -25.56 34.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.247 0.546 . . . . 74.120000000000005 110.229 178.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 58.0 mmtt -81.25 109.11 15.46 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.587 -0.733 . . . . 71.450000000000003 110.762 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 11.8 t -67.2 -24.36 65.84 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.074 -0.713 . . . . 72.109999999999999 109.074 176.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 4.8 m -82.68 -12.26 57.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.411 -0.813 . . . . 73.420000000000002 111.617 -179.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.426 ' O ' ' HB2' ' B' ' 179' ' ' LEU . 79.1 mtp -121.77 -10.05 8.77 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.924 0.392 . . . . 71.049999999999997 111.441 -179.203 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . 0.403 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 89.0 tttt -64.81 -34.99 79.65 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.083 -0.508 . . . . 72.409999999999997 111.056 -177.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -84.43 -6.67 59.4 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 122.001 0.905 . . . . 65.540000000000006 109.494 -176.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 179' ' ' LEU . . . . . 0.488 ' HB3' HG21 ' A' ' 33' ' ' ILE . 11.0 mp -90.33 -56.29 3.27 Favored 'General case' 0 N--CA 1.438 -1.06 0 CA-C-N 114.054 -1.43 . . . . 73.540000000000006 109.801 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.01 -10.64 56.78 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.782 -0.644 . . . . 63.229999999999997 112.242 -173.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 181' ' ' LYS . . . . . 0.569 ' HB2' ' OE1' ' B' ' 186' ' ' GLN . 64.0 pttt -64.8 -5.92 6.97 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.405 -0.518 . . . . 73.019999999999996 111.493 178.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -74.75 -30.99 61.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.201 -0.454 . . . . 62.130000000000003 110.434 175.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 183' ' ' VAL . . . . . 0.458 ' HB ' HD22 ' A' ' 29' ' ' ASN . 10.7 p -104.58 -18.87 6.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 52.329999999999998 110.764 -178.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 184' ' ' LEU . . . . . 0.439 ' HB2' ' HA ' ' B' ' 181' ' ' LYS . 9.1 mp -76.64 137.1 67.01 Favored Pre-proline 0 C--N 1.33 -0.258 0 N-CA-C 109.898 -0.408 . . . . 74.430000000000007 109.898 176.276 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 185' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' B' ' 184' ' ' LEU . 9.4 Cg_exo -71.51 81.17 1.3 Allowed 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.816 2.344 . . . . 64.319999999999993 112.256 -178.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 186' ' ' GLN . . . . . 0.569 ' OE1' ' HB2' ' B' ' 181' ' ' LYS . 85.8 mt-30 -115.68 141.34 48.21 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.957 -0.565 . . . . 64.239999999999995 109.584 179.108 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -107.53 -25.83 11.19 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.587 -0.733 . . . . 70.010000000000005 109.991 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 188' ' ' GLU . . . . . 0.463 ' O ' ' HA ' ' B' ' 118' ' ' SER . 0.5 OUTLIER . . . . . 0 C--O 1.251 1.172 0 CA-C-O 118.298 -0.858 . . . . 74.329999999999998 109.722 177.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.851 0 N-CA-C 112.273 -0.331 . . . . 72.299999999999997 112.273 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.726 HG23 ' HG2' ' A' ' 4' ' ' MET . 22.8 m -97.71 176.91 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 120.751 0.31 . . . . 64.319999999999993 110.518 -179.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.437 HD12 ' N ' ' A' ' 3' ' ' LEU . 5.6 mp -75.03 97.38 3.39 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.125 -0.489 . . . . 74.530000000000001 110.076 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.726 ' HG2' HG23 ' A' ' 2' ' ' VAL . 87.7 mmm -127.14 102.05 6.78 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.821 -0.627 . . . . 52.109999999999999 110.982 -177.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -97.76 107.7 20.25 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.59 0.709 . . . . 72.049999999999997 109.217 172.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -143.16 -179.52 6.43 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 114.521 -1.218 . . . . 74.439999999999998 110.001 -173.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -178.86 -117.48 0.54 Allowed Glycine 0 N--CA 1.443 -0.835 0 N-CA-C 111.554 -0.619 . . . . 62.439999999999998 111.554 178.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -150.3 138.24 20.11 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 110.1 -0.333 . . . . 75.230000000000004 110.1 178.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 35.0 m -66.82 159.85 4.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.175 -0.466 . . . . 55.200000000000003 109.985 174.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 68.5 mt -56.59 101.4 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.139 0.495 . . . . 73.430000000000007 111.025 -177.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 59.7 m -96.09 107.98 20.36 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.581 -0.736 . . . . 70.409999999999997 110.282 178.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.41 HD23 ' N ' ' A' ' 13' ' ' ALA . 1.9 tt -141.35 136.52 31.57 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 108.2 -1.037 . . . . 60.229999999999997 108.2 179.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.41 ' N ' HD23 ' A' ' 12' ' ' LEU . . . -64.91 162.43 16.42 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.095 0.474 . . . . 64.340000000000003 111.885 -174.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -89.5 -43.74 10.62 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.956 -0.566 . . . . 74.140000000000001 110.527 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -111.05 -41.58 4.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.251 -0.432 . . . . 75.299999999999997 110.778 179.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.5 mt -87.62 46.42 1.38 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.012 -0.54 . . . . 71.109999999999999 109.709 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.6 m -78.17 51.1 0.96 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.261 -0.881 . . . . 72.430000000000007 110.72 -173.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 46.2 m -67.64 136.39 54.32 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 114.986 -1.006 . . . . 54.43 111.061 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -113.93 4.61 15.85 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.279 -0.419 . . . . 61.119999999999997 111.128 -178.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 28.3 m -87.46 119.58 27.88 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.186 -0.461 . . . . 31.5 109.868 177.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -83.22 153.3 24.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.124 0.487 . . . . 70.430000000000007 111.577 -176.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -84.55 144.17 28.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.523 -0.762 . . . . 74.420000000000002 110.342 177.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 6.0 tp -60.36 116.62 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.592 0.71 . . . . 63.420000000000002 110.738 -178.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.632 ' HB3' ' HB3' ' B' ' 124' ' ' SER . 32.0 m -85.23 123.14 30.39 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.336 -0.847 . . . . 50.219999999999999 110.814 -177.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.557 ' HG2' ' OE1' ' A' ' 26' ' ' GLN . 0.0 OUTLIER -132.71 14.8 4.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.174 0.512 . . . . 73.400000000000006 111.038 179.468 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.557 ' OE1' ' HG2' ' A' ' 25' ' ' LYS . 2.8 mp0 -97.72 82.96 3.12 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.275 -0.639 . . . . 74.129999999999995 109.275 175.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.418 ' HZ2' ' HB2' ' A' ' 63' ' ' LEU . 86.9 m95 -100.83 -75.05 0.59 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.968 0.413 . . . . 72.510000000000005 111.786 -174.089 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 14.6 m -83.33 19.86 1.43 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.835 0.679 . . . . 74.430000000000007 112.835 -169.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.522 ' OD1' ' HB ' ' B' ' 183' ' ' VAL . 27.3 t-20 -85.82 -21.49 28.09 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 122.073 -0.392 . . . . 74.450000000000003 110.629 179.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.711 HG12 ' HG ' ' B' ' 163' ' ' LEU . 27.5 m -55.79 -37.32 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 112.593 0.59 . . . . 63.439999999999998 112.593 -174.416 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.438 ' HB3' HD11 ' B' ' 149' ' ' LEU . 53.1 p90 -101.99 -5.41 24.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.713 0.292 . . . . 74.420000000000002 110.99 -177.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.554 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 8.7 t30 -62.96 -57.23 11.45 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.211 -0.449 . . . . 60.130000000000003 111.478 -172.348 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.586 HG21 ' HB3' ' B' ' 179' ' ' LEU . 4.2 mp -65.35 -37.2 79.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.142 0.496 . . . . 71.109999999999999 110.985 -176.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.0 mt -63.92 -32.37 73.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.978 -0.555 . . . . 64.120000000000005 110.527 178.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -77.08 -29.16 54.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.745 -0.661 . . . . 72.400000000000006 110.417 178.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' A' ' 32' ' ' ASN . 95.6 mt-10 -70.21 -47.98 59.08 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.073 -0.512 . . . . 74.549999999999997 110.952 177.567 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -92.13 6.09 47.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.067 -0.515 . . . . 70.430000000000007 111.536 -175.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 57.2 60.67 2.84 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 113.089 0.774 . . . . 71.120000000000005 113.089 177.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -86.32 -1.1 57.21 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.883 -0.784 . . . . 75.400000000000006 108.883 167.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 60.43 78.15 0.34 Allowed Pre-proline 0 C--O 1.235 0.291 0 CA-C-N 114.333 -1.303 . . . . 64.219999999999999 110.946 -179.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -79.14 161.77 26.14 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.639 2.226 . . . . 72.019999999999996 111.529 177.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.42 ' HB3' ' H ' ' A' ' 43' ' ' PHE . 12.7 mptt -91.22 -162.88 0.96 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.146 0.498 . . . . 72.030000000000001 111.63 -179.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.42 ' H ' ' HB3' ' A' ' 42' ' ' LYS . 12.8 p90 -85.42 154.38 21.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.297 -0.865 . . . . 71.230000000000004 112.053 -172.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.413 ' N ' HD22 ' A' ' 44' ' ' LEU . 2.9 mm? -110.73 79.45 1.21 Allowed 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.391 -0.822 . . . . 71.319999999999993 109.06 175.086 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 37.8 t -76.84 93.01 3.67 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.916 -0.583 . . . . 54.399999999999999 109.516 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -67.16 108.54 2.72 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.864 -0.607 . . . . 73.519999999999996 110.226 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.465 HG11 ' HB3' ' B' ' 145' ' ' CYS . 15.3 m -87.2 152.19 3.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 N-CA-C 108.784 -0.821 . . . . 72.120000000000005 108.784 172.116 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.589 ' HD2' ' H ' ' A' ' 48' ' ' LYS . 0.1 OUTLIER -102.46 140.22 37.02 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.947 -0.76 . . . . 62.100000000000001 108.947 -175.934 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.779 HD11 ' HB3' ' B' ' 131' ' ' PHE . 9.6 tp -66.01 -33.25 75.37 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.973 -0.751 . . . . 75.319999999999993 108.973 175.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.548 ' HB3' ' HG2' ' B' ' 142' ' ' LYS . . . 43.09 43.43 3.76 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 124.484 1.115 . . . . 75.099999999999994 112.639 169.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 41.6 p90 -84.55 165.08 18.33 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.061 -0.518 . . . . 51.420000000000002 110.544 -176.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -101.17 115.26 30.08 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.048 -0.524 . . . . 74.219999999999999 110.561 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.608 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 42.5 t -108.37 102.3 11.42 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.782 -0.644 . . . . 73.400000000000006 109.844 178.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.4 t70 68.2 8.39 6.53 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.878 -0.601 . . . . 72.200000000000003 111.435 174.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 129.52 -32.06 3.28 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.476 -0.869 . . . . 75.140000000000001 112.654 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.763 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 11.6 pt-20 -92.71 141.65 28.23 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.783 0.325 . . . . 74.109999999999999 110.602 -178.644 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.4 mm -85.88 120.71 36.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.708 -0.478 . . . . 72.319999999999993 109.708 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.763 ' HD3' ' HG3' ' A' ' 56' ' ' GLU . 26.7 mmmt -108.4 119.22 38.88 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.032 0.444 . . . . 73.129999999999995 110.634 -177.567 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.4 p -95.5 108.58 20.82 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.34 0.591 . . . . 65.25 111.838 -179.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -129.71 145.98 51.5 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.4 -0.818 . . . . 74.340000000000003 109.616 176.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.6 m -131.24 14.51 5.11 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.031 0.443 . . . . 71.099999999999994 110.576 178.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -152.3 173.14 15.4 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.991 -0.55 . . . . 71.340000000000003 109.631 177.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.854 ' HG ' HG12 ' B' ' 130' ' ' VAL . 3.1 mt -90.53 -25.68 20.12 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.264 0.468 . . . . 72.510000000000005 112.264 -174.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 51.0 tp60 -73.23 -43.55 61.02 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.651 0.262 . . . . 71.239999999999995 110.786 -173.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.0 p -68.09 -40.85 82.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.231 -0.44 . . . . 71.430000000000007 110.672 179.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.482 HD23 ' O ' ' A' ' 66' ' ' LEU . 6.3 tt -67.35 -36.65 81.82 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.05 -0.523 . . . . 72.5 109.969 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.642 ' HG3' HD13 ' A' ' 84' ' ' LEU . 66.7 ttt180 -58.21 -34.51 70.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.953 -0.567 . . . . 73.329999999999998 110.618 -179.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -59.27 -51.81 68.35 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.909 -0.587 . . . . 74.439999999999998 110.59 175.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -70.8 -45.94 63.73 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.024 -0.989 . . . . 72.519999999999996 111.195 -174.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.59 -31.22 71.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.298 -0.41 . . . . 62.200000000000003 111.859 -178.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.7 t -72.79 -40.88 65.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.706 0.289 . . . . 65.319999999999993 110.933 -178.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -82.85 -12.77 57.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.012 0.434 . . . . 74.439999999999998 111.226 -176.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.608 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 31.0 mmmt -80.78 143.37 32.92 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.244 -0.434 . . . . 74.25 110.141 174.216 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 5.5 m -77.18 -46.43 23.38 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.085 0.469 . . . . 61.299999999999997 109.949 178.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 14.0 p -70.15 -50.23 42.59 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.756 -0.657 . . . . 74.25 111.413 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.55 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 68.2 mtp -66.36 -20.13 65.99 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.409 -0.359 . . . . 74.450000000000003 111.571 -175.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 4.5 ttmp? -61.23 -31.76 71.55 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.017 0.437 . . . . 61.240000000000002 110.492 177.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -97.36 1.42 49.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.452 0.644 . . . . 50.310000000000002 110.585 -177.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.476 ' HB3' HG21 ' B' ' 133' ' ' ILE . 81.4 mt -98.12 -47.59 5.43 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.377 -0.828 . . . . 64.430000000000007 109.433 177.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.577 ' HB3' HD12 ' A' ' 84' ' ' LEU . 4.2 mm? -85.5 -8.57 58.27 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.492 -0.776 . . . . 65.129999999999995 111.463 -177.035 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -56.84 -20.63 23.82 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.868 0.366 . . . . 54.509999999999998 111.284 176.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -72.73 -45.54 58.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.192 -0.458 . . . . 74.109999999999999 111.46 -176.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 27.1 m -105.67 -22.6 4.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 112.494 0.553 . . . . 74.5 112.494 -174.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.642 HD13 ' HG3' ' A' ' 67' ' ' ARG . 94.2 mt -98.12 126.89 38.48 Favored Pre-proline 0 C--N 1.324 -0.537 0 C-N-CA 120.753 -0.379 . . . . 70.319999999999993 110.107 -179.444 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -53.11 127.76 26.35 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 123.408 2.739 . . . . 70.409999999999997 112.502 -178.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 86.0 mm-40 -122.59 -160.03 0.86 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.662 -0.699 . . . . 73.439999999999998 110.23 -178.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm 67.39 13.4 9.33 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.481 0.712 . . . . 73.109999999999999 111.519 178.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 115.515 -0.766 . . . . 72.439999999999998 111.1 177.679 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.465 0 N-CA-C 112.003 -0.439 . . . . 73.329999999999998 112.003 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.483 HG12 ' HG2' ' B' ' 104' ' ' MET . 48.2 t -91.84 108.37 19.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.814 0.34 . . . . 63.219999999999999 110.176 178.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 10.0 mp -80.07 104.73 10.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.207 0.527 . . . . 62.310000000000002 111.267 -177.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 104' ' ' MET . . . . . 0.483 ' HG2' HG12 ' B' ' 102' ' ' VAL . 87.9 mmm -127.61 100.75 6.11 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.216 -0.902 . . . . 72.209999999999994 109.043 176.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 45.9 m-20 -98.27 126.86 43.94 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.279 0.561 . . . . 75.010000000000005 111.371 -173.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -153.73 108.71 3.14 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.122 -0.945 . . . . 64.219999999999999 108.785 177.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -73.01 -97.08 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.628 -0.796 . . . . 71.319999999999993 112.482 -176.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -135.39 174.56 10.48 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.862 0.363 . . . . 74.099999999999994 110.321 -178.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 p -87.12 103.0 12.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 121.635 0.731 . . . . 72.409999999999997 110.066 177.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 5.0 tt -75.62 104.0 5.98 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.683 -0.689 . . . . 75.140000000000001 109.149 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 56.5 m -149.93 118.25 6.43 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.011 0.434 . . . . 64.299999999999997 111.036 -178.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . 0.417 HD13 ' N ' ' B' ' 113' ' ' ALA . 1.2 tm? -89.45 131.51 35.46 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.669 -0.863 . . . . 72.549999999999997 108.669 174.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 113' ' ' ALA . . . . . 0.553 ' HB3' ' HA ' ' B' ' 117' ' ' SER . . . -55.13 128.34 33.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.828 0.346 . . . . 72.140000000000001 111.589 -177.533 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -91.06 -44.4 9.32 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.31 -0.405 . . . . 34.109999999999999 111.778 -177.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -79.15 -55.7 4.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.087 -0.506 . . . . 71.450000000000003 110.696 -174.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 6.6 mp -90.56 -28.53 18.41 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.002 -0.545 . . . . 74.010000000000005 110.368 -178.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.553 ' HA ' ' HB3' ' B' ' 113' ' ' ALA . 50.7 m 50.96 58.01 6.03 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.534 -0.757 . . . . 65.010000000000005 110.906 -175.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 3.4 m -70.67 74.49 0.58 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.902 -1.044 . . . . 74.239999999999995 110.39 178.064 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -101.5 9.89 40.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.537 -0.756 . . . . 74.230000000000004 110.202 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 21.5 m -88.27 117.38 27.14 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.48 -0.782 . . . . 74.400000000000006 109.616 177.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . 0.519 ' HB2' ' HA ' ' B' ' 183' ' ' VAL . 3.5 mm? -70.04 167.07 18.39 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.22 -0.446 . . . . 63.409999999999997 110.867 -178.086 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -142.46 143.6 32.67 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.996 -0.547 . . . . 71.230000000000004 109.956 -176.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 5.1 tp -66.45 108.11 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.783 0.802 . . . . 75.400000000000006 111.399 -176.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.632 ' HB3' ' HB3' ' A' ' 24' ' ' SER . 48.1 m -91.86 141.14 28.98 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.277 -0.874 . . . . 74.200000000000003 110.156 178.648 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.51 17.21 3.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.903 0.382 . . . . 63.140000000000001 111.644 -178.323 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -101.12 91.72 4.67 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.076 0.465 . . . . 52.520000000000003 110.132 176.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 39.5 m95 -114.89 -57.44 2.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.738 -0.664 . . . . 71.109999999999999 110.426 -176.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 19.4 m -82.35 -1.77 50.81 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.71 -0.677 . . . . 61.409999999999997 111.692 -173.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . 0.422 ' HA ' ' HB2' ' B' ' 132' ' ' ASN . 9.8 t-20 -77.96 -14.19 59.62 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.988 0.423 . . . . 74.5 110.496 -177.62 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.854 HG12 ' HG ' ' A' ' 63' ' ' LEU . 35.6 m -63.01 -32.76 57.3 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-N 116.25 -0.432 . . . . 63.310000000000002 111.982 -176.301 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 131' ' ' PHE . . . . . 0.779 ' HB3' HD11 ' A' ' 49' ' ' LEU . 53.8 p90 -108.93 3.56 22.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.743 0.306 . . . . 74.450000000000003 110.823 -178.457 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.422 ' HB2' ' HA ' ' B' ' 129' ' ' ASN . 7.5 t30 -62.79 -50.63 70.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.018 -0.537 . . . . 73.329999999999998 111.151 -173.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 133' ' ' ILE . . . . . 0.476 HG21 ' HB3' ' A' ' 79' ' ' LEU . 3.4 mp -68.39 -41.52 83.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.176 0.512 . . . . 73.219999999999999 110.456 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.409 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 88.8 mt -62.95 -29.22 70.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.739 -0.664 . . . . 43.229999999999997 111.172 -178.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -72.02 -40.11 68.7 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.197 -0.456 . . . . 70.430000000000007 110.692 179.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 136' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 9.6 mm-40 -72.8 -32.09 65.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.13 -0.486 . . . . 70.439999999999998 110.79 -178.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -95.48 3.72 53.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.005 -0.543 . . . . 72.510000000000005 111.072 -179.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 53.19 58.14 5.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.435 -0.802 . . . . 74.409999999999997 112.8 177.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 139' ' ' PHE . . . . . 0.409 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 3.4 m-85 -89.31 -1.07 57.92 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.282 0.563 . . . . 63.020000000000003 109.604 170.472 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 63.58 84.05 0.19 Allowed Pre-proline 0 C--O 1.233 0.225 0 CA-C-N 114.508 -1.224 . . . . 74.430000000000007 111.534 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.488 ' HB3' ' HB2' ' B' ' 131' ' ' PHE . 60.0 Cg_endo -75.19 132.83 15.6 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.463 2.109 . . . . 52.32 110.604 172.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 142' ' ' LYS . . . . . 0.548 ' HG2' ' HB3' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -79.86 -171.09 2.71 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.605 0.595 . . . . 74.329999999999998 112.605 -173.205 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 13.5 p90 -68.67 131.59 45.45 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.156 0.799 . . . . 72.209999999999994 113.156 -163.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -90.22 85.54 6.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.543 -0.753 . . . . 71.25 109.838 174.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 145' ' ' CYS . . . . . 0.465 ' HB3' HG11 ' A' ' 47' ' ' VAL . 45.4 t -82.07 106.18 13.77 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.42 -0.585 . . . . 64.310000000000002 109.42 177.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.55 94.91 6.98 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.899 -0.592 . . . . 74.25 111.389 -176.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 8.3 m -84.24 152.07 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 N-CA-C 108.438 -0.949 . . . . 70.239999999999995 108.438 170.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . 0.426 ' HD3' ' H ' ' B' ' 148' ' ' LYS . 0.0 OUTLIER -121.28 145.27 48.04 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.896 -0.409 . . . . 71.25 109.896 -173.163 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.628 ' HB3' ' HD1' ' B' ' 151' ' ' PHE . 4.2 mm? -53.44 -46.15 69.74 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 123.48 0.488 . . . . 72.140000000000001 109.963 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.416 ' HB2' ' HE3' ' B' ' 148' ' ' LYS . . . 48.14 36.35 6.48 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 124.118 0.886 . . . . 22.129999999999999 111.871 174.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 151' ' ' PHE . . . . . 0.628 ' HD1' ' HB3' ' B' ' 149' ' ' LEU . 42.3 p90 -82.59 169.68 16.02 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.099 -0.5 . . . . 72.310000000000002 109.952 -178.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 28.4 ttmt -106.39 125.34 50.87 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.214 -0.448 . . . . 65.340000000000003 110.581 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 153' ' ' CYS . . . . . . . . . . . . . 35.4 t -124.96 105.2 9.03 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.279 -0.637 . . . . 60.539999999999999 109.279 177.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 34.7 t70 67.19 28.6 8.09 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.529 0.68 . . . . 62.009999999999998 110.81 176.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 107.12 -35.76 4.83 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.552 -0.832 . . . . 73.209999999999994 112.877 175.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 156' ' ' GLU . . . . . 0.401 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 10.7 pt-20 -92.87 145.26 24.52 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.047 0.451 . . . . 54.32 110.762 -177.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 50.0 mm -84.74 125.13 40.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.755 -0.657 . . . . 54.240000000000002 110.06 -179.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 158' ' ' LYS . . . . . 0.401 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 28.6 mmmt -106.17 110.77 23.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.141 0.496 . . . . 72.310000000000002 110.063 -178.579 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -98.34 107.49 19.97 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.924 -0.58 . . . . 72.109999999999999 112.119 -175.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -131.53 151.97 51.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.54 -0.755 . . . . 75.439999999999998 109.928 176.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 64.3 m -131.29 5.63 4.45 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.346 0.594 . . . . 63.149999999999999 109.89 173.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -125.4 145.13 50.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.541 -0.754 . . . . 64.310000000000002 109.894 -179.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . 0.711 ' HG ' HG12 ' A' ' 30' ' ' VAL . 1.0 OUTLIER -71.58 -35.11 70.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.098 0.475 . . . . 51.109999999999999 109.776 178.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 164' ' ' GLN . . . . . 0.473 ' O ' ' HG2' ' B' ' 168' ' ' LYS . 50.5 tp60 -66.72 -42.73 85.86 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.934 -0.575 . . . . 72.140000000000001 111.414 -176.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 10.3 p -69.6 -39.22 77.38 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.846 0.355 . . . . 64.129999999999995 110.925 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 54.0 tp -65.53 -36.24 83.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.964 0.412 . . . . 72.420000000000002 109.973 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . 0.429 ' HB3' ' O ' ' B' ' 164' ' ' GLN . 61.4 ttt180 -57.29 -39.84 76.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.711 -0.677 . . . . 74.400000000000006 110.57 174.176 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 168' ' ' LYS . . . . . 0.58 ' HZ2' ' HB3' ' B' ' 168' ' ' LYS . 2.8 mmmp? -60.39 -39.24 86.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.717 -0.674 . . . . 62.350000000000001 110.91 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -77.66 -45.02 26.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.081 -0.509 . . . . 64.209999999999994 110.799 -178.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 170' ' ' ALA . . . . . 0.755 ' HB2' HD12 ' B' ' 180' ' ' LEU . . . -59.19 -38.1 79.02 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.115 -0.493 . . . . 75.430000000000007 111.666 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 8.7 t -65.55 -31.68 72.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.092 -0.504 . . . . 72.319999999999993 111.157 -176.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -94.17 4.62 53.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.988 0.423 . . . . 71.439999999999998 110.718 -179.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -105.55 140.84 38.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.23 -0.441 . . . . 74.549999999999997 110.477 177.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.4 p -67.26 -54.92 16.47 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.994 -0.548 . . . . 71.219999999999999 111.166 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 175' ' ' SER . . . . . 0.444 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 25.0 p -76.55 -46.99 24.06 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.829 -0.623 . . . . 71.430000000000007 111.653 -174.548 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 69.8 mtp -66.49 -21.59 66.18 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.127 0.417 . . . . 74.230000000000004 112.127 -174.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . 0.417 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 4.2 ttmp? -64.94 -29.26 70.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.21 0.528 . . . . 63.119999999999997 109.828 176.132 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -94.7 -13.77 25.45 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 115.578 -0.737 . . . . 62.539999999999999 110.084 -176.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 179' ' ' LEU . . . . . 0.586 ' HB3' HG21 ' A' ' 33' ' ' ILE . 81.6 mt -86.71 -47.94 8.7 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.389 -0.823 . . . . 60.450000000000003 109.823 178.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 180' ' ' LEU . . . . . 0.755 HD12 ' HB2' ' B' ' 170' ' ' ALA . 8.9 mt -89.81 -2.17 58.16 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.759 -0.655 . . . . 64.450000000000003 111.339 -173.212 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 181' ' ' LYS . . . . . 0.417 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 64.1 pttt -64.92 -9.07 18.41 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.298 0.571 . . . . 74.420000000000002 110.518 173.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -61.71 -33.88 74.81 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.571 -0.741 . . . . 55.25 109.914 175.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 183' ' ' VAL . . . . . 0.522 ' HB ' ' OD1' ' A' ' 29' ' ' ASN . 14.3 p -113.15 -29.4 2.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 115.845 -0.616 . . . . 62.5 110.99 178.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 184' ' ' LEU . . . . . . . . . . . . . 91.8 mt -91.52 118.17 68.23 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.431 -0.35 . . . . 75.030000000000001 110.975 -176.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_exo -61.54 130.54 32.07 Favored 'Trans proline' 0 C--O 1.236 0.399 0 C-N-CA 122.835 2.357 . . . . 55.43 111.862 178.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 87.7 mm-40 -105.94 -152.68 0.48 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.938 -0.574 . . . . 74.340000000000003 110.685 -177.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 63.2 mttm 61.53 34.21 18.03 Favored 'General case' 0 N--CA 1.447 -0.625 0 O-C-N 123.994 0.809 . . . . 70.140000000000001 112.313 178.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.425 -0.798 . . . . 65.530000000000001 109.012 171.553 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.759 0 N-CA-C 112.065 -0.414 . . . . 43.450000000000003 112.065 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 27.0 m -108.88 1.23 9.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.138 0.494 . . . . 64.030000000000001 110.445 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 90.6 mt -99.15 -143.97 0.32 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.776 -0.647 . . . . 71.219999999999999 109.63 178.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.432 ' HG2' ' O ' ' A' ' 4' ' ' MET . 1.2 pmm? -73.62 81.67 1.52 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.797 0.808 . . . . 73.209999999999994 110.644 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -106.09 119.14 38.43 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.369 -0.832 . . . . 55.219999999999999 109.986 -178.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -108.09 9.61 28.31 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.441 -0.799 . . . . 73.420000000000002 111.28 -175.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 152.11 -85.78 0.15 Allowed Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.339 -0.934 . . . . 73.430000000000007 112.76 -178.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -155.35 156.91 36.28 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.971 0.415 . . . . 45.420000000000002 111.432 -177.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 28.9 m -83.5 173.3 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.88 -0.6 . . . . 61.219999999999999 110.78 176.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.7 mp -90.98 132.71 35.82 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.187 -0.46 . . . . 75.150000000000006 111.08 -177.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 26.7 m -120.75 121.6 38.57 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.891 -0.595 . . . . 65.310000000000002 109.931 177.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.8 tt -93.43 122.25 35.66 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.313 -0.625 . . . . 64.510000000000005 109.313 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.709 ' H ' ' HB3' ' A' ' 17' ' ' SER . . . -125.94 149.33 48.82 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.634 -0.712 . . . . 54.25 110.285 -179.753 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.65 -17.09 63.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.164 -0.471 . . . . 65.329999999999998 112.177 -175.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 23.2 p-10 -133.29 -44.54 0.84 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.896 0.379 . . . . 75.329999999999998 111.157 -178.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.69 44.26 1.19 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.991 0.424 . . . . 75.319999999999993 110.575 -176.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.709 ' HB3' ' H ' ' A' ' 13' ' ' ALA . 22.9 t -176.56 -52.48 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.692 -0.685 . . . . 54.409999999999997 109.225 -179.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.0 t -87.69 93.44 9.44 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.515 -0.55 . . . . 74.129999999999995 109.515 174.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -92.77 -158.77 0.62 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.927 -0.579 . . . . 54.020000000000003 111.769 -174.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.67 -157.85 0.24 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.671 -0.695 . . . . 61.399999999999999 110.82 -178.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.499 HD23 ' H ' ' A' ' 21' ' ' LEU . 2.6 pt? -71.38 -175.73 1.33 Allowed 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.328 0.585 . . . . 64.349999999999994 111.515 -176.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.436 ' O ' ' HB ' ' A' ' 23' ' ' ILE . 6.2 p-10 -106.16 178.58 4.52 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.332 -0.849 . . . . 62.140000000000001 111.566 -173.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.567 HG23 ' HB2' ' B' ' 122' ' ' ASP . 17.3 tt 169.35 128.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 114.476 -1.238 . . . . 62.140000000000001 108.054 172.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.7 p -147.82 141.46 25.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.205 0.526 . . . . 54.130000000000003 112.055 -172.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.793 ' HB3' ' HA ' ' B' ' 117' ' ' SER . 34.5 mttp -136.58 -7.45 1.94 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.632 -0.713 . . . . 73.129999999999995 110.561 177.011 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.652 ' HG2' HD22 ' B' ' 163' ' ' LEU . 21.3 mp0 -87.29 99.52 12.03 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.513 -0.767 . . . . 52.229999999999997 111.237 -166.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.583 ' CZ2' ' HB2' ' A' ' 62' ' ' ASP . 68.5 m95 -110.99 -74.33 0.65 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.408 -0.815 . . . . 72.439999999999998 111.466 -179.384 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 44.8 t -88.26 -62.85 1.4 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.737 -0.665 . . . . 54.030000000000001 112.144 -171.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.52 ' HA ' ' HB3' ' A' ' 32' ' ' ASN . 57.9 t30 -80.28 68.53 6.47 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.338 0.589 . . . . 71.5 111.951 -170.405 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 48.5 t -120.11 -63.1 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 108.698 -0.852 . . . . 62.420000000000002 108.698 171.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -88.04 -6.59 57.88 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.191 -0.913 . . . . 70.219999999999999 110.292 175.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.52 ' HB3' ' HA ' ' A' ' 29' ' ' ASN . 10.6 t30 -65.38 -43.04 92.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.548 -0.751 . . . . 72.519999999999996 111.074 -176.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.839 HG21 ' HB3' ' B' ' 179' ' ' LEU . 38.5 mm -60.41 -40.27 83.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-O 121.478 0.656 . . . . 72.400000000000006 110.594 177.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.705 HD12 HD21 ' B' ' 149' ' ' LEU . 82.9 mt -69.23 -25.84 64.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.489 -0.778 . . . . 73.099999999999994 110.71 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 54.1 ttt180 -67.47 -47.49 69.95 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.117 -0.492 . . . . 71.549999999999997 110.085 175.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -64.11 -39.3 93.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.499 -0.773 . . . . 63.140000000000001 111.777 -177.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -97.43 8.37 44.74 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.348 -0.387 . . . . 52.299999999999997 111.036 -175.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 14.3 t70 53.32 64.38 1.87 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.213 -0.903 . . . . 70.400000000000006 111.949 177.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.667 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 16.8 m-85 -92.82 -6.24 49.29 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.307 -0.627 . . . . 73.099999999999994 109.307 167.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 69.43 88.43 0.1 Allowed Pre-proline 0 CA--C 1.53 0.182 0 CA-C-N 114.789 -1.096 . . . . 71.200000000000003 111.233 -178.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.443 ' HA ' HD11 ' B' ' 149' ' ' LEU . 16.8 Cg_exo -67.23 135.03 35.63 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.633 2.222 . . . . 71.420000000000002 110.505 174.119 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.657 ' H ' HD12 ' B' ' 149' ' ' LEU . 33.4 tptt -80.66 -74.47 0.31 Allowed 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.284 -0.566 . . . . 53.130000000000003 111.565 -171.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.575 ' HD2' HG22 ' B' ' 147' ' ' VAL . 44.7 t80 -120.53 130.19 54.14 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.864 0.364 . . . . 75.319999999999993 110.024 -178.36 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -78.18 146.33 35.08 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.063 -0.517 . . . . 71.329999999999998 110.031 -179.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 49.0 t -78.04 88.11 4.18 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.214 0.531 . . . . 63.229999999999997 110.781 -177.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -117.1 11.71 14.29 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 122.01 0.909 . . . . 53.549999999999997 109.024 174.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 48.9 t -91.26 104.52 15.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.182 -0.917 . . . . 73.439999999999998 110.246 -178.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.446 ' HD2' ' H ' ' A' ' 48' ' ' LYS . 0.1 OUTLIER -114.68 142.22 46.77 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.62 -0.718 . . . . 61.200000000000003 109.637 177.731 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.735 ' HB3' ' HD1' ' A' ' 51' ' ' PHE . 7.1 mp -57.74 -44.77 86.29 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.334 0.494 . . . . 72.450000000000003 112.334 -173.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.858 ' HB3' ' HD2' ' B' ' 142' ' ' LYS . . . 39.49 49.48 1.94 Allowed 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.806 0.691 . . . . 74.340000000000003 111.85 -179.422 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.735 ' HD1' ' HB3' ' A' ' 49' ' ' LEU . 48.4 p90 -88.48 167.92 13.05 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.889 -0.596 . . . . 74.420000000000002 110.415 -175.467 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.411 ' HE3' ' HB2' ' A' ' 52' ' ' LYS . 29.3 ttmt -99.68 115.0 28.46 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.223 0.535 . . . . 74.519999999999996 110.809 -178.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.553 ' SG ' ' HE2' ' A' ' 73' ' ' LYS . 34.9 t -110.47 95.23 5.44 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.668 -0.696 . . . . 74.340000000000003 110.018 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 69.08 12.45 8.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.998 -1.001 . . . . 43.549999999999997 112.3 176.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 138.78 -40.87 1.41 Allowed Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.523 -0.846 . . . . 44.210000000000001 112.675 176.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.485 ' HG3' ' HD3' ' A' ' 58' ' ' LYS . 9.8 pt-20 -96.42 150.91 20.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.106 0.479 . . . . 73.019999999999996 111.157 -175.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.6 mm -83.44 120.57 34.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.585 -0.734 . . . . 45.399999999999999 110.533 178.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.555 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 29.1 mmmt -106.25 106.92 17.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.02 -0.536 . . . . 73.150000000000006 110.124 -179.574 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -81.44 98.49 8.26 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.952 0.406 . . . . 74.140000000000001 111.256 178.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.555 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 41.3 m-85 -117.74 138.26 52.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.228 -0.442 . . . . 73.329999999999998 110.953 179.455 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 4.3 p -136.78 3.96 2.76 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.565 -0.743 . . . . 53.310000000000002 109.979 175.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.583 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 29.9 t70 -125.18 122.44 37.07 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.416 -0.811 . . . . 65.310000000000002 109.965 -178.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.1 tt -66.98 -42.82 84.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 72.430000000000007 110.032 -176.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.464 ' HB3' ' OD2' ' A' ' 62' ' ' ASP . 6.8 tt0 -51.77 -50.69 60.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.815 -0.629 . . . . 74.230000000000004 111.376 -179.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 10.5 m -69.21 -38.02 78.36 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.855 -0.611 . . . . 60.229999999999997 110.934 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.5 tp -68.79 -38.68 80.16 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.234 -0.439 . . . . 62.200000000000003 111.001 -178.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -57.28 -43.15 82.85 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.076 -0.511 . . . . 73.040000000000006 111.135 179.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -63.48 -40.43 97.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 72.420000000000002 110.429 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.506 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 81.3 t80 -67.55 -42.41 82.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.757 -0.656 . . . . 75.430000000000007 110.598 179.124 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.98 -32.52 73.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.998 -0.547 . . . . 72.319999999999993 111.293 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.4 m -71.61 -31.81 67.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.401 -0.363 . . . . 63.140000000000001 111.377 -179.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.506 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 20.6 pt20 -85.21 -9.5 57.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.229 0.538 . . . . 54.130000000000003 110.394 179.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.553 ' HE2' ' SG ' ' A' ' 53' ' ' CYS . 28.3 mmmt -93.42 111.24 22.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.713 -0.676 . . . . 73.299999999999997 109.651 174.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.6 m -55.55 -37.11 67.56 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.669 0.271 . . . . 74.310000000000002 111.137 -178.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.548 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 21.6 m -75.33 -42.92 53.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.569 -0.287 . . . . 71.430000000000007 111.325 -178.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.464 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 80.8 mtp -77.87 -24.16 48.6 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.659 0.266 . . . . 72.219999999999999 111.614 -174.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -60.13 -36.7 78.08 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.853 0.359 . . . . 73.409999999999997 111.31 -179.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -84.42 -16.11 43.81 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.953 0.883 . . . . 72.310000000000002 109.473 -174.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 75' ' ' SER . 59.6 mt -81.1 -51.78 8.09 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 114.312 -1.313 . . . . 54.399999999999999 109.697 178.366 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 80' ' ' LEU . 4.2 mm? -78.49 -30.45 47.24 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.374 -0.83 . . . . 72.200000000000003 112.638 -174.001 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -64.53 -10.18 24.09 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 118.367 0.531 . . . . 72.040000000000006 112.003 -173.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -75.55 -39.66 57.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.912 0.387 . . . . 73.310000000000002 110.98 -177.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 27.7 m -114.59 -5.92 11.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.091 -0.504 . . . . 70.319999999999993 110.92 -178.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 67.9 tp -122.01 95.84 47.19 Favored Pre-proline 0 C--N 1.321 -0.649 0 CA-C-N 115.777 -0.647 . . . . 75.340000000000003 109.841 -178.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -69.85 116.2 4.46 Favored 'Trans proline' 0 C--O 1.233 0.233 0 C-N-CA 123.385 2.723 . . . . 74.530000000000001 112.753 -177.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -83.05 100.35 10.43 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.012 0.434 . . . . 73.340000000000003 110.855 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -85.16 -22.4 28.81 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.775 -0.648 . . . . 75.409999999999997 110.008 175.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 . . . . . 0 C--N 1.325 -0.465 0 CA-C-N 115.415 -0.811 . . . . 73.25 110.033 -178.654 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.235 0 N-CA-C 112.316 -0.314 . . . . 54.520000000000003 112.316 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.655 HG22 ' HG ' ' B' ' 103' ' ' LEU . 2.7 p -93.8 -57.11 4.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.617 0.246 . . . . 74.400000000000006 110.926 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 103' ' ' LEU . . . . . 0.655 ' HG ' HG22 ' B' ' 102' ' ' VAL . 97.6 mt -139.01 169.51 17.65 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.042 -0.355 . . . . 71.329999999999998 110.042 -179.39 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 47.55 28.45 1.19 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.437 1.095 . . . . 72.239999999999995 112.861 176.076 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -96.36 119.56 35.08 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.744 -0.662 . . . . 52.109999999999999 110.701 178.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -97.16 5.12 50.73 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.415 -0.811 . . . . 74.409999999999997 110.428 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 91.05 -63.43 2.81 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 121.034 -0.603 . . . . 64.540000000000006 112.507 179.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -111.88 145.15 40.02 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.744 0.307 . . . . 70.219999999999999 110.435 179.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 23.3 m -99.67 -179.91 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.077 -0.51 . . . . 74.120000000000005 110.561 179.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 8.0 mp -85.16 113.66 21.7 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.925 -0.398 . . . . 72.109999999999999 109.925 177.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 12.4 m -118.62 114.13 22.3 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.369 -0.378 . . . . 75.219999999999999 110.495 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 2.9 tt -78.95 111.58 15.28 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.101 -0.703 . . . . 73.540000000000006 109.101 177.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 113' ' ' ALA . . . . . 0.483 ' O ' ' HB3' ' B' ' 117' ' ' SER . . . -95.42 104.39 16.29 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.709 -0.678 . . . . 72.239999999999995 110.568 -176.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.514 ' HA ' ' HB3' ' B' ' 118' ' ' SER . . . -81.75 -2.01 49.17 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.158 0.504 . . . . 75.430000000000007 111.024 -178.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 29.7 p-10 -123.81 -21.65 5.1 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.75 -0.659 . . . . 54.420000000000002 111.456 -177.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 7.0 mp -119.3 6.36 11.19 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 111.976 0.361 . . . . 74.349999999999994 111.976 -179.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.793 ' HA ' ' HB3' ' A' ' 25' ' ' LYS . 41.3 t -140.43 -59.73 0.52 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.798 -0.445 . . . . 73.329999999999998 109.798 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . 0.514 ' HB3' ' HA ' ' B' ' 114' ' ' ALA . 22.7 t -78.87 83.09 5.02 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.682 -0.488 . . . . 71.120000000000005 109.682 177.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -158.97 -148.85 0.2 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.846 -0.616 . . . . 74.329999999999998 110.228 -176.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 120' ' ' THR . . . . . 0.517 ' O ' ' HE2' ' A' ' 25' ' ' LYS . 1.2 m -55.77 110.74 0.77 Allowed 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.559 0.344 . . . . 64.430000000000007 110.218 176.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . 0.45 ' HB3' ' HD2' ' B' ' 185' ' ' PRO . 0.2 OUTLIER -65.94 166.24 11.73 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 113.465 0.913 . . . . 74.530000000000001 113.465 -171.42 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 122' ' ' ASP . . . . . 0.567 ' HB2' HG23 ' A' ' 23' ' ' ILE . 1.8 p30 -154.73 -177.76 6.73 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-N 114.149 -1.387 . . . . 74.530000000000001 109.022 176.042 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -152.01 149.93 13.42 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 115.901 -0.591 . . . . 62.109999999999999 111.423 -170.046 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 2.7 p -86.08 137.76 32.44 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.559 -0.746 . . . . 74.540000000000006 111.222 -179.051 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.71 6.71 6.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.375 0.607 . . . . 64.230000000000004 109.552 175.088 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 23.6 mp0 -114.4 121.88 44.93 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.461 -0.79 . . . . 71.540000000000006 109.762 -176.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -94.54 -79.76 0.42 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.18 0.514 . . . . 75.450000000000003 110.435 -176.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . 0.408 ' O ' ' HB2' ' B' ' 132' ' ' ASN . 23.1 t -104.37 1.2 29.95 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.408 0.623 . . . . 73.400000000000006 109.825 -178.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -57.91 -32.02 67.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.198 -0.91 . . . . 71.400000000000006 111.822 -174.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 21.8 t -60.94 -61.37 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.961 -0.563 . . . . 74.510000000000005 111.897 -174.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -94.19 -4.36 49.17 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.447 -0.342 . . . . 65.239999999999995 111.775 -173.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.544 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 63.7 t30 -59.75 -50.25 74.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.096 0.474 . . . . 72.140000000000001 110.201 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 133' ' ' ILE . . . . . 0.545 ' CG2' ' HB3' ' A' ' 79' ' ' LEU . 46.8 mm -59.38 -48.19 87.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.679 -0.691 . . . . 73.239999999999995 110.966 -179.033 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 80.9 mt -57.86 -36.58 72.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.022 -0.535 . . . . 73.140000000000001 111.263 177.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 36.9 ttt180 -67.17 -44.21 80.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.231 -0.44 . . . . 75.340000000000003 110.532 179.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 136' ' ' GLU . . . . . 0.544 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 10.6 mm-40 -68.3 -39.67 81.98 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.923 -0.581 . . . . 73.420000000000002 111.562 -178.046 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 52.4 m-80 -90.0 5.16 47.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.996 0.427 . . . . 74.519999999999996 110.695 -179.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 11.8 t70 56.53 57.03 5.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.112 -0.949 . . . . 74.400000000000006 112.19 173.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -90.61 8.9 31.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.791 -0.64 . . . . 72.049999999999997 109.996 173.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 60.61 80.93 0.25 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 114.926 -1.034 . . . . 73.420000000000002 111.488 -176.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -71.15 156.12 60.02 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 121.732 1.622 . . . . 61.329999999999998 109.831 171.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 142' ' ' LYS . . . . . 0.858 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -77.69 -144.19 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.239 -0.585 . . . . 70.230000000000004 111.739 -176.804 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -75.72 165.64 24.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.115 -0.493 . . . . 75.439999999999998 111.089 -169.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . 0.927 ' H ' HD13 ' B' ' 144' ' ' LEU . 0.0 OUTLIER -64.16 160.94 17.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.785 -0.643 . . . . 75.239999999999995 110.48 175.757 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 50.1 t -94.91 108.89 20.94 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.226 0.536 . . . . 53.119999999999997 111.271 -176.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -97.45 8.5 44.5 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.656 -0.702 . . . . 74.099999999999994 109.647 171.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 147' ' ' VAL . . . . . 0.575 HG22 ' HD2' ' A' ' 43' ' ' PHE . 41.2 t -82.22 82.67 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 CA-C-N 115.581 -0.736 . . . . 73.109999999999999 111.258 -175.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.75 112.58 16.88 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.14 -1.059 . . . . 74.209999999999994 108.14 165.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.705 HD21 HD12 ' A' ' 34' ' ' LEU . 63.0 tp -73.68 85.79 1.64 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.101 -0.5 . . . . 75.209999999999994 110.173 -176.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -90.71 86.51 6.37 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.366 -0.833 . . . . 73.219999999999999 110.485 178.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 151' ' ' PHE . . . . . 0.599 ' HD1' ' HG ' ' B' ' 149' ' ' LEU . 51.6 p90 -103.24 171.23 7.49 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.934 -0.575 . . . . 65.430000000000007 109.785 178.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -106.5 125.76 51.41 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.088 0.47 . . . . 54.240000000000002 111.009 -179.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 153' ' ' CYS . . . . . 0.43 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 48.6 t -122.09 104.29 9.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.74 -0.663 . . . . 72.230000000000004 109.746 176.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 65.38 26.48 12.0 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.809 -0.632 . . . . 65.129999999999995 111.504 176.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 114.94 -35.95 4.15 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.719 -0.753 . . . . 53.210000000000001 113.148 176.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -92.64 145.13 24.66 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.971 0.415 . . . . 73.239999999999995 110.909 -176.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 49.2 mm -83.0 131.31 34.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.893 -0.594 . . . . 64.450000000000003 109.669 175.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 158' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -117.05 100.7 7.92 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.319 -0.401 . . . . 55.549999999999997 110.468 -177.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.09 103.45 10.91 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.127 0.489 . . . . 44.310000000000002 111.318 178.313 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -116.6 113.87 23.31 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.962 -0.563 . . . . 74.310000000000002 110.84 177.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 14.5 m -103.79 -0.14 29.66 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.454 0.645 . . . . 60.299999999999997 109.753 174.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 162' ' ' ASP . . . . . 0.418 ' OD2' ' HB3' ' B' ' 164' ' ' GLN . 0.3 OUTLIER -133.65 141.78 47.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.3 -0.864 . . . . 73.140000000000001 110.612 -175.936 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . 0.652 HD22 ' HG2' ' A' ' 26' ' ' GLN . 44.8 tp -71.6 -34.33 69.8 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.952 -0.567 . . . . 74.340000000000003 111.341 -177.347 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 164' ' ' GLN . . . . . 0.467 ' O ' ' HG3' ' B' ' 168' ' ' LYS . 6.4 tt0 -60.09 -49.19 78.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.071 0.462 . . . . 73.109999999999999 110.238 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 20.9 m -58.43 -42.5 87.43 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.559 -0.746 . . . . 63.420000000000002 111.21 178.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 67.4 tp -68.66 -40.34 80.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.451 -0.341 . . . . 64.319999999999993 110.756 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . 1.098 ' HG3' HD21 ' B' ' 184' ' ' LEU . 15.1 ttp180 -61.11 -44.64 97.03 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.357 -0.383 . . . . 74.140000000000001 110.38 -178.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 168' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' B' ' 164' ' ' GLN . 48.9 mtmt -60.32 -29.77 69.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.978 -0.555 . . . . 71.140000000000001 111.317 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -84.7 -50.19 7.84 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.337 -0.392 . . . . 54.229999999999997 110.762 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.53 -32.82 74.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.084 -0.507 . . . . 70.420000000000002 111.968 -176.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 17.6 t -69.6 -19.0 63.66 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.886 0.328 . . . . 71.549999999999997 111.886 -176.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -104.88 2.34 29.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.912 0.387 . . . . 74.420000000000002 110.485 177.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 173' ' ' LYS . . . . . 0.43 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 29.6 mmmt -103.04 111.48 23.84 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.767 -0.651 . . . . 72.519999999999996 110.056 179.003 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 69.5 m -55.41 -34.38 64.34 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.8 0.333 . . . . 75.120000000000005 111.775 -178.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 175' ' ' SER . . . . . 0.46 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 6.8 m -77.03 -46.49 23.56 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.899 0.38 . . . . 75.129999999999995 110.975 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.401 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 73.9 mtp -78.31 -21.97 48.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.588 -0.278 . . . . 74.019999999999996 111.471 -173.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . 0.473 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 79.2 tttt -58.65 -37.46 76.01 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.164 0.507 . . . . 74.099999999999994 110.393 178.283 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -85.36 -13.95 47.9 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.6 0.714 . . . . 72.120000000000005 109.916 -175.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 179' ' ' LEU . . . . . 0.839 ' HB3' HG21 ' A' ' 33' ' ' ILE . 59.3 mt -84.28 -50.03 8.23 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 114.674 -1.148 . . . . 75.140000000000001 110.351 -179.296 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -88.84 -20.09 25.08 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.594 0.59 . . . . 71.030000000000001 112.594 -173.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 181' ' ' LYS . . . . . 0.473 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 62.7 pttt -59.95 -18.41 45.09 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.2 0.445 . . . . 64.310000000000002 112.2 -174.287 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -55.76 -49.42 73.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.004 0.43 . . . . 64.329999999999998 110.879 -177.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 183' ' ' VAL . . . . . 0.433 HG13 HD22 ' A' ' 29' ' ' ASN . 18.4 m -109.71 3.66 9.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.768 -0.651 . . . . 42.43 110.48 -179.089 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 184' ' ' LEU . . . . . 1.098 HD21 ' HG3' ' B' ' 167' ' ' ARG . 46.1 tp -135.34 83.53 37.78 Favored Pre-proline 0 N--CA 1.447 -0.614 0 CA-C-N 115.956 -0.565 . . . . 73.299999999999997 110.352 -175.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 185' ' ' PRO . . . . . 0.45 ' HD2' ' HB3' ' B' ' 121' ' ' LEU . 66.8 Cg_endo -75.73 103.74 1.79 Allowed 'Trans proline' 0 CA--C 1.528 0.219 0 C-N-CA 122.979 2.453 . . . . 73.420000000000002 112.772 -177.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 77.7 mm-40 -61.84 132.16 52.15 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.798 -0.637 . . . . 64.019999999999996 110.788 -176.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -95.79 -11.04 27.53 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.429 -0.805 . . . . 73.329999999999998 110.507 177.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 . . . . . 0 C--O 1.246 0.895 0 CA-C-O 118.54 -0.743 . . . . 65.049999999999997 110.492 179.645 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 112.038 -0.425 . . . . 70.239999999999995 112.038 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.68 HG23 HD22 ' A' ' 3' ' ' LEU . 18.8 m -107.1 -29.43 2.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 120.831 0.348 . . . . 72.400000000000006 110.417 178.25 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.68 HD22 HG23 ' A' ' 2' ' ' VAL . 4.1 mm? -85.26 88.2 7.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.182 0.515 . . . . 62.020000000000003 109.751 174.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 89.3 mtp -103.18 97.12 7.26 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.658 -0.701 . . . . 73.340000000000003 109.8 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -129.45 122.47 29.4 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.764 -0.653 . . . . 74.230000000000004 110.38 -178.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -127.74 101.16 6.25 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.357 -0.838 . . . . 74.540000000000006 110.002 -178.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.98 -145.12 13.57 Favored Glycine 0 N--CA 1.441 -0.97 0 C-N-CA 120.446 -0.883 . . . . 52.350000000000001 111.96 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -160.75 111.84 1.83 Allowed 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 110.228 -0.286 . . . . 24.309999999999999 110.228 -179.337 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 57.5 t -67.96 115.69 6.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 109.841 -0.429 . . . . 63.32 109.841 176.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 94.8 mt -54.7 130.54 40.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.93 -0.577 . . . . 71.219999999999999 110.704 -178.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 46.1 m -73.05 108.54 6.01 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.758 -0.655 . . . . 65.239999999999995 111.451 -178.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.506 HD23 ' N ' ' A' ' 13' ' ' ALA . 2.2 tt -81.72 141.59 33.43 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.306 -0.998 . . . . 73.340000000000003 108.306 174.114 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.56 ' HB2' ' HB3' ' A' ' 17' ' ' SER . . . -54.09 161.07 1.36 Allowed 'General case' 0 C--O 1.236 0.39 0 N-CA-C 112.507 0.558 . . . . 63.140000000000001 112.507 -177.672 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.28 -28.0 69.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.629 -0.714 . . . . 63.350000000000001 111.487 -174.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -149.09 -47.88 0.14 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.346 -0.388 . . . . 72.349999999999994 110.347 176.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.7 mt -157.38 137.22 12.38 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.676 -0.693 . . . . 73.219999999999999 110.916 -174.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.56 ' HB3' ' HB2' ' A' ' 13' ' ' ALA . 33.1 t 174.93 -24.59 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.966 -1.016 . . . . 72.430000000000007 108.539 176.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.9 t -77.81 83.77 4.15 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.423 -0.808 . . . . 70.030000000000001 110.155 178.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -98.03 26.94 4.85 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.044 -0.98 . . . . 64.400000000000006 108.722 173.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.8 m -59.43 105.19 0.33 Allowed 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 113.856 -1.52 . . . . 73.349999999999994 110.939 -173.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.43 ' HA ' ' HG2' ' B' ' 126' ' ' GLN . 4.0 tt -161.11 109.32 1.54 Allowed 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.948 -0.569 . . . . 72.209999999999994 109.593 -178.684 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.612 ' OD2' ' HA ' ' B' ' 124' ' ' SER . 3.5 p-10 -119.55 143.3 47.68 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.453 -0.573 . . . . 71.430000000000007 109.453 178.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 10.9 tt -126.43 123.44 63.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-O 121.177 0.513 . . . . 71.400000000000006 111.09 -174.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.574 ' HB2' ' OD1' ' B' ' 122' ' ' ASP . 31.7 p -94.97 -171.0 2.32 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.815 -0.63 . . . . 51.200000000000003 110.401 179.289 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -119.74 -54.03 2.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.152 0.501 . . . . 74.109999999999999 109.929 176.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -92.05 53.57 2.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.788 -0.642 . . . . 74.230000000000004 111.81 -173.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.447 ' C ' ' HE3' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -84.33 42.45 0.89 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.481 0.657 . . . . 65.109999999999999 111.439 178.053 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.1 m -110.44 17.4 20.85 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.778 -0.647 . . . . 74.329999999999998 110.42 -179.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -85.44 44.21 1.08 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.226 0.536 . . . . 72.010000000000005 110.516 -176.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 15.3 m -69.14 114.55 6.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.086 -0.507 . . . . 52.140000000000001 111.64 -176.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 44.3 p90 44.47 28.16 0.29 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.4 1.08 . . . . 73.450000000000003 112.887 178.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -61.72 -53.33 57.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 64.239999999999995 111.108 -174.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.509 ' CG2' ' HB3' ' B' ' 179' ' ' LEU . 48.9 mm -59.3 -43.65 90.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.924 -0.58 . . . . 73.450000000000003 110.832 -177.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 86.5 mt -63.26 -35.13 79.33 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.759 -0.655 . . . . 74.409999999999997 111.012 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.439 HH11 ' HD3' ' A' ' 35' ' ' ARG . 35.0 ttt180 -70.58 -46.6 63.17 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.92 0.391 . . . . 64.349999999999994 110.322 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -59.21 -46.4 88.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.903 -0.59 . . . . 61.340000000000003 111.308 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -86.89 1.34 52.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.983 -0.553 . . . . 73.150000000000006 111.227 -177.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.6 t70 60.64 71.26 0.57 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.33 -0.85 . . . . 74.0 112.455 175.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -96.41 -6.8 36.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.508 -0.769 . . . . 74.430000000000007 110.105 167.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 57.84 73.69 0.72 Allowed Pre-proline 0 CA--C 1.53 0.199 0 CA-C-N 115.263 -0.881 . . . . 62.140000000000001 110.582 -176.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -78.44 150.35 25.05 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 122.918 2.412 . . . . 73.530000000000001 112.629 -177.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.554 ' HB2' ' H ' ' B' ' 150' ' ' ALA . 5.5 mptp? -108.74 135.95 49.12 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.859 -0.61 . . . . 74.120000000000005 109.681 177.027 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 74.5 t80 174.28 100.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 O-C-N 123.637 0.585 . . . . 64.200000000000003 109.758 -175.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 86.7 mt -123.39 114.75 20.57 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.516 -0.55 . . . . 72.420000000000002 109.516 175.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.681 ' SG ' HG22 ' A' ' 47' ' ' VAL . 47.2 t -130.31 108.28 9.89 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.359 -0.382 . . . . 72.099999999999994 111.066 -175.159 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 46' ' ' GLU . 36.9 tt0 -117.5 21.61 12.92 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.738 0.78 . . . . 75.209999999999994 109.48 176.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.681 HG22 ' SG ' ' A' ' 45' ' ' CYS . 17.5 m -75.67 157.38 5.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.814 -0.63 . . . . 74.129999999999995 110.471 -178.102 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.485 ' HB3' ' OG ' ' A' ' 61' ' ' SER . 0.1 OUTLIER -153.84 143.44 21.69 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.554 -0.748 . . . . 73.140000000000001 110.092 -179.657 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.562 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.0 mp -69.64 82.06 0.42 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.155 -0.475 . . . . 52.240000000000002 109.957 175.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.454 ' H ' ' HB2' ' B' ' 142' ' ' LYS . . . -82.56 67.38 8.59 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.259 0.552 . . . . 74.310000000000002 110.365 178.14 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.562 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 49.2 p90 -97.85 164.51 12.35 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.883 -0.599 . . . . 75.140000000000001 110.672 -177.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.411 ' HD2' ' C ' ' A' ' 55' ' ' GLY . 11.2 tppt? -88.41 123.97 33.49 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.636 -0.711 . . . . 73.299999999999997 110.57 -178.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 17.6 t -141.72 119.84 12.12 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.326 -0.397 . . . . 63.149999999999999 109.954 176.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 69.99 13.9 7.87 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.711 -0.677 . . . . 73.540000000000006 112.194 177.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.411 ' C ' ' HD2' ' A' ' 52' ' ' LYS . . . 104.64 -18.53 43.95 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.33 -0.938 . . . . 54.210000000000001 112.351 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -110.37 153.04 25.5 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.86 0.362 . . . . 65.299999999999997 110.08 179.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 47.6 mm -81.31 115.48 23.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.739 -0.467 . . . . 72.340000000000003 109.739 177.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -101.19 103.17 14.19 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.403 -0.362 . . . . 70.420000000000002 110.223 -177.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.58 124.82 28.57 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.391 -0.368 . . . . 72.120000000000005 111.526 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.428 ' CE2' ' HA ' ' A' ' 66' ' ' LEU . 74.6 m-85 -124.38 104.04 8.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.144 0.497 . . . . 70.310000000000002 111.44 176.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.485 ' OG ' ' HB3' ' A' ' 48' ' ' LYS . 5.8 m -95.2 -2.81 48.92 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.389 -0.823 . . . . 73.140000000000001 109.407 173.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -130.86 136.94 49.1 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.225 -0.898 . . . . 72.340000000000003 110.783 -177.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.6 tp -81.95 -27.24 33.37 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.909 -0.587 . . . . 65.030000000000001 110.801 -177.144 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -65.91 -44.2 85.93 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.244 0.545 . . . . 75.319999999999993 110.112 -178.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.424 ' HA ' ' HZ2' ' A' ' 68' ' ' LYS . 45.5 m -65.66 -41.16 92.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.665 -0.698 . . . . 73.010000000000005 110.567 175.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.428 ' HA ' ' CE2' ' A' ' 60' ' ' PHE . 45.8 tp -61.1 -46.8 89.14 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 63.25 111.05 -178.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.449 ' HG3' HD21 ' A' ' 84' ' ' LEU . 50.3 ttt-85 -55.31 -48.34 74.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.135 -0.484 . . . . 65.109999999999999 111.063 178.292 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.424 ' HZ2' ' HA ' ' A' ' 65' ' ' SER . 9.9 mtmp? -70.52 -30.39 67.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.199 -0.455 . . . . 72.540000000000006 111.333 -177.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.514 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 81.7 t80 -70.22 -45.86 65.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.309 -0.405 . . . . 53.219999999999999 110.149 176.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.21 -30.48 71.62 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.095 0.474 . . . . 73.120000000000005 110.465 178.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.5 t -71.02 -29.61 65.58 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.721 -0.672 . . . . 64.109999999999999 111.226 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.514 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 9.7 pt20 -86.66 -9.48 55.9 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.215 0.531 . . . . 71.319999999999993 110.01 177.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.917 ' HE2' ' HA ' ' A' ' 73' ' ' LYS . 9.0 mmpt? -81.79 164.03 21.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.653 -0.703 . . . . 74.109999999999999 109.945 176.073 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.2 t -100.45 -42.82 6.44 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.239 -0.652 . . . . 71.230000000000004 109.239 173.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.49 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 15.1 p -73.16 -58.8 3.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.648 -0.706 . . . . 71.400000000000006 110.778 179.018 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.457 ' HA ' HD12 ' A' ' 79' ' ' LEU . 86.9 mtp -65.09 -17.2 64.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.68 -0.691 . . . . 75.129999999999995 111.746 -176.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.535 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 24.8 ttpp -59.02 -38.32 78.99 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.272 -0.422 . . . . 65.25 110.825 -178.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -106.8 5.05 28.2 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.164 0.507 . . . . 72.010000000000005 110.816 -178.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.763 ' HB3' HG21 ' B' ' 133' ' ' ILE . 31.2 mt -81.41 -54.0 5.83 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.819 -0.628 . . . . 72.230000000000004 110.301 176.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.53 -5.59 50.61 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.095 -0.502 . . . . 75.340000000000003 111.98 -174.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 62.7 pttt -65.93 -9.07 26.29 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.958 0.408 . . . . 72.140000000000001 111.19 -178.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -61.02 -37.53 82.89 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.774 -0.648 . . . . 75.129999999999995 110.406 176.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.435 ' O ' ' HD3' ' A' ' 85' ' ' PRO . 14.8 p -115.54 -23.18 4.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.801 -0.636 . . . . 74.030000000000001 110.453 178.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.462 ' O ' ' HA ' ' A' ' 81' ' ' LYS . 58.8 tp -96.42 105.27 21.43 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.975 -0.557 . . . . 75.129999999999995 110.315 -179.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.435 ' HD3' ' O ' ' A' ' 83' ' ' VAL . 9.1 Cg_exo -71.88 103.86 1.54 Allowed 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 123.178 2.585 . . . . 72.409999999999997 111.969 -177.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -100.44 118.22 36.21 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.053 -0.521 . . . . 62.020000000000003 111.261 -176.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt 53.41 76.84 0.19 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.792 -1.095 . . . . 71.299999999999997 112.425 174.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 . . . . . 0 C--N 1.308 -1.207 0 CA-C-N 114.224 -1.353 . . . . 74.140000000000001 110.087 173.828 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.391 0 N-CA-C 111.942 -0.463 . . . . 51.109999999999999 111.942 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 17.3 t -67.51 -18.35 23.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.948 0.404 . . . . 54.25 110.902 -177.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 103' ' ' LEU . . . . . 0.405 ' H ' HD22 ' B' ' 103' ' ' LEU . 2.8 mm? -71.28 -17.47 62.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.284 -0.416 . . . . 72.25 110.606 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 73.5 mtp 60.9 21.61 11.81 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.518 0.675 . . . . 72.040000000000006 110.546 -177.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -143.25 116.49 8.99 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.345 -0.843 . . . . 73.329999999999998 108.903 177.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -82.5 136.13 34.96 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.573 -0.739 . . . . 54.340000000000003 111.116 -173.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -85.05 90.71 1.66 Allowed Glycine 0 N--CA 1.44 -1.065 0 N-CA-C 111.053 -0.819 . . . . 75.329999999999998 111.053 176.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -68.79 96.96 0.78 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.856 0.36 . . . . 51.149999999999999 110.54 -178.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 42.1 t -78.53 104.76 6.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.92 -0.582 . . . . 72.140000000000001 109.689 177.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 92.1 mt -54.54 121.39 8.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.918 -0.583 . . . . 73.530000000000001 110.93 -177.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 87.7 m -77.36 106.1 8.89 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.779 -0.646 . . . . 44.530000000000001 110.602 -179.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 2.9 tt -85.14 126.69 33.83 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.394 -0.821 . . . . 63.100000000000001 108.958 178.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.06 125.41 22.55 Favored 'General case' 0 C--N 1.329 -0.288 0 O-C-N 123.304 0.378 . . . . 70.25 110.6 178.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -57.43 -38.07 73.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.082 -0.508 . . . . 73.120000000000005 112.056 -172.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -84.96 27.82 0.74 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.417 -0.356 . . . . 52.130000000000003 111.114 -177.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 76.8 mt 62.3 27.32 16.34 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.072 0.463 . . . . 61.140000000000001 110.946 175.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 13.6 t -88.74 16.86 6.13 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.896 -0.593 . . . . 55.329999999999998 110.929 -176.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 15.4 t -134.21 94.16 3.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.244 -0.434 . . . . 73.310000000000002 109.853 178.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -161.54 162.69 30.35 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.893 -0.594 . . . . 42.43 110.57 -179.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 94.6 m -157.9 121.53 4.04 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.411 -0.588 . . . . 64.239999999999995 109.411 177.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . 0.411 HD11 HG12 ' B' ' 183' ' ' VAL . 6.3 tt -106.81 115.24 29.85 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.601 -0.518 . . . . 73.239999999999995 109.601 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 122' ' ' ASP . . . . . 0.574 ' OD1' ' HB2' ' A' ' 24' ' ' SER . 1.3 p30 -136.79 163.71 30.0 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.658 -0.701 . . . . 74.420000000000002 110.193 -179.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 12.3 tt -151.62 141.13 15.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 120.907 0.384 . . . . 73.319999999999993 111.046 -177.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.612 ' HA ' ' OD2' ' A' ' 22' ' ' ASP . 4.5 p -112.23 156.01 23.06 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.242 -0.435 . . . . 71.120000000000005 110.255 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? -112.41 -25.74 9.06 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.091 0.472 . . . . 75.230000000000004 109.862 -179.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 126' ' ' GLN . . . . . 0.512 ' HB2' ' H ' ' A' ' 22' ' ' ASP . 2.8 mp0 -92.47 36.07 1.01 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.59 -0.732 . . . . 74.409999999999997 111.405 -178.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 62.1 t-105 -77.9 67.64 3.8 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.686 0.755 . . . . 65.129999999999995 109.324 175.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 15.4 p -118.1 -12.39 10.05 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.374 -0.83 . . . . 73.25 111.038 -178.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -68.05 108.41 3.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.268 -0.424 . . . . 73.120000000000005 110.757 -177.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 6.1 m -130.81 105.98 11.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.148 -0.478 . . . . 62.130000000000003 111.082 178.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 39.0 p90 45.76 28.21 0.54 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.168 0.987 . . . . 73.5 113.27 175.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.479 ' O ' ' HG2' ' B' ' 136' ' ' GLU . 27.3 p-10 -58.55 -48.49 80.7 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.77 0.319 . . . . 61.25 111.431 -174.272 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 133' ' ' ILE . . . . . 0.763 HG21 ' HB3' ' A' ' 79' ' ' LEU . 43.0 mm -64.73 -41.21 91.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.101 0.477 . . . . 73.409999999999997 111.156 -177.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.447 HD22 HD23 ' A' ' 49' ' ' LEU . 9.8 mp -65.45 -35.87 82.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.737 -0.665 . . . . 75.439999999999998 110.613 179.535 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -69.92 -41.65 74.36 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.79 -0.641 . . . . 62.310000000000002 110.264 177.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 136' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' B' ' 132' ' ' ASN . 5.8 mm-40 -64.25 -42.2 96.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.964 -0.562 . . . . 75.439999999999998 111.456 178.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -94.17 7.43 45.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.328 -0.396 . . . . 55.439999999999998 111.672 -175.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 10.4 t70 60.97 43.32 11.69 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.794 -0.639 . . . . 74.209999999999994 112.233 172.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 139' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -74.05 -10.56 59.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.877 0.37 . . . . 71.200000000000003 110.66 172.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 58.09 78.26 0.37 Allowed Pre-proline 0 C--O 1.232 0.182 0 CA-C-N 115.325 -0.852 . . . . 63.210000000000001 110.313 -174.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.414 ' HG3' ' HB3' ' B' ' 134' ' ' LEU . 10.9 Cg_endo -86.17 145.71 8.58 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 122.887 2.391 . . . . 52.109999999999999 112.418 -178.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 142' ' ' LYS . . . . . 0.454 ' HB2' ' H ' ' A' ' 50' ' ' ALA . 4.7 mptp? -109.91 139.46 44.97 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.097 -0.502 . . . . 70.540000000000006 110.028 178.587 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -173.13 30.04 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.82 0.819 . . . . 73.400000000000006 109.098 -176.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 80.8 mt -80.73 112.27 17.95 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.252 -0.885 . . . . 52.229999999999997 110.536 -176.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 145' ' ' CYS . . . . . 0.6 ' HB3' HG11 ' A' ' 47' ' ' VAL . 17.4 p -158.83 138.95 12.17 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.861 -0.609 . . . . 75.319999999999993 110.721 -177.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -124.69 102.59 7.67 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.875 -0.602 . . . . 73.439999999999998 109.487 173.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 35.8 m -133.45 161.18 41.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.099 -0.5 . . . . 44.030000000000001 110.051 178.321 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -156.19 142.17 18.1 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.908 -0.587 . . . . 73.420000000000002 109.553 178.323 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.477 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.8 mp -68.42 75.76 0.26 Allowed 'General case' 0 C--O 1.219 -0.535 0 O-C-N 123.91 0.756 . . . . 72.219999999999999 109.558 174.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.554 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -81.98 59.25 4.26 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.202 0.525 . . . . 62.5 110.451 -179.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 151' ' ' PHE . . . . . 0.477 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 44.2 p90 -86.84 162.78 17.58 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.662 -0.699 . . . . 71.319999999999993 110.588 -177.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 152' ' ' LYS . . . . . 0.432 ' HD3' ' CD1' ' B' ' 157' ' ' ILE . 21.6 tptt -92.76 113.47 25.75 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.518 -0.765 . . . . 64.340000000000003 109.659 -177.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 153' ' ' CYS . . . . . 0.536 ' SG ' ' HE2' ' B' ' 173' ' ' LYS . 29.9 t -123.29 96.12 4.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.01 0.433 . . . . 62.43 110.44 -176.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 57.91 55.05 5.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.174 -0.921 . . . . 70.450000000000003 111.628 179.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 95.17 -35.85 4.08 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.596 -0.729 . . . . 73.140000000000001 113.054 172.251 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -107.31 141.13 39.13 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.22 0.533 . . . . 60.100000000000001 111.277 -175.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . 0.432 ' CD1' ' HD3' ' B' ' 152' ' ' LYS . 43.3 mm -76.01 119.51 24.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.522 -0.763 . . . . 74.409999999999997 109.525 174.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 158' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -106.28 97.79 7.55 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.909 -0.316 . . . . 74.239999999999995 110.386 -177.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 2.6 p -76.47 124.24 27.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.221 -0.445 . . . . 73.420000000000002 111.815 -177.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 160' ' ' PHE . . . . . . . . . . . . . 86.9 m-85 -125.37 107.32 10.57 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.27 -0.423 . . . . 64.219999999999999 111.206 176.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 39.6 m -97.21 -0.67 46.39 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.748 -0.66 . . . . 51.210000000000001 109.448 172.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -129.56 131.84 46.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.198 -0.91 . . . . 75.010000000000005 109.797 -179.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 51.0 tp -76.49 -35.35 58.44 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.354 -0.385 . . . . 73.109999999999999 110.79 -175.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -62.27 -44.64 96.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.936 0.398 . . . . 71.420000000000002 110.491 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . 0.674 ' HA ' ' HE2' ' B' ' 168' ' ' LYS . 32.0 m -61.55 -32.14 72.2 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.976 -0.557 . . . . 72.530000000000001 110.932 178.411 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 49.5 tp -68.09 -40.16 82.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 75.420000000000002 110.414 179.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . 0.555 ' HG3' HD21 ' B' ' 184' ' ' LEU . 24.2 ttt180 -57.22 -45.65 83.67 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.047 0.451 . . . . 74.409999999999997 110.543 175.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 168' ' ' LYS . . . . . 0.674 ' HE2' ' HA ' ' B' ' 165' ' ' SER . 52.0 mtmt -63.34 -36.46 83.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.519 -0.764 . . . . 62.200000000000003 111.195 -179.086 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -71.26 -44.95 64.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.092 -0.504 . . . . 74.5 110.736 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -62.08 -28.65 69.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.212 -0.449 . . . . 72.510000000000005 110.972 -179.514 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 33.2 t -66.29 -30.92 71.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.96 -0.564 . . . . 64.310000000000002 111.29 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -100.53 10.93 40.52 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.098 0.475 . . . . 74.209999999999994 110.695 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 173' ' ' LYS . . . . . 0.536 ' HE2' ' SG ' ' B' ' 153' ' ' CYS . 30.7 mmmt -108.05 117.88 35.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.939 -0.573 . . . . 61.399999999999999 110.738 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 39.8 t -64.27 -37.13 86.38 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.956 -0.565 . . . . 71.129999999999995 110.456 -178.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 16.9 p -78.25 -35.75 47.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.748 -0.66 . . . . 71.510000000000005 111.778 -177.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 76.9 mtp -90.7 -16.64 28.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.317 -0.401 . . . . 74.230000000000004 111.824 -172.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -56.68 -37.73 71.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.495 -0.321 . . . . 70.230000000000004 111.558 -177.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -96.73 0.15 49.13 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.305 0.574 . . . . 63.5 110.529 -174.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 179' ' ' LEU . . . . . 0.509 ' HB3' ' CG2' ' A' ' 33' ' ' ILE . 59.6 mt -88.72 -51.97 5.38 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.245 -0.889 . . . . 31.43 109.408 176.076 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 180' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.0 -19.64 59.99 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.368 -0.833 . . . . 74.219999999999999 111.797 -176.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -60.34 -15.08 22.25 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.057 0.391 . . . . 63.119999999999997 112.057 -177.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -75.05 -32.54 61.56 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.086 0.47 . . . . 62.5 110.659 -173.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 183' ' ' VAL . . . . . 0.411 HG12 HD11 ' B' ' 121' ' ' LEU . 27.0 m -117.05 -15.39 9.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.811 -0.631 . . . . 60.420000000000002 110.997 -179.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 184' ' ' LEU . . . . . 0.555 HD21 ' HG3' ' B' ' 167' ' ' ARG . 42.5 tp -114.56 111.49 46.33 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.024 -0.534 . . . . 71.150000000000006 109.969 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -62.44 114.68 2.47 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.959 2.439 . . . . 73.030000000000001 112.121 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -109.45 107.2 17.26 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.075 -0.511 . . . . 74.209999999999994 110.734 -178.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 187' ' ' LYS . . . . . 0.948 ' HE2' ' HA ' ' B' ' 187' ' ' LYS . 11.1 mmpt? 56.09 83.89 0.09 Allowed 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 122.058 0.933 . . . . 72.310000000000002 112.201 178.558 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 . . . . . 0 C--N 1.31 -1.148 0 CA-C-N 114.281 -1.327 . . . . 75.120000000000005 109.072 174.603 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.88 0 N-CA-C 112.082 -0.407 . . . . 74.109999999999999 112.082 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.42 HG22 ' H ' ' A' ' 4' ' ' MET . 7.6 p -106.42 122.82 60.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.153 0.502 . . . . 73.099999999999994 110.774 -178.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 86.4 mt -90.65 -6.93 53.93 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.226 -0.443 . . . . 75.299999999999997 111.009 -178.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.42 ' H ' HG22 ' A' ' 2' ' ' VAL . 90.5 mtp -77.64 95.16 4.52 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.29 -0.414 . . . . 65.329999999999998 110.604 -178.4 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -82.43 137.55 34.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.92 -0.582 . . . . 61.439999999999998 110.233 175.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.434 ' HA ' HD12 ' A' ' 10' ' ' LEU . 48.2 mt-10 -89.81 -85.84 0.2 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.563 0.697 . . . . 74.150000000000006 111.583 -177.467 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 75.7 21.21 77.31 Favored Glycine 0 C--N 1.316 -0.582 0 N-CA-C 110.505 -1.038 . . . . 72.530000000000001 110.505 -172.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -173.1 177.74 2.65 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.655 -0.868 . . . . 30.350000000000001 108.655 -178.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.0 t -84.26 102.19 9.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.578 -0.527 . . . . 72.129999999999995 109.578 177.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 6' ' ' GLU . 91.0 mt -120.9 -178.09 3.65 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.144 -0.48 . . . . 64.420000000000002 110.745 -177.445 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.6 t -143.09 160.65 39.99 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.897 -0.592 . . . . 74.420000000000002 109.457 -179.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 44.4 tp -97.83 125.47 42.7 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.031 0.444 . . . . 73.400000000000006 110.924 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.838 ' HB1' ' HB2' ' A' ' 16' ' ' LEU . . . -83.54 116.34 22.52 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.661 -0.699 . . . . 74.439999999999998 110.629 174.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.31 95.39 1.71 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.045 0.45 . . . . 65.120000000000005 110.978 179.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 1.014 ' HA ' ' HA ' ' A' ' 19' ' ' ALA . 9.5 m-20 76.07 0.23 3.26 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.916 -1.038 . . . . 63.219999999999999 111.658 172.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.838 ' HB2' ' HB1' ' A' ' 13' ' ' ALA . 62.9 mt -83.29 -19.46 36.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.388 0.613 . . . . 70.129999999999995 110.557 -178.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 40.8 m -145.53 -62.37 0.34 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.773 -0.825 . . . . 72.129999999999995 108.773 175.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 66.3 m -90.17 100.14 13.03 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.143 -0.688 . . . . 52.340000000000003 109.143 169.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 1.014 ' HA ' ' HA ' ' A' ' 15' ' ' ASP . . . -77.1 169.77 17.73 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.823 -0.626 . . . . 75.209999999999994 110.904 -177.466 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 19.8 m -63.08 98.14 0.13 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.255 0.55 . . . . 74.099999999999994 110.536 178.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.598 ' O ' HD22 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -82.37 101.97 10.94 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 122.011 0.91 . . . . 64.400000000000006 109.124 176.33 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -146.19 172.67 13.09 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.116 -0.947 . . . . 52.539999999999999 109.888 -175.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.749 ' HB ' ' HG3' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -144.02 123.09 7.37 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 CA-C-N 115.689 -0.687 . . . . 73.109999999999999 111.994 -166.948 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 m -84.31 34.09 0.51 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.065 -0.97 . . . . 73.049999999999997 110.468 -177.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.749 ' HG3' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -81.44 42.96 0.71 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.399 0.619 . . . . 74.120000000000005 112.177 -174.657 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -124.09 -168.89 1.86 Allowed 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.853 -0.612 . . . . 63.100000000000001 110.508 -175.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 45.0 m95 -68.64 97.39 0.79 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.36 0.6 . . . . 71.230000000000004 110.252 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.7 m -88.88 -2.86 58.8 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.785 0.802 . . . . 74.319999999999993 109.425 -178.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -70.48 -25.81 63.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.56 -1.2 . . . . 71.439999999999998 110.945 -176.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.447 HG22 ' HG ' ' B' ' 163' ' ' LEU . 21.8 t -51.67 -56.07 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 115.754 -0.657 . . . . 71.200000000000003 112.02 -174.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.49 ' HB2' ' HB2' ' A' ' 41' ' ' PRO . 14.0 p90 -97.13 -7.64 32.1 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.587 -0.278 . . . . 73.349999999999994 110.991 -176.105 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.418 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 12.1 t30 -61.58 -53.68 53.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.454 -0.339 . . . . 73.420000000000002 111.114 -173.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.447 ' H ' HD12 ' A' ' 33' ' ' ILE . 3.6 mp -62.77 -39.73 85.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.134 0.493 . . . . 72.400000000000006 110.378 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.498 ' HB3' ' HB2' ' A' ' 39' ' ' PHE . 88.8 mt -62.49 -34.79 77.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.014 -0.539 . . . . 64.450000000000003 110.736 178.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -69.88 -38.67 76.46 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.141 -0.481 . . . . 75.099999999999994 110.441 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 34.1 mm-40 -65.93 -31.3 72.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.052 -0.522 . . . . 71.209999999999994 111.08 178.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -100.39 4.35 43.82 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.13 -0.486 . . . . 73.439999999999998 111.281 -177.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.5 t0 67.69 47.09 1.21 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.617 -0.719 . . . . 74.019999999999996 112.054 171.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.498 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . 28.7 m-85 -81.21 -7.63 59.6 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.525 -0.307 . . . . 64.209999999999994 111.608 173.215 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.93 69.53 1.35 Allowed Pre-proline 0 CA--C 1.538 0.515 0 CA-C-O 121.321 0.581 . . . . 71.140000000000001 110.076 -175.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.551 ' HA ' ' HB3' ' B' ' 151' ' ' PHE . 87.2 Cg_endo -89.07 175.75 3.38 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 123.017 2.478 . . . . 75.549999999999997 112.637 -177.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.64 ' HZ1' ' N ' ' B' ' 101' ' ' GLY . 12.7 mptt -109.7 -178.48 3.55 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.276 -0.42 . . . . 72.219999999999999 111.125 -178.03 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -90.39 178.01 6.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.141 -0.482 . . . . 73.120000000000005 111.596 -168.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -82.62 151.91 26.13 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.771 -0.649 . . . . 64.519999999999996 109.938 178.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 35.9 m -85.94 70.59 10.64 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.007 0.432 . . . . 62.25 110.036 177.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -83.63 63.78 7.59 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.466 0.651 . . . . 64.230000000000004 110.8 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.881 HG21 ' HB2' ' B' ' 145' ' ' CYS . 1.2 m -156.86 119.97 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 114.525 -1.216 . . . . 74.230000000000004 109.423 174.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.509 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER -139.92 166.94 23.29 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.381 -0.372 . . . . 63.520000000000003 111.022 179.919 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.653 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.9 mp -73.67 92.18 1.95 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.904 -0.589 . . . . 72.019999999999996 110.889 -177.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -94.11 68.18 3.7 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.272 -0.64 . . . . 73.200000000000003 109.272 171.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.653 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 44.9 p90 -91.68 165.12 13.47 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.994 -0.548 . . . . 75.409999999999997 111.132 -173.288 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.2 tptm -92.24 116.61 29.11 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.568 -0.742 . . . . 65.109999999999999 110.338 -176.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.554 ' HB3' ' HG2' ' A' ' 58' ' ' LYS . 47.3 t -120.06 100.49 7.24 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.993 0.425 . . . . 65.310000000000002 110.362 178.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 64.41 15.9 9.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.265 -0.88 . . . . 64.219999999999999 112.317 174.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.63 -32.26 3.92 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.297 -0.954 . . . . 74.140000000000001 112.638 177.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -100.66 153.74 19.17 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 110.117 -0.327 . . . . 75.530000000000001 110.117 -179.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 48.1 mm -83.9 116.48 27.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.401 -0.363 . . . . 72.329999999999998 110.166 177.243 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.739 ' HB3' ' HE1' ' A' ' 60' ' ' PHE . 31.8 mmmt -101.01 115.9 31.56 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.381 -0.6 . . . . 73.230000000000004 109.381 177.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -97.8 112.06 24.11 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.864 -0.607 . . . . 72.450000000000003 111.16 -174.716 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.739 ' HE1' ' HB3' ' A' ' 58' ' ' LYS . 23.8 m-85 -121.6 140.72 51.89 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.839 -0.619 . . . . 64.219999999999999 111.228 -178.239 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.509 ' HB3' ' HB3' ' A' ' 48' ' ' LYS . 17.1 p -137.08 15.55 3.04 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.811 -0.631 . . . . 74.219999999999999 109.75 175.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.466 ' OD2' ' HB3' ' A' ' 64' ' ' GLN . 4.9 t70 -148.1 127.55 13.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.488 -0.778 . . . . 73.319999999999993 110.692 -177.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.525 HD13 HG22 ' B' ' 130' ' ' VAL . 56.1 tp -68.25 -29.61 68.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.915 -0.584 . . . . 74.040000000000006 111.144 -177.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.466 ' HB3' ' OD2' ' A' ' 62' ' ' ASP . 44.3 tt0 -62.1 -47.92 82.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.26 0.552 . . . . 61.329999999999998 109.674 178.339 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 42.6 m -58.03 -45.05 87.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.389 -0.823 . . . . 75.040000000000006 111.109 177.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 37.1 tp -68.71 -34.63 75.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.285 -0.416 . . . . 73.409999999999997 110.977 -177.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 67' ' ' ARG . 46.4 ttp180 -61.96 -31.91 72.29 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.143 0.497 . . . . 71.450000000000003 110.463 177.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 64' ' ' GLN . 3.8 mtmp? -75.71 -42.62 50.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.988 -0.551 . . . . 74.319999999999993 110.343 176.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.469 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 63.7 t80 -65.98 -41.98 90.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.652 -0.703 . . . . 74.340000000000003 111.011 -176.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.38 -26.89 64.88 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.524 -0.307 . . . . 63.0 111.009 177.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.7 t -75.58 -28.6 59.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.915 0.388 . . . . 73.099999999999994 110.522 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 19.9 pt20 -87.69 -10.53 50.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.383 0.611 . . . . 72.299999999999997 109.847 176.059 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.458 ' O ' ' HE3' ' A' ' 77' ' ' LYS . 26.9 mmmt -94.03 163.33 13.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.334 -0.848 . . . . 71.209999999999994 109.431 173.016 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.1 t -105.42 -44.86 4.61 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.645 -0.502 . . . . 65.409999999999997 109.645 176.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.594 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 17.7 p -65.91 -53.35 40.57 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.969 -0.56 . . . . 70.510000000000005 110.891 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 81.3 mtp -64.87 -26.63 68.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.786 -0.643 . . . . 74.120000000000005 111.383 -177.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.458 ' HE3' ' O ' ' A' ' 73' ' ' LYS . 37.1 ttmt -61.12 -34.12 74.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.268 0.556 . . . . 63.340000000000003 110.47 178.468 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -102.88 8.08 39.25 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.631 0.729 . . . . 72.310000000000002 109.799 -176.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 75' ' ' SER . 45.6 mt -94.14 -52.87 4.19 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.063 -0.971 . . . . 72.329999999999998 108.912 172.041 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.483 ' HA ' HG13 ' B' ' 133' ' ' ILE . 9.1 mt -80.25 6.67 11.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.427 -0.806 . . . . 75.310000000000002 111.306 -173.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -54.36 -20.81 8.0 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.628 0.58 . . . . 71.219999999999999 112.481 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.586 ' HB3' HD11 ' B' ' 133' ' ' ILE . 27.6 t70 -67.69 -41.99 82.78 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.972 0.415 . . . . 72.400000000000006 110.365 175.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 35.6 t -91.33 -42.55 13.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.069 -0.514 . . . . 73.409999999999997 110.405 -178.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.1 mp -79.94 122.55 83.37 Favored Pre-proline 0 C--N 1.322 -0.597 0 CA-C-N 116.107 -0.497 . . . . 74.319999999999993 110.495 -179.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -59.7 119.51 6.76 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.947 2.431 . . . . 64.430000000000007 112.266 -177.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -108.3 148.05 30.59 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 121.405 0.621 . . . . 74.209999999999994 110.456 -178.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -102.43 -34.74 9.04 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.225 -0.898 . . . . 75.430000000000007 110.049 178.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 115.7 -0.682 . . . . 61.350000000000001 110.518 179.152 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . 0.64 ' N ' ' HZ1' ' A' ' 42' ' ' LYS . . . . . . . . 0 N--CA 1.45 -0.41 0 N-CA-C 111.551 -0.62 . . . . 51.210000000000001 111.551 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 7.6 p 30.03 82.07 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.738 1.215 . . . . 74.109999999999999 113.323 -179.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 95.8 mt -91.76 -21.71 20.56 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 115.458 -0.792 . . . . 72.150000000000006 110.138 177.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 85.1 mtp -56.08 112.26 1.16 Allowed 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.556 -0.747 . . . . 73.120000000000005 110.131 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -31.23 119.36 0.21 Allowed 'General case' 0 N--CA 1.47 0.543 0 O-C-N 124.946 1.404 . . . . 75.109999999999999 112.94 -178.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -75.46 146.71 40.44 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.006 -0.997 . . . . 72.450000000000003 111.583 -172.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -159.41 -65.09 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.685 0 N-CA-C 111.332 -0.707 . . . . 74.129999999999995 111.332 177.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -141.22 -173.56 3.77 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.397 -0.594 . . . . 41.340000000000003 109.397 177.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 94.7 t -68.49 114.96 5.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.244 0.545 . . . . 75.230000000000004 110.044 176.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 84.7 mt -120.45 176.33 5.54 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.435 -0.802 . . . . 62.439999999999998 109.755 -178.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 4.7 t -81.18 153.27 27.3 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.373 -0.603 . . . . 73.409999999999997 109.373 176.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 43.9 tp -137.04 111.75 8.76 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.226 0.536 . . . . 71.340000000000003 110.79 177.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 113' ' ' ALA . . . . . 0.63 ' HB1' ' HB2' ' B' ' 116' ' ' LEU . . . -94.54 82.9 4.03 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.594 -0.73 . . . . 72.230000000000004 110.113 177.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.67 ' HA ' ' OG ' ' B' ' 118' ' ' SER . . . -71.08 -20.51 62.34 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.245 -0.889 . . . . 65.219999999999999 110.558 -178.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -97.53 -2.34 42.05 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.347 -0.842 . . . . 62.140000000000001 110.636 -177.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.63 ' HB2' ' HB1' ' B' ' 113' ' ' ALA . 98.0 mt -133.63 -66.7 0.63 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.016 0.376 . . . . 44.039999999999999 112.016 -174.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 20.6 m -75.16 -47.39 28.7 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.29 0.478 . . . . 73.409999999999997 112.29 -171.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . 0.67 ' OG ' ' HA ' ' B' ' 114' ' ' ALA . 34.6 p -78.89 110.31 13.97 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.828 0.347 . . . . 62.450000000000003 110.621 -179.473 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -80.85 147.5 30.37 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.115 -0.493 . . . . 52.219999999999999 110.625 -179.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 1.6 p -72.44 153.58 41.33 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.04 -0.527 . . . . 73.209999999999994 111.436 -179.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . 0.554 ' H ' HD13 ' B' ' 121' ' ' LEU . 0.0 OUTLIER -130.35 6.93 4.91 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.787 0.803 . . . . 64.099999999999994 109.293 177.967 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -68.98 147.88 50.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.199 -1.364 . . . . 74.109999999999999 111.059 -174.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -148.17 143.62 19.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-N 114.479 -1.237 . . . . 72.340000000000003 110.575 -171.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.617 ' HA ' ' OE2' ' B' ' 146' ' ' GLU . 66.5 m -78.78 85.17 4.8 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.183 0.516 . . . . 54.43 110.704 -179.446 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . 0.526 ' HD2' ' HG3' ' B' ' 126' ' ' GLN . 0.0 OUTLIER -115.64 20.52 14.6 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.686 -0.688 . . . . 65.209999999999994 110.996 177.959 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 126' ' ' GLN . . . . . 0.526 ' HG3' ' HD2' ' B' ' 125' ' ' LYS . 22.1 mt-30 -115.4 -163.8 0.91 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.515 -0.766 . . . . 60.32 110.048 -178.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -80.24 65.17 5.31 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.131 0.491 . . . . 72.049999999999997 109.857 176.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 11.7 m -99.95 11.72 38.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.64 -0.709 . . . . 61.020000000000003 110.25 -174.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -78.36 23.45 0.29 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.509 -0.769 . . . . 74.150000000000006 111.197 -175.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.525 HG22 HD13 ' A' ' 63' ' ' LEU . 21.9 t -84.31 -36.22 11.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.113 -0.494 . . . . 71.019999999999996 111.848 -172.271 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 131' ' ' PHE . . . . . . . . . . . . . 26.0 p90 -88.47 -17.22 30.84 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.219 0.451 . . . . 74.519999999999996 112.219 -171.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.466 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 54.7 t30 -55.52 -60.14 3.84 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.142 0.276 . . . . 75.510000000000005 111.661 -171.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 133' ' ' ILE . . . . . 0.586 HD11 ' HB3' ' A' ' 82' ' ' ASP . 39.5 mm -59.52 -46.52 92.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.27 0.557 . . . . 75.420000000000002 111.482 -176.007 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.432 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 88.0 mt -58.22 -30.71 66.71 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.587 -0.733 . . . . 54.32 111.613 -179.564 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -77.73 -33.61 52.91 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.751 0.31 . . . . 63.030000000000001 110.599 -178.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 136' ' ' GLU . . . . . 0.469 ' OE1' ' HA ' ' B' ' 133' ' ' ILE . 33.5 mt-10 -64.72 -46.56 81.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.406 0.622 . . . . 62.240000000000002 110.296 177.609 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 39.3 m-80 -90.83 5.25 49.19 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.363 -0.835 . . . . 65.109999999999999 110.796 -175.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 31.5 t70 60.2 65.13 1.12 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.982 -1.008 . . . . 64.409999999999997 112.754 173.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 139' ' ' PHE . . . . . 0.432 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 9.7 m-85 -95.92 1.29 52.82 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.667 -0.697 . . . . 65.209999999999994 109.938 169.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 60.34 76.5 0.42 Allowed Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.647 -0.706 . . . . 62.009999999999998 110.796 -178.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -79.86 157.19 24.15 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.814 2.342 . . . . 75.209999999999994 112.087 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . 11.8 mptt -93.44 -172.65 2.98 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.925 0.393 . . . . 75.209999999999994 111.766 -176.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 143' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -70.83 150.53 45.73 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.43 -0.805 . . . . 71.239999999999995 111.468 -170.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -109.51 87.0 2.4 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.063 -0.517 . . . . 62.200000000000003 110.274 -179.148 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 145' ' ' CYS . . . . . 0.881 ' HB2' HG21 ' A' ' 47' ' ' VAL . 60.5 m -116.53 82.95 1.88 Allowed 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.17 0.509 . . . . 65.109999999999999 109.978 177.471 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . 0.617 ' OE2' ' HA ' ' B' ' 124' ' ' SER . 6.7 pt-20 -83.25 95.01 8.02 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.742 0.782 . . . . 74.420000000000002 110.281 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 3.5 t -96.11 163.69 2.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.142 -0.935 . . . . 71.310000000000002 109.527 -178.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.68 158.55 38.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.736 -0.211 . . . . 65.019999999999996 110.504 178.406 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.569 ' HB3' ' HD2' ' B' ' 151' ' ' PHE . 10.9 mp -73.04 88.2 1.39 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.294 -0.412 . . . . 72.010000000000005 110.576 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -91.69 72.06 5.82 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.424 -0.584 . . . . 65.319999999999993 109.424 174.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 151' ' ' PHE . . . . . 0.569 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 50.3 p90 -102.09 166.08 10.8 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.04 -0.527 . . . . 74.319999999999993 110.584 -176.102 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.8 tppp? -94.69 124.36 38.68 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.014 -0.539 . . . . 63.5 110.212 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 153' ' ' CYS . . . . . 0.538 ' HB3' ' CG ' ' B' ' 158' ' ' LYS . 32.5 t -138.64 117.09 12.02 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.321 -0.399 . . . . 73.209999999999994 110.194 178.158 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 73.2 4.51 4.91 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.235 -0.893 . . . . 54.229999999999997 112.087 174.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 119.6 -19.46 9.75 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.439 -0.886 . . . . 55.130000000000003 112.822 178.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -114.51 156.1 25.22 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.984 -0.376 . . . . 73.140000000000001 109.984 177.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 46.4 mm -78.35 117.55 23.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 110.039 -0.356 . . . . 65.430000000000007 110.039 177.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 158' ' ' LYS . . . . . 0.705 ' HB3' ' HE1' ' B' ' 160' ' ' PHE . 29.0 mmmt -100.34 103.62 15.03 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.192 -0.67 . . . . 70.25 109.192 178.622 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . 0.464 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.2 OUTLIER -89.51 113.39 24.77 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.048 -0.523 . . . . 73.200000000000003 111.165 -176.228 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 160' ' ' PHE . . . . . 0.705 ' HE1' ' HB3' ' B' ' 158' ' ' LYS . 34.3 m-85 -115.17 134.3 55.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.115 0.484 . . . . 75.219999999999999 110.989 -179.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 16.6 p -114.38 1.68 14.47 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.692 -0.686 . . . . 74.409999999999997 110.616 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 162' ' ' ASP . . . . . 0.577 ' HB2' ' CB ' ' B' ' 165' ' ' SER . 4.1 m-20 -134.65 150.17 50.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.891 -0.595 . . . . 74.010000000000005 110.077 -174.475 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . 0.447 ' HG ' HG22 ' A' ' 30' ' ' VAL . 5.6 tt -79.12 -51.03 10.08 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.006 -0.739 . . . . 72.219999999999999 109.006 177.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 61.4 tt0 -60.82 -35.78 77.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.515 -0.766 . . . . 71.409999999999997 110.771 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . 0.665 ' HA ' ' HE3' ' B' ' 168' ' ' LYS . 13.4 t -65.02 -36.27 83.85 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.732 -0.667 . . . . 72.549999999999997 110.624 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . 0.509 ' HA ' ' CE2' ' B' ' 160' ' ' PHE . 52.4 tp -71.25 -31.8 67.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.797 0.332 . . . . 72.340000000000003 110.408 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . 0.42 ' HG3' HD11 ' B' ' 184' ' ' LEU . 56.5 ttp180 -61.54 -36.12 79.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.964 -0.562 . . . . 75.519999999999996 110.124 177.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 168' ' ' LYS . . . . . 0.665 ' HE3' ' HA ' ' B' ' 165' ' ' SER . 9.8 mtmp? -59.63 -43.62 93.76 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.903 -0.59 . . . . 74.0 110.558 176.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 169' ' ' PHE . . . . . 0.483 ' O ' ' HG2' ' B' ' 172' ' ' GLN . 40.4 t80 -70.7 -40.76 72.69 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.453 -0.794 . . . . 65.230000000000004 110.007 -178.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 170' ' ' ALA . . . . . 0.462 ' HB2' HD12 ' B' ' 180' ' ' LEU . . . -61.88 -31.44 71.72 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.995 -0.548 . . . . 64.430000000000007 111.179 177.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 9.1 t -78.33 -28.95 47.42 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 121.062 -0.255 . . . . 72.439999999999998 111.233 -176.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . 0.483 ' HG2' ' O ' ' B' ' 169' ' ' PHE . 21.0 pt20 -85.82 -5.94 59.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.468 0.651 . . . . 71.239999999999995 109.937 177.563 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 10.7 mmmm -118.41 98.09 6.09 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.232 -0.894 . . . . 63.409999999999997 110.101 -179.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 16.8 t -51.35 -34.85 35.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.083 0.468 . . . . 32.399999999999999 110.454 -179.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 175' ' ' SER . . . . . 0.577 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 3.9 m -62.06 -47.29 85.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.799 -0.637 . . . . 65.439999999999998 111.059 178.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 86.3 mtp -82.89 -21.65 34.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.929 -0.578 . . . . 71.109999999999999 111.224 -175.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 20.5 ttmm -66.57 -23.73 66.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.678 0.752 . . . . 75.340000000000003 109.296 175.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -100.15 4.28 44.36 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.947 -1.024 . . . . 72.340000000000003 109.655 -177.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 179' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' B' ' 175' ' ' SER . 57.7 mt -103.16 -49.96 3.61 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.293 -0.867 . . . . 73.430000000000007 109.325 175.525 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 180' ' ' LEU . . . . . 0.462 HD12 ' HB2' ' B' ' 170' ' ' ALA . 9.8 mt -86.91 5.74 35.45 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.821 -0.627 . . . . 74.129999999999995 110.477 -176.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 181' ' ' LYS . . . . . 0.515 ' HB2' ' HG3' ' B' ' 186' ' ' GLN . 63.4 pttt -59.7 -11.84 5.85 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.474 -0.784 . . . . 73.230000000000004 111.673 178.317 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -63.54 -35.02 79.09 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.368 0.604 . . . . 73.150000000000006 109.683 175.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 23.9 t -102.76 -37.74 5.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.048 -0.978 . . . . 64.409999999999997 110.098 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 184' ' ' LEU . . . . . 0.42 HD11 ' HG3' ' B' ' 167' ' ' ARG . 10.7 mp -71.81 134.29 83.8 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.617 -0.72 . . . . 52.229999999999997 110.497 -178.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -61.78 123.67 13.08 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.759 2.306 . . . . 53.530000000000001 112.486 -177.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 186' ' ' GLN . . . . . 0.515 ' HG3' ' HB2' ' B' ' 181' ' ' LYS . 29.5 mm-40 -123.99 136.78 54.52 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.707 -0.678 . . . . 65.150000000000006 109.974 -179.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 187' ' ' LYS . . . . . 0.493 ' HB2' ' OE2' ' B' ' 188' ' ' GLU . 67.0 mttm -79.74 -26.75 40.66 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.227 -0.657 . . . . 61.539999999999999 109.227 173.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 188' ' ' GLU . . . . . 0.493 ' OE2' ' HB2' ' B' ' 187' ' ' LYS . 1.5 mp0 . . . . . 0 C--O 1.253 1.24 0 CA-C-O 118.263 -0.875 . . . . 73.409999999999997 110.144 178.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.649 0 N-CA-C 111.817 -0.513 . . . . 73.439999999999998 111.817 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 27.5 m -72.73 -36.63 53.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.724 0.297 . . . . 65.340000000000003 111.017 -179.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 32.7 tp -128.9 -41.74 1.44 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.412 -0.358 . . . . 74.319999999999993 110.223 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 24.4 ptm 41.48 91.9 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.639 1.176 . . . . 75.200000000000003 113.614 177.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -66.32 142.2 57.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.466 -0.788 . . . . 75.340000000000003 109.405 176.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -72.46 152.0 42.2 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.193 0.521 . . . . 52.539999999999999 111.632 -173.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 166.35 -143.91 8.73 Favored Glycine 0 N--CA 1.439 -1.133 0 N-CA-C 110.835 -0.906 . . . . 50.530000000000001 110.835 179.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -95.18 101.23 12.96 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 110.176 -0.305 . . . . 75.010000000000005 110.176 178.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 41.3 t -74.62 -46.72 41.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 121.391 0.615 . . . . 64.340000000000003 111.141 -178.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -144.69 134.37 23.51 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.367 -0.833 . . . . 74.049999999999997 110.42 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 m -106.02 143.77 33.68 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.875 -0.602 . . . . 74.030000000000001 110.312 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.521 ' HA ' ' OG ' ' A' ' 17' ' ' SER . 0.5 OUTLIER -99.74 120.42 39.7 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.454 -0.943 . . . . 73.150000000000006 108.454 175.692 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.624 ' HB3' ' O ' ' A' ' 16' ' ' LEU . . . -54.79 -69.45 0.13 Allowed 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.502 0.501 . . . . 73.430000000000007 112.242 -175.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -152.21 -75.41 0.14 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.064 -0.516 . . . . 71.439999999999998 109.851 178.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -90.9 -46.62 8.08 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.192 -1.04 . . . . 63.109999999999999 108.192 172.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.624 ' O ' ' HB3' ' A' ' 13' ' ' ALA . 95.8 mt -141.02 158.17 44.31 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.387 -1.279 . . . . 55.140000000000001 107.91 173.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.521 ' OG ' ' HA ' ' A' ' 12' ' ' LEU . 39.8 m -81.75 30.54 0.37 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.514 0.673 . . . . 51.299999999999997 110.812 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 42.8 t -120.53 107.0 12.33 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.4 -0.818 . . . . 33.43 109.715 -178.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.82 113.11 10.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.296 -0.411 . . . . 52.039999999999999 110.444 179.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 18.5 m -80.5 105.81 12.03 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.086 -0.506 . . . . 71.150000000000006 110.346 178.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 87.9 mt -99.37 -163.98 1.09 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.93 -0.577 . . . . 53.039999999999999 109.811 177.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -59.72 106.47 0.48 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.441 -0.345 . . . . 74.430000000000007 110.612 -179.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 13.5 tt -63.88 -38.84 83.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.978 -0.555 . . . . 71.150000000000006 110.949 -177.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.9 m -127.66 126.37 41.83 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.43 -0.582 . . . . 73.310000000000002 109.43 176.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -96.3 -5.57 39.83 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.962 0.41 . . . . 73.019999999999996 110.203 -178.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -107.67 99.24 8.74 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.042 -0.526 . . . . 70.230000000000004 110.568 -172.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -123.66 94.67 4.31 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.003 0.43 . . . . 72.219999999999999 110.772 178.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.2 m -124.85 10.76 8.33 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.944 -0.571 . . . . 73.200000000000003 110.384 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.73 HD22 HG21 ' B' ' 183' ' ' VAL . 17.9 p-10 -77.22 -54.56 6.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.727 -0.669 . . . . 72.310000000000002 110.618 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.669 HG23 ' H ' ' A' ' 31' ' ' PHE . 3.7 m 32.57 -98.54 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 N-CA-C 114.214 1.19 . . . . 61.0 114.214 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.669 ' H ' HG23 ' A' ' 30' ' ' VAL . 32.4 p90 -117.49 12.86 14.28 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 111.895 0.332 . . . . 74.299999999999997 111.895 -173.038 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.552 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 50.1 t30 -54.62 -54.91 35.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.052 0.453 . . . . 73.140000000000001 111.046 -176.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.752 HG21 ' HB3' ' B' ' 179' ' ' LEU . 36.1 mm -58.55 -38.47 70.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.678 -0.692 . . . . 65.120000000000005 111.489 -176.324 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.6 mt -62.66 -34.51 77.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.84 -0.618 . . . . 74.140000000000001 111.771 -177.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 74.8 ttt180 -81.02 -36.72 30.25 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.492 -0.483 . . . . 71.510000000000005 110.366 178.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.552 ' HG2' ' O ' ' A' ' 32' ' ' ASN . 8.5 mm-40 -67.04 -31.4 71.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.76 0.314 . . . . 62.109999999999999 111.139 -178.486 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -98.33 -1.15 42.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.9 0.381 . . . . 65.109999999999999 111.003 178.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 19.5 t70 59.84 74.95 0.42 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.926 0.87 . . . . 73.040000000000006 111.749 176.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.484 ' HB3' ' HB2' ' B' ' 151' ' ' PHE . 3.7 m-85 -94.54 -4.21 48.42 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.986 -1.007 . . . . 71.120000000000005 109.865 169.002 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 59.39 74.7 0.56 Allowed Pre-proline 0 N--CA 1.463 0.22 0 O-C-N 124.178 0.924 . . . . 70.230000000000004 110.252 -174.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -80.32 -165.2 0.32 Allowed 'Trans proline' 0 N--CA 1.458 -0.599 0 C-N-CA 123.277 2.651 . . . . 54.43 112.221 -177.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.932 ' HD3' ' HB3' ' B' ' 150' ' ' ALA . 6.9 tptp -116.24 168.7 9.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.134 -0.485 . . . . 73.129999999999995 110.327 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.68 ' HB3' ' HZ ' ' B' ' 143' ' ' PHE . 57.5 m-85 -163.59 71.59 0.25 Allowed 'General case' 0 C--N 1.327 -0.387 0 O-C-N 123.653 0.596 . . . . 74.140000000000001 109.969 -170.04 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 45.9 tp -167.74 97.69 0.47 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.194 -0.457 . . . . 74.450000000000003 109.919 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.506 ' SG ' ' HA ' ' B' ' 147' ' ' VAL . 84.3 m -155.86 -179.97 8.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.948 -0.569 . . . . 75.239999999999995 110.326 -178.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -70.01 89.19 0.6 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.395 0.617 . . . . 74.409999999999997 110.376 176.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.894 HG11 ' HA ' ' B' ' 143' ' ' PHE . 48.7 t -90.57 155.21 3.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.548 -0.751 . . . . 71.420000000000002 109.779 179.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.531 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER -93.38 103.05 15.3 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.398 0.618 . . . . 72.209999999999994 109.802 179.349 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.521 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 9.3 mp -67.33 91.15 0.24 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.997 -1.001 . . . . 74.239999999999995 111.171 -176.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' B' ' 142' ' ' LYS . . . -90.38 96.72 10.79 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.911 -0.774 . . . . 71.430000000000007 108.911 170.281 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.639 ' HB3' ' HA ' ' B' ' 141' ' ' PRO . 49.5 p90 -129.93 170.01 14.49 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.71 -0.677 . . . . 54.219999999999999 110.34 -176.185 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.7 tppp? -85.08 131.22 34.48 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.257 -0.429 . . . . 73.319999999999993 110.65 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 39.4 t -146.89 119.31 8.42 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.646 -0.502 . . . . 52.109999999999999 109.646 174.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 31.4 t70 71.39 2.74 4.38 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.668 -0.696 . . . . 33.350000000000001 112.404 175.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 117.76 -20.06 11.04 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.415 -0.898 . . . . 74.420000000000002 112.15 -179.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -107.77 163.83 12.76 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.819 -0.437 . . . . 64.129999999999995 109.819 178.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 46.7 mm -93.03 125.41 45.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.734 -0.469 . . . . 74.340000000000003 109.734 177.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.559 ' O ' ' HA ' ' A' ' 50' ' ' ALA . 30.6 mmmt -107.46 141.13 39.36 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.337 -0.392 . . . . 74.420000000000002 110.023 -179.295 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -112.63 115.67 28.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.0 0.428 . . . . 45.340000000000003 111.169 176.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -120.75 106.28 11.55 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.162 -0.472 . . . . 63.210000000000001 110.834 178.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.531 ' HB3' ' HB3' ' A' ' 48' ' ' LYS . 5.4 p -96.96 -2.42 43.67 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.102 -0.499 . . . . 51.229999999999997 110.944 178.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -131.14 138.69 49.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.033 -0.53 . . . . 72.299999999999997 110.775 179.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.406 HD23 ' HE3' ' B' ' 127' ' ' TRP . 46.4 tp -70.36 -31.03 68.13 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.282 -0.636 . . . . 74.340000000000003 109.282 175.59 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -56.94 -47.17 81.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.782 -0.644 . . . . 74.519999999999996 110.389 174.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.6 m -63.77 -43.18 97.15 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.928 -0.578 . . . . 74.230000000000004 110.952 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 33.6 tp -72.94 -32.08 65.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.414 . . . . 72.239999999999995 110.862 -177.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.404 ' HG2' HD21 ' A' ' 84' ' ' LEU . 55.4 ttp180 -59.29 -44.45 92.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.055 -0.52 . . . . 75.099999999999994 110.19 178.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -62.79 -46.82 86.23 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.728 -0.669 . . . . 74.530000000000001 110.827 178.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.46 ' CE2' ' HE3' ' A' ' 73' ' ' LYS . 46.5 t80 -63.72 -45.42 90.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.249 -0.887 . . . . 71.430000000000007 110.883 -176.388 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.73 -24.98 64.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.134 -0.484 . . . . 70.299999999999997 112.018 -176.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.1 m -65.05 -38.11 89.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.813 0.34 . . . . 75.200000000000003 111.231 -179.106 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -92.27 0.11 57.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.09 0.472 . . . . 70.219999999999999 111.217 -178.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 66.4 mmtt -97.5 116.91 30.61 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.909 -0.587 . . . . 75.0 110.247 177.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.2 m -64.61 -35.0 79.59 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.093 0.473 . . . . 42.439999999999998 110.561 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 23.3 t -78.78 -34.05 45.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.689 -0.687 . . . . 53.0 110.916 -179.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.509 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 82.4 mtp -92.15 -12.47 32.77 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.652 0.263 . . . . 61.43 111.64 -175.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.58 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 40.4 tttp -52.27 -43.11 64.24 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.04 -0.527 . . . . 61.109999999999999 110.972 174.406 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.467 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 28.7 mm-40 -90.88 -2.53 57.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.485 0.66 . . . . 63.100000000000001 110.444 -172.037 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.549 ' HB2' HD22 ' A' ' 80' ' ' LEU . 36.1 mt -90.48 -53.7 4.32 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.162 -0.926 . . . . 72.200000000000003 109.872 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.549 HD22 ' HB2' ' A' ' 79' ' ' LEU . 3.0 mm? -94.93 3.45 54.95 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.768 -0.651 . . . . 53.43 111.515 -176.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.58 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 65.3 pttt -55.98 -16.41 4.81 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.274 0.472 . . . . 70.010000000000005 112.274 178.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -58.63 -30.56 67.38 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.935 0.398 . . . . 74.129999999999995 111.228 177.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 19.7 m -123.18 10.34 5.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.215 0.531 . . . . 71.519999999999996 111.01 178.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.767 HD23 ' HD2' ' A' ' 85' ' ' PRO . 3.1 mt -112.98 129.89 24.07 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.903 -0.59 . . . . 53.43 110.602 -177.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.767 ' HD2' HD23 ' A' ' 84' ' ' LEU . 19.8 Cg_endo -59.52 117.8 4.59 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.844 2.363 . . . . 74.349999999999994 111.958 177.369 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.5 ' HG3' ' HB2' ' A' ' 81' ' ' LYS . 77.6 mm-40 -117.61 155.77 29.28 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.052 -0.522 . . . . 74.239999999999995 109.846 -177.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 55.0 pttt -84.42 -12.06 55.08 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.501 -0.772 . . . . 70.299999999999997 109.695 176.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 . . . . . 0 C--O 1.238 0.488 0 CA-C-N 115.167 -0.924 . . . . 75.310000000000002 110.77 176.35 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . 0.502 ' O ' ' HG2' ' B' ' 104' ' ' MET . . . . . . . . 0 N--CA 1.45 -0.388 0 N-CA-C 111.872 -0.491 . . . . 64.010000000000005 111.872 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 9.9 p -84.48 -11.97 11.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.571 0.7 . . . . 72.030000000000001 109.628 176.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 103' ' ' LEU . . . . . 0.499 HD12 ' N ' ' B' ' 104' ' ' MET . 1.2 pp -88.45 -21.4 24.24 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.618 -0.719 . . . . 72.049999999999997 111.888 -178.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 104' ' ' MET . . . . . 0.502 ' HG2' ' O ' ' B' ' 101' ' ' GLY . 22.6 ptm -75.34 96.27 3.36 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.889 0.852 . . . . 75.230000000000004 110.876 -175.371 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -70.15 179.49 2.35 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.895 -1.048 . . . . 64.420000000000002 109.497 175.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -79.41 136.1 36.87 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.069 0.461 . . . . 43.439999999999998 111.036 -175.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -167.8 -170.94 33.21 Favored Glycine 0 N--CA 1.435 -1.419 0 N-CA-C 110.761 -0.936 . . . . 65.209999999999994 110.761 178.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -79.76 79.03 6.31 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 121.024 0.44 . . . . 60.329999999999998 110.884 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 59.5 t -72.88 -53.24 19.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.586 0.708 . . . . 72.310000000000002 109.806 177.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 110' ' ' LEU . . . . . 0.651 ' H ' HD23 ' B' ' 110' ' ' LEU . 2.3 pt? -120.29 124.37 45.43 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 114.796 -1.093 . . . . 75.310000000000002 109.655 177.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 19.0 m -122.71 111.28 16.53 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.962 -0.295 . . . . 60.140000000000001 110.558 -178.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . 0.492 ' HA ' ' OG ' ' B' ' 117' ' ' SER . 0.1 OUTLIER -99.51 128.55 45.62 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.372 -0.603 . . . . 73.049999999999997 109.372 177.448 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 113' ' ' ALA . . . . . 0.751 ' HB3' ' O ' ' B' ' 116' ' ' LEU . . . -87.13 -170.99 3.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.175 -0.466 . . . . 52.549999999999997 110.65 -178.749 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -57.75 -76.69 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.338 0.495 . . . . 63.119999999999997 112.338 -176.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 115' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -68.94 -60.64 2.23 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.828 -0.805 . . . . 74.120000000000005 108.828 175.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.751 ' O ' ' HB3' ' B' ' 113' ' ' ALA . 93.6 mt -149.24 160.61 43.23 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 106.756 -1.572 . . . . 61.32 106.756 178.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.492 ' OG ' ' HA ' ' B' ' 112' ' ' LEU . 18.2 m -57.23 -21.97 37.77 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.404 0.621 . . . . 60.229999999999997 110.587 179.021 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 33.0 t -114.43 94.22 4.69 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.151 -0.931 . . . . 73.129999999999995 109.08 178.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -72.36 146.23 47.21 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.914 -0.585 . . . . 65.5 111.172 -175.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 26.7 m -74.86 101.23 4.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.309 0.576 . . . . 63.32 110.422 179.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 85.8 mt -90.63 -163.34 1.01 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.36 -0.837 . . . . 70.5 110.021 178.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -74.77 73.52 2.06 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.131 -0.322 . . . . 63.399999999999999 110.131 176.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 14.8 tt -59.65 -30.75 45.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.919 -0.582 . . . . 71.329999999999998 110.872 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 20.2 m -117.78 116.03 26.18 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.889 -0.596 . . . . 71.310000000000002 109.828 177.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.08 1.77 39.68 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.262 0.553 . . . . 64.519999999999996 109.577 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -99.91 124.4 45.19 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.591 -0.732 . . . . 72.230000000000004 111.245 -173.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 127' ' ' TRP . . . . . 0.406 ' HE3' HD23 ' A' ' 63' ' ' LEU . 76.2 m95 -129.03 40.69 3.59 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.146 -0.687 . . . . 64.129999999999995 109.146 178.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 4.9 p -81.46 8.31 9.74 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 112.909 0.707 . . . . 62.140000000000001 112.909 -171.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -95.34 97.53 9.91 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.679 -0.489 . . . . 64.510000000000005 109.679 178.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.467 ' C ' ' H ' ' B' ' 132' ' ' ASN . 18.7 m -105.54 -157.01 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.932 -0.576 . . . . 71.439999999999998 110.518 -179.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 131' ' ' PHE . . . . . 0.404 ' H ' ' HB ' ' B' ' 130' ' ' VAL . 43.4 p90 -68.48 11.08 0.19 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.456 -0.338 . . . . 74.219999999999999 111.76 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.467 ' H ' ' C ' ' B' ' 130' ' ' VAL . 8.7 t30 -54.92 -48.47 73.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.082 -0.508 . . . . 75.530000000000001 110.959 179.258 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 133' ' ' ILE . . . . . 0.515 HG21 ' HB3' ' A' ' 79' ' ' LEU . 43.2 mm -61.99 -42.54 95.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.339 0.59 . . . . 62.310000000000002 110.777 -179.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.518 HD12 HD23 ' A' ' 49' ' ' LEU . 98.9 mt -70.29 -26.31 63.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.613 -0.722 . . . . 52.43 111.784 -174.267 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -76.37 -35.18 58.81 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.336 -0.546 . . . . 75.120000000000005 109.875 176.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -63.83 -30.24 71.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.838 -0.619 . . . . 72.230000000000004 110.723 176.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -102.62 5.74 39.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.045 -0.525 . . . . 63.130000000000003 111.263 -179.472 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 57.41 51.3 10.05 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.708 -0.678 . . . . 62.329999999999998 112.317 174.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 139' ' ' PHE . . . . . 0.488 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 7.6 m-85 -82.72 -8.0 59.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.109 -0.496 . . . . 64.450000000000003 110.221 172.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 140' ' ' GLU . . . . . 0.41 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 37.0 tt0 58.42 75.89 0.5 Allowed Pre-proline 0 N--CA 1.464 0.232 0 CA-C-N 115.487 -0.779 . . . . 71.200000000000003 110.785 -176.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.639 ' HA ' ' HB3' ' A' ' 51' ' ' PHE . 78.1 Cg_endo -80.2 173.61 12.36 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.669 2.246 . . . . 74.329999999999998 112.491 -178.39 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 142' ' ' LYS . . . . . 0.82 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 11.5 tptp -99.1 -179.76 4.35 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.091 -0.504 . . . . 63.520000000000003 109.795 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 143' ' ' PHE . . . . . 0.894 ' HA ' HG11 ' A' ' 47' ' ' VAL . 44.1 t80 175.92 79.23 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.133 0.492 . . . . 74.420000000000002 109.921 -174.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 41.4 tp -165.83 91.88 0.5 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.885 -0.598 . . . . 62.030000000000001 110.098 177.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 145' ' ' CYS . . . . . 0.645 ' SG ' ' HA ' ' A' ' 47' ' ' VAL . 92.6 m -145.32 176.16 9.76 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.26 -0.882 . . . . 71.140000000000001 109.049 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -80.9 91.64 6.03 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.397 0.618 . . . . 74.439999999999998 110.689 178.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 147' ' ' VAL . . . . . 0.517 HG11 ' HA ' ' A' ' 43' ' ' PHE . 18.7 t -77.49 161.15 4.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.138 -0.937 . . . . 53.219999999999999 110.001 178.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . 0.771 ' HB3' ' HB3' ' B' ' 161' ' ' SER . 0.0 OUTLIER -92.74 90.48 7.08 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.911 -0.774 . . . . 70.409999999999997 108.911 179.99 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.627 HD22 ' H ' ' B' ' 149' ' ' LEU . 1.5 mm? -60.72 107.92 0.77 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.316 -0.857 . . . . 73.439999999999998 111.298 -171.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.932 ' HB3' ' HD3' ' A' ' 42' ' ' LYS . . . -97.08 87.47 4.22 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.835 -0.802 . . . . 54.310000000000002 108.835 171.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 151' ' ' PHE . . . . . 0.518 ' HD2' ' HB3' ' B' ' 149' ' ' LEU . 45.4 p90 -119.85 167.05 12.5 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.704 -0.68 . . . . 71.530000000000001 110.593 -175.544 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -93.65 122.25 35.91 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.997 -0.547 . . . . 72.409999999999997 110.079 177.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 153' ' ' CYS . . . . . 0.431 ' HB2' ' HE1' ' B' ' 151' ' ' PHE . 20.8 t -137.13 121.61 18.31 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.067 -0.515 . . . . 75.319999999999993 110.097 177.686 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 20.9 t70 73.54 1.8 4.07 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.874 -0.603 . . . . 61.32 111.545 171.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 116.3 -11.59 16.79 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.782 -0.723 . . . . 72.120000000000005 112.495 -179.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 156' ' ' GLU . . . . . 0.833 ' HG3' ' HD3' ' B' ' 158' ' ' LYS . 10.4 pt-20 -117.31 145.32 44.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.838 0.351 . . . . 71.319999999999993 110.667 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 46.2 mm -77.28 127.03 38.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 109.361 -0.607 . . . . 73.120000000000005 109.361 175.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 158' ' ' LYS . . . . . 0.833 ' HD3' ' HG3' ' B' ' 156' ' ' GLU . 30.6 mmmt -120.57 126.94 51.59 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.005 -0.543 . . . . 73.209999999999994 110.279 -176.379 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . 0.58 ' HA ' ' O ' ' B' ' 149' ' ' LEU . 0.9 OUTLIER -103.01 115.42 30.57 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 123.249 0.343 . . . . 71.430000000000007 110.169 172.749 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 160' ' ' PHE . . . . . 0.418 ' CE2' ' HB3' ' B' ' 158' ' ' LYS . 59.9 m-85 -115.28 102.84 10.24 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.349 0.595 . . . . 63.140000000000001 111.758 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . 0.771 ' HB3' ' HB3' ' B' ' 148' ' ' LYS . 34.1 p -108.12 12.35 26.83 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.174 -0.921 . . . . 65.219999999999999 108.714 168.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -132.0 108.12 9.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.766 -1.106 . . . . 53.399999999999999 110.243 -179.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 50.9 tp -66.25 -26.33 67.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.656 -0.702 . . . . 73.340000000000003 110.66 -178.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.09 -52.1 65.26 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.093 -0.503 . . . . 73.299999999999997 110.67 -179.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 30.9 m -72.32 -28.71 63.24 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.645 -0.252 . . . . 61.539999999999999 110.743 178.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 60.6 tp -64.98 -39.88 94.14 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.054 -0.351 . . . . 70.310000000000002 110.054 178.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . 0.545 ' HG3' ' HG ' ' B' ' 184' ' ' LEU . 29.1 ttp180 -61.73 -36.56 81.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.12 0.486 . . . . 63.020000000000003 110.3 177.747 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -66.08 -51.45 57.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.856 -0.611 . . . . 74.209999999999994 110.882 175.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 169' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -68.56 -46.06 70.45 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.787 -0.642 . . . . 75.310000000000002 111.651 -174.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -60.9 -37.43 82.19 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.147 0.425 . . . . 33.109999999999999 112.147 -176.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . 0.481 ' HB3' HD23 ' B' ' 184' ' ' LEU . 22.8 p -73.02 -23.51 60.62 Favored 'General case' 0 C--N 1.323 -0.543 0 N-CA-C 112.054 0.391 . . . . 72.209999999999994 112.054 -174.649 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -95.89 -8.71 33.3 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.839 0.352 . . . . 75.120000000000005 111.138 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 173' ' ' LYS . . . . . 1.092 ' HE2' ' HA ' ' B' ' 173' ' ' LYS . 7.2 mmpt? -86.61 129.88 34.7 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 110.049 -0.352 . . . . 62.229999999999997 110.049 177.188 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 19.2 m -58.31 -43.17 88.01 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.841 0.353 . . . . 75.549999999999997 111.541 -176.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 175' ' ' SER . . . . . 0.586 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 47.1 t -77.21 -49.29 15.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.049 0.452 . . . . 74.439999999999998 110.143 -179.484 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.811 ' HB2' ' HB2' ' B' ' 173' ' ' LYS . 73.0 mtp -66.11 -23.94 66.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.757 -0.656 . . . . 72.209999999999994 111.789 -175.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . 0.648 ' O ' ' HB3' ' B' ' 181' ' ' LYS . 28.5 tttp -59.26 -35.94 74.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 65.530000000000001 110.788 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -88.86 -21.38 23.71 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 121.519 0.676 . . . . 72.120000000000005 110.314 -176.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 179' ' ' LEU . . . . . 0.752 ' HB3' HG21 ' A' ' 33' ' ' ILE . 35.8 mt -75.88 -46.24 31.24 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.845 -1.07 . . . . 74.5 110.466 -178.093 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 180' ' ' LEU . . . . . 0.821 ' HB3' HD13 ' B' ' 184' ' ' LEU . 3.7 mm? -98.57 -3.35 36.5 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.532 -0.758 . . . . 75.510000000000005 112.027 -174.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 181' ' ' LYS . . . . . 0.648 ' HB3' ' O ' ' B' ' 177' ' ' LYS . 64.9 pttt -56.12 -18.24 9.35 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.904 0.705 . . . . 65.310000000000002 112.904 -177.459 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -70.04 -38.62 75.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.002 0.43 . . . . 61.020000000000003 110.937 179.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 183' ' ' VAL . . . . . 0.73 HG21 HD22 ' A' ' 29' ' ' ASN . 18.7 m -108.63 -9.01 11.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.996 -0.547 . . . . 72.409999999999997 111.605 -175.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 184' ' ' LEU . . . . . 0.821 HD13 ' HB3' ' B' ' 180' ' ' LEU . 8.6 mp -94.64 139.69 22.36 Favored Pre-proline 0 C--N 1.325 -0.488 0 N-CA-C 110.221 -0.289 . . . . 62.049999999999997 110.221 177.208 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.55 116.42 3.28 Favored 'Trans proline' 0 CA--C 1.529 0.238 0 C-N-CA 122.985 2.457 . . . . 54.43 112.87 -178.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -117.34 -171.72 2.09 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.427 -0.583 . . . . 74.329999999999998 109.427 177.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -121.56 -0.27 9.77 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.466 0.651 . . . . 70.400000000000006 110.257 179.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 18.3 mp0 . . . . . 0 C--O 1.25 1.126 0 CA-C-N 115.055 -0.975 . . . . 52.32 110.642 178.985 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.749 0 N-CA-C 112.234 -0.346 . . . . 64.209999999999994 112.234 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 29.3 m -87.45 156.34 3.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.586 0.193 . . . . 61.530000000000001 110.925 -178.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.489 HD13 ' O ' ' A' ' 3' ' ' LEU . 2.1 tm? -164.02 -27.88 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.141 0.496 . . . . 55.420000000000002 110.327 -176.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 67.3 mtt -88.99 0.87 56.29 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.221 -0.445 . . . . 74.5 111.243 -177.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -83.97 160.27 21.07 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.209 -0.45 . . . . 72.120000000000005 110.176 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.408 ' H ' ' CD ' ' A' ' 6' ' ' GLU . 0.2 OUTLIER -114.57 -174.1 2.42 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.063 -0.517 . . . . 75.239999999999995 111.127 -172.019 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.95 -117.99 2.06 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 121.084 -0.579 . . . . 74.219999999999999 112.171 178.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -147.99 133.42 18.61 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.728 -0.277 . . . . 74.530000000000001 111.009 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 42.0 t -123.64 143.03 38.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.731 -0.47 . . . . 53.130000000000003 109.731 178.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 86.7 mt -77.16 115.11 16.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.695 0.283 . . . . 75.019999999999996 110.742 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.7 m -79.45 110.44 14.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.996 0.427 . . . . 73.150000000000006 110.71 178.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -117.24 121.59 41.61 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.465 -0.568 . . . . 54.350000000000001 109.465 178.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.442 ' HB3' ' H ' ' A' ' 18' ' ' SER . . . -77.5 127.61 32.8 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.853 -0.612 . . . . 55.450000000000003 110.898 -178.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.77 -56.55 3.77 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.308 -0.406 . . . . 72.200000000000003 110.823 -178.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -79.24 -50.12 11.44 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.159 -0.473 . . . . 44.039999999999999 110.904 -177.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.41 HD13 HD13 ' B' ' 116' ' ' LEU . 76.1 mt -75.79 -40.36 55.3 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.496 -0.774 . . . . 62.240000000000002 111.516 -175.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.5 m 50.32 57.92 6.07 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.366 0.603 . . . . 64.239999999999995 110.581 -172.115 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.547 ' HB2' ' HB2' ' B' ' 118' ' ' SER . 13.5 m -75.97 -1.4 25.48 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.508 -0.769 . . . . 62.119999999999997 112.243 -173.73 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.73 87.5 4.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.03 0.443 . . . . 74.319999999999993 110.097 178.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 14.3 t -103.87 -163.66 1.0 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.675 -0.693 . . . . 72.129999999999995 110.533 -176.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -78.28 98.21 5.83 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.661 0.615 . . . . 74.439999999999998 112.661 -173.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.418 ' O ' ' HB3' ' B' ' 122' ' ' ASP . 17.1 t70 -159.51 121.66 3.41 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-N 115.094 -0.957 . . . . 75.400000000000006 108.53 170.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.498 HG22 ' H ' ' B' ' 124' ' ' SER . 6.5 pt -112.58 143.18 22.81 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.136 0 CA-C-N 114.584 -1.189 . . . . 75.010000000000005 113.811 -160.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.2 m -98.85 136.89 38.21 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.913 -1.04 . . . . 71.209999999999994 109.325 171.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.533 ' HD3' ' N ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -143.09 22.44 1.9 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.136 0.493 . . . . 74.150000000000006 111.214 -171.552 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.2 mp0 -80.24 92.93 5.79 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.933 -0.576 . . . . 65.120000000000005 110.627 -177.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -131.25 92.49 3.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.096 -0.502 . . . . 65.140000000000001 110.138 179.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.2 t -115.61 -29.77 6.37 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.621 -0.718 . . . . 63.409999999999997 110.241 -179.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.47 ' OD1' ' HB3' ' A' ' 32' ' ' ASN . 36.4 t-20 -89.51 85.36 6.5 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.76 -0.654 . . . . 71.510000000000005 110.837 -176.186 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.8 m -119.99 126.59 75.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.431 -0.804 . . . . 70.329999999999998 109.575 174.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.409 ' CE2' ' HB3' ' A' ' 43' ' ' PHE . 35.3 p90 49.39 14.57 0.1 Allowed 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.395 1.078 . . . . 61.200000000000003 113.095 -177.383 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.47 ' HB3' ' OD1' ' A' ' 29' ' ' ASN . 34.4 t30 -65.11 -46.11 82.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.013 0.435 . . . . 61.0 110.437 -179.417 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.4 HG21 ' O ' ' B' ' 179' ' ' LEU . 40.6 mm -58.97 -34.35 52.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.718 -0.674 . . . . 72.420000000000002 110.769 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.479 ' CD1' HD21 ' B' ' 149' ' ' LEU . 80.2 mt -72.14 -28.41 63.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.795 -0.639 . . . . 74.129999999999995 110.524 -178.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.99 -44.3 63.7 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.497 -0.557 . . . . 64.219999999999999 109.497 174.381 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -60.32 -45.95 91.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.558 -0.746 . . . . 74.329999999999998 111.355 -179.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -85.36 0.54 51.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.445 -0.343 . . . . 75.409999999999997 111.16 -178.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 21.4 t70 58.1 69.09 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.475 -0.784 . . . . 75.239999999999995 111.609 178.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.6 m-30 -101.63 -2.21 30.93 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.906 -0.588 . . . . 72.219999999999999 110.861 174.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.638 ' HG3' ' HE2' ' A' ' 42' ' ' LYS . 7.5 tp10 62.59 80.87 0.24 Allowed Pre-proline 0 N--CA 1.466 0.35 0 O-C-N 123.68 0.613 . . . . 75.150000000000006 110.624 -174.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -88.92 138.0 3.4 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.048 2.499 . . . . 72.420000000000002 113.352 -176.398 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.678 ' O ' ' HA ' ' B' ' 149' ' ' LEU . 5.6 mptp? -117.82 136.87 53.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 63.240000000000002 109.758 177.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.606 ' HA ' HG11 ' B' ' 147' ' ' VAL . 12.1 t80 171.16 35.16 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.454 0.645 . . . . 61.0 109.385 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.8 mp -72.46 99.94 2.59 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.608 -0.724 . . . . 75.510000000000005 109.966 -178.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 1.5 p -97.35 85.14 3.59 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.427 -0.806 . . . . 44.530000000000001 110.653 -175.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.496 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.9 OUTLIER -89.52 -2.47 58.37 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.383 -0.826 . . . . 74.25 109.281 179.265 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.53 ' HB ' ' HA ' ' B' ' 143' ' ' PHE . 28.2 m -67.11 123.47 20.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.472 0.653 . . . . 60.520000000000003 110.645 177.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.496 ' HG3' ' O ' ' A' ' 46' ' ' GLU . 0.2 OUTLIER -147.72 154.56 40.71 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.533 -0.758 . . . . 70.530000000000001 110.028 -178.195 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.565 ' HB3' ' HD2' ' A' ' 51' ' ' PHE . 10.9 mp -71.52 82.41 0.81 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.001 0.429 . . . . 74.319999999999993 110.765 -178.55 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.09 58.19 4.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.792 -0.64 . . . . 75.140000000000001 109.343 173.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.565 ' HD2' ' HB3' ' A' ' 49' ' ' LEU . 52.3 p90 -89.24 169.42 11.46 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.674 -0.694 . . . . 72.409999999999997 110.723 -175.132 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.509 ' HE3' HD13 ' A' ' 57' ' ' ILE . 3.8 tppp? -100.95 124.27 46.4 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.86 -0.609 . . . . 71.099999999999994 111.035 -177.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.47 ' HB3' ' CG ' ' A' ' 58' ' ' LYS . 45.2 t -143.04 132.12 23.05 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.947 -0.57 . . . . 64.319999999999993 109.535 175.676 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 65.15 11.71 7.4 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.043 -0.526 . . . . 73.420000000000002 112.399 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 102.32 -6.35 53.13 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.74 -0.743 . . . . 60.049999999999997 112.734 177.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -123.72 159.05 30.25 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.841 0.353 . . . . 72.319999999999993 110.293 177.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.509 HD13 ' HE3' ' A' ' 52' ' ' LYS . 41.3 mm -78.43 123.97 36.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 109.787 -0.449 . . . . 75.140000000000001 109.787 176.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.47 ' CG ' ' HB3' ' A' ' 53' ' ' CYS . 27.7 mmmt -104.48 85.26 2.31 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.429 -0.582 . . . . 75.319999999999993 109.429 178.605 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.419 ' CG2' ' HD3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -74.07 112.08 9.86 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.021 -0.536 . . . . 73.510000000000005 111.525 -174.744 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -123.45 116.01 22.53 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.901 0.381 . . . . 74.420000000000002 110.992 178.39 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.5 m -91.1 -12.66 34.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.431 0.634 . . . . 63.299999999999997 109.451 172.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.462 ' OD2' ' HB3' ' A' ' 64' ' ' GLN . 33.4 t70 -115.6 118.87 34.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.34 -0.845 . . . . 54.32 109.923 -179.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -74.11 -25.61 59.88 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.018 0.437 . . . . 62.530000000000001 110.511 -176.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.463 ' O ' ' HB3' ' A' ' 67' ' ' ARG . 28.5 tt0 -63.23 -39.72 95.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.962 -0.563 . . . . 63.140000000000001 109.963 176.267 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.7 m -70.98 -29.05 64.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.641 -0.709 . . . . 75.109999999999999 110.77 177.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 69.4 tp -64.74 -38.75 92.06 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.768 -0.456 . . . . 74.019999999999996 109.768 175.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.463 ' HB3' ' O ' ' A' ' 64' ' ' GLN . 16.5 ttt-85 -56.34 -40.95 75.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.706 -0.679 . . . . 72.019999999999996 110.647 174.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 60.4 mmtt -60.94 -48.83 79.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.164 -0.471 . . . . 73.120000000000005 110.913 177.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.509 ' O ' ' HG2' ' A' ' 72' ' ' GLN . 63.3 t80 -67.23 -46.65 73.18 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.673 -0.694 . . . . 75.340000000000003 111.194 -177.489 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.5 -29.76 70.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.338 -0.392 . . . . 73.530000000000001 111.818 -177.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.4 m -69.21 -25.82 64.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.518 -0.31 . . . . 52.200000000000003 111.608 -178.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.509 ' HG2' ' O ' ' A' ' 69' ' ' PHE . 11.6 pt20 -99.37 -0.68 40.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.141 0.496 . . . . 74.239999999999995 110.524 -179.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.774 ' HE2' ' HA ' ' A' ' 73' ' ' LYS . 9.1 mmpt? -95.96 120.02 35.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.776 -0.647 . . . . 64.049999999999997 109.984 177.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.6 m -57.0 -42.96 81.25 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.933 0.396 . . . . 41.020000000000003 110.813 179.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.472 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 4.7 m -78.35 -42.61 30.03 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.034 -0.53 . . . . 74.409999999999997 111.212 -176.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.734 ' HB2' ' HB2' ' A' ' 73' ' ' LYS . 86.9 mtp -74.28 -19.9 60.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.401 -0.363 . . . . 75.120000000000005 111.339 -175.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.442 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 1.8 tmtm? -56.23 -41.91 76.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.181 -0.463 . . . . 71.510000000000005 110.024 177.329 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -85.13 -20.72 29.86 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.621 0.724 . . . . 61.439999999999998 110.041 -174.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.701 ' HB3' HG21 ' B' ' 133' ' ' ILE . 83.6 mt -75.3 -53.04 9.44 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.734 -1.121 . . . . 73.030000000000001 110.235 179.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.514 ' HB3' HD12 ' A' ' 84' ' ' LEU . 4.1 mm? -82.62 -16.07 49.74 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.564 -0.744 . . . . 74.549999999999997 112.516 -173.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.417 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 63.7 pttt -62.79 -14.69 48.31 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 120.755 0.312 . . . . 35.350000000000001 111.636 -178.102 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -68.51 -42.94 77.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.128 0.49 . . . . 65.420000000000002 110.37 179.269 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.523 HG13 ' HG ' ' A' ' 84' ' ' LEU . 7.7 p -99.09 -37.1 5.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.94 -0.573 . . . . 74.010000000000005 111.102 -178.492 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.523 ' HG ' HG13 ' A' ' 83' ' ' VAL . 90.7 mt -92.52 118.81 68.18 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.473 -0.33 . . . . 71.120000000000005 110.946 -177.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.424 ' HD2' ' HA ' ' A' ' 84' ' ' LEU . 29.0 Cg_endo -62.86 127.62 20.96 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.974 2.449 . . . . 71.129999999999995 112.314 179.11 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.511 ' HB3' ' OE1' ' A' ' 88' ' ' GLU . 85.3 mm-40 -100.51 -169.84 1.78 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.663 -0.699 . . . . 75.25 110.02 -178.42 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -118.16 -31.6 4.96 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.248 0.547 . . . . 70.140000000000001 110.639 -177.268 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.511 ' OE1' ' HB3' ' A' ' 86' ' ' GLN . 1.4 pm0 . . . . . 0 C--N 1.321 -0.647 0 CA-C-N 115.487 -0.779 . . . . 74.239999999999995 110.855 -178.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.544 0 N-CA-C 112.218 -0.353 . . . . 62.109999999999999 112.218 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 15.6 m -90.35 113.04 25.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.137 0.494 . . . . 70.439999999999998 110.901 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -102.52 -13.18 17.31 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.059 -0.518 . . . . 63.32 110.598 178.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 65.5 mtt -90.68 24.53 2.65 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.044 -0.526 . . . . 73.030000000000001 111.069 -176.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -89.44 166.47 13.68 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.607 -0.516 . . . . 72.549999999999997 109.607 177.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -135.66 179.5 6.3 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.817 0.341 . . . . 61.409999999999997 110.953 -177.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -99.05 -144.97 17.72 Favored Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.969 -0.634 . . . . 72.0 111.796 -179.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -125.07 108.48 11.86 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.749 0.309 . . . . 50.109999999999999 110.663 -178.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 48.0 t -86.71 94.78 4.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.244 -0.434 . . . . 73.439999999999998 110.006 178.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 88.7 mt -60.81 107.96 0.78 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.999 -0.546 . . . . 64.140000000000001 110.214 179.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 95.4 m -109.61 125.49 52.62 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.97 -0.559 . . . . 63.100000000000001 111.144 -176.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . 0.447 HD13 ' N ' ' B' ' 113' ' ' ALA . 0.5 OUTLIER -73.9 132.83 42.89 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.246 -1.02 . . . . 65.200000000000003 108.246 175.074 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 113' ' ' ALA . . . . . 0.656 ' HB1' ' HB2' ' B' ' 116' ' ' LEU . . . -45.25 126.18 6.07 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 123.888 0.742 . . . . 65.120000000000005 112.686 -175.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.458 ' O ' ' HB2' ' B' ' 115' ' ' ASP . . . -70.17 97.01 1.14 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.125 -0.488 . . . . 70.409999999999997 110.29 176.51 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 115' ' ' ASP . . . . . 0.458 ' HB2' ' O ' ' B' ' 114' ' ' ALA . 23.9 m-20 82.91 -36.92 0.08 Allowed 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 114.558 -1.201 . . . . 74.450000000000003 111.564 173.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.656 ' HB2' ' HB1' ' B' ' 113' ' ' ALA . 58.2 mt -61.02 -43.74 98.43 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.716 -0.475 . . . . 74.420000000000002 109.716 176.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.443 ' N ' ' HB3' ' B' ' 113' ' ' ALA . 14.4 t 56.34 24.89 8.81 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.42 -0.809 . . . . 45.149999999999999 112.174 172.608 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . 0.547 ' HB2' ' HB2' ' A' ' 18' ' ' SER . 4.2 m -83.53 25.09 0.79 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.331 -0.395 . . . . 74.140000000000001 111.518 -176.437 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.479 ' O ' ' HB ' ' B' ' 120' ' ' THR . . . -112.18 107.93 17.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.539 -0.3 . . . . 64.200000000000003 110.926 -177.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 120' ' ' THR . . . . . 0.479 ' HB ' ' O ' ' B' ' 119' ' ' ALA . 10.9 t 170.81 -23.84 0.0 OUTLIER 'General case' 0 N--CA 1.461 0.119 0 O-C-N 123.835 0.709 . . . . 75.329999999999998 110.126 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.69 79.17 6.09 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.469 -0.787 . . . . 73.150000000000006 109.826 -177.37 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 122' ' ' ASP . . . . . 0.418 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 18.3 t70 -159.45 149.5 18.87 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.771 -0.649 . . . . 70.230000000000004 109.529 177.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 10.9 tt -138.79 79.39 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.932 0.872 . . . . 75.239999999999995 110.332 176.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.498 ' H ' HG22 ' A' ' 23' ' ' ILE . 48.8 m -85.48 116.26 23.68 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.492 -0.777 . . . . 64.420000000000002 110.284 177.156 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . 0.461 ' HD3' ' H ' ' B' ' 125' ' ' LYS . 0.0 OUTLIER -119.52 30.06 7.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.536 0.684 . . . . 73.409999999999997 110.429 -177.613 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 126' ' ' GLN . . . . . . . . . . . . . 26.6 mp0 -82.34 30.72 0.4 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.468 -0.787 . . . . 73.329999999999998 111.492 -177.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 127' ' ' TRP . . . . . . . . . . . . . 53.0 m95 -100.68 86.77 3.18 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.348 -0.612 . . . . 54.299999999999997 109.348 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 31.7 t -100.25 -18.37 16.88 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.771 -0.65 . . . . 73.120000000000005 110.579 -173.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . 0.459 ' HB3' HG21 ' A' ' 83' ' ' VAL . 29.3 t-20 -88.47 101.39 13.87 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.935 -0.575 . . . . 60.310000000000002 110.32 -177.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.554 HG23 ' HD1' ' B' ' 131' ' ' PHE . 10.4 m -128.47 -46.25 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.464 -0.334 . . . . 62.240000000000002 111.822 -178.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 131' ' ' PHE . . . . . 0.554 ' HD1' HG23 ' B' ' 130' ' ' VAL . 52.3 p90 -120.31 0.24 10.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.793 0.33 . . . . 72.310000000000002 110.533 179.259 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.45 ' O ' ' HG3' ' B' ' 136' ' ' GLU . 7.3 t30 -55.41 -55.08 35.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.761 -0.654 . . . . 61.43 111.226 -179.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 133' ' ' ILE . . . . . 0.701 HG21 ' HB3' ' A' ' 79' ' ' LEU . 49.0 mm -54.75 -46.89 74.42 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.155 -0.475 . . . . 74.420000000000002 111.201 -178.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.545 ' HB3' ' HB2' ' B' ' 139' ' ' PHE . 84.7 mt -62.82 -37.22 85.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.71 -0.677 . . . . 73.430000000000007 111.021 -177.503 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.437 HH11 ' HG2' ' B' ' 136' ' ' GLU . 0.1 OUTLIER -65.61 -41.6 92.55 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.673 0.273 . . . . 53.43 110.53 177.944 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 136' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' B' ' 132' ' ' ASN . 16.6 mt-10 -69.75 -28.13 65.53 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.399 -0.364 . . . . 71.140000000000001 111.2 -176.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 137' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -101.48 8.13 42.17 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.157 0.503 . . . . 73.319999999999993 110.439 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 138' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 60.27 45.93 10.82 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.11 -0.95 . . . . 65.530000000000001 112.395 173.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 139' ' ' PHE . . . . . 0.545 ' HB2' ' HB3' ' B' ' 134' ' ' LEU . 8.1 m-85 -79.83 -8.92 59.56 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.12 -0.491 . . . . 70.140000000000001 109.926 172.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 140' ' ' GLU . . . . . 0.437 ' O ' ' HA ' ' A' ' 51' ' ' PHE . 10.5 tp10 63.21 70.69 0.71 Allowed Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 115.306 -0.861 . . . . 73.450000000000003 110.679 179.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.409 ' C ' ' HD2' ' B' ' 142' ' ' LYS . 89.2 Cg_endo -87.93 151.11 7.15 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.792 2.328 . . . . 74.049999999999997 112.348 -179.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 142' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' B' ' 143' ' ' PHE . 4.2 mptp? -116.9 131.52 56.93 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.562 -0.533 . . . . 63.439999999999998 109.562 179.354 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 143' ' ' PHE . . . . . 0.53 ' HA ' ' HB ' ' A' ' 47' ' ' VAL . 27.8 t80 177.59 60.85 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.351 0.596 . . . . 73.450000000000003 109.481 179.298 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 32.1 tp -78.42 93.35 4.71 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.367 -0.605 . . . . 64.140000000000001 109.367 176.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 145' ' ' CYS . . . . . . . . . . . . . 11.8 p -80.96 72.28 7.96 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.889 -0.596 . . . . 70.519999999999996 112.046 -173.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -128.59 90.01 2.99 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.922 -0.581 . . . . 74.230000000000004 110.304 172.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 147' ' ' VAL . . . . . 0.606 HG11 ' HA ' ' A' ' 43' ' ' PHE . 3.2 t -131.73 154.73 40.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 108.032 -1.099 . . . . 74.140000000000001 108.032 173.667 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.8 132.25 26.89 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 120.636 -0.425 . . . . 44.229999999999997 110.041 179.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.678 ' HA ' ' O ' ' A' ' 42' ' ' LYS . 61.7 tp -71.81 79.32 0.87 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.672 -0.694 . . . . 65.200000000000003 109.488 176.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.641 ' H ' ' HB2' ' A' ' 42' ' ' LYS . . . -83.81 74.93 10.14 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.941 -0.572 . . . . 73.409999999999997 110.997 -177.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 151' ' ' PHE . . . . . 0.584 ' CD1' ' HG ' ' B' ' 149' ' ' LEU . 15.0 p90 -107.09 161.63 14.58 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.986 -0.552 . . . . 73.230000000000004 110.229 179.131 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 152' ' ' LYS . . . . . 0.417 ' HE3' ' CD1' ' B' ' 157' ' ' ILE . 4.8 tppp? -90.94 117.36 29.48 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.413 -0.812 . . . . 62.340000000000003 110.325 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 153' ' ' CYS . . . . . 0.558 ' HB2' ' CE2' ' B' ' 151' ' ' PHE . 42.6 t -135.83 122.65 21.15 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.657 -0.701 . . . . 51.329999999999998 110.035 179.013 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.7 t70 73.64 4.27 4.7 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.757 -0.656 . . . . 72.010000000000005 111.182 172.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 155' ' ' GLY . . . . . . . . . . . . . . . 109.12 -4.02 31.63 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.826 -0.702 . . . . 74.340000000000003 112.351 179.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 156' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -125.45 155.82 39.86 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 110.017 -0.364 . . . . 73.140000000000001 110.017 176.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . 0.417 ' CD1' ' HE3' ' B' ' 152' ' ' LYS . 44.5 mm -84.76 115.52 26.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 109.358 -0.608 . . . . 50.229999999999997 109.358 177.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 158' ' ' LYS . . . . . 0.487 ' HE2' ' CE1' ' B' ' 169' ' ' PHE . 31.9 mmmt -100.24 94.63 6.31 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.555 0.217 . . . . 74.129999999999995 111.025 -175.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 1.2 p -78.09 111.88 14.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.007 0.432 . . . . 72.030000000000001 111.941 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 160' ' ' PHE . . . . . 0.454 ' CD2' HD13 ' B' ' 166' ' ' LEU . 64.1 m-85 -121.16 126.66 50.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.899 -0.591 . . . . 72.120000000000005 110.623 175.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 54.1 m -99.92 9.86 42.26 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.025 0.44 . . . . 73.519999999999996 110.453 174.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -143.51 138.75 29.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.93 -0.577 . . . . 71.400000000000006 110.943 -175.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . 0.478 HD13 ' O ' ' B' ' 163' ' ' LEU . 2.0 tm? -81.35 -33.41 32.44 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.781 -0.452 . . . . 74.010000000000005 109.781 -176.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 164' ' ' GLN . . . . . 0.449 ' O ' ' HB3' ' B' ' 167' ' ' ARG . 22.1 tt0 -57.97 -47.33 83.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.823 -0.626 . . . . 63.32 110.838 179.516 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . 0.482 ' O ' ' HB2' ' B' ' 168' ' ' LYS . 18.5 m -70.02 -31.73 69.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.933 -0.576 . . . . 74.420000000000002 111.193 179.426 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . 0.454 HD13 ' CD2' ' B' ' 160' ' ' PHE . 54.9 tp -67.53 -33.64 75.47 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.709 -0.478 . . . . 73.319999999999993 109.709 175.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' B' ' 164' ' ' GLN . 50.5 ttp180 -59.87 -36.76 77.58 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.693 -0.685 . . . . 75.530000000000001 109.879 173.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 168' ' ' LYS . . . . . 0.482 ' HB2' ' O ' ' B' ' 165' ' ' SER . 67.2 mmtt -63.76 -51.69 63.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.761 -0.654 . . . . 75.019999999999996 110.522 176.287 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 169' ' ' PHE . . . . . 0.487 ' CE1' ' HE2' ' B' ' 158' ' ' LYS . 41.0 t80 -59.47 -41.6 90.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.797 -0.638 . . . . 54.100000000000001 110.509 -178.14 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 170' ' ' ALA . . . . . 0.543 ' HB2' HD12 ' B' ' 180' ' ' LEU . . . -62.79 -42.56 99.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.214 -0.448 . . . . 74.109999999999999 111.591 178.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 49.3 m -67.22 -28.81 68.38 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.492 -0.322 . . . . 40.130000000000003 111.598 -176.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -95.51 9.57 39.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.091 0.472 . . . . 71.209999999999994 110.731 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 173' ' ' LYS . . . . . . . . . . . . . 55.6 mmtt -118.21 156.68 28.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.84 -0.618 . . . . 72.439999999999998 110.757 179.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.2 p -87.13 -56.18 3.49 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.17 0.509 . . . . 62.420000000000002 109.681 172.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 175' ' ' SER . . . . . 0.534 ' O ' ' HG ' ' B' ' 179' ' ' LEU . 3.4 m -55.95 -53.74 53.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.449 -0.796 . . . . 73.019999999999996 111.427 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 19.0 mtp -74.7 -20.04 60.01 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.041 -0.527 . . . . 73.549999999999997 112.163 -172.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -64.36 -36.38 83.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.09 0.472 . . . . 74.230000000000004 110.671 178.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -94.21 -11.52 30.15 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 115.792 -0.64 . . . . 53.340000000000003 109.905 -173.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 179' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' B' ' 175' ' ' SER . 62.8 mt -76.03 -51.4 12.4 Favored 'General case' 0 N--CA 1.437 -1.101 0 N-CA-C 108.971 -0.752 . . . . 70.150000000000006 108.971 174.575 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 180' ' ' LEU . . . . . 0.543 HD12 ' HB2' ' B' ' 170' ' ' ALA . 8.5 mt -92.42 -1.48 56.98 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.524 -0.762 . . . . 64.200000000000003 111.574 -171.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 181' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -60.18 -13.22 11.15 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.769 0.319 . . . . 64.120000000000005 111.729 178.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 182' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -70.21 -29.44 66.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.991 0.424 . . . . 53.399999999999999 110.782 178.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 183' ' ' VAL . . . . . . . . . . . . . 28.5 m -114.66 -19.9 6.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.185 -0.461 . . . . 63.43 111.355 179.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 184' ' ' LEU . . . . . . . . . . . . . 83.5 mt -98.06 118.01 64.27 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 109.877 -0.416 . . . . 71.239999999999995 109.877 178.398 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 185' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -62.29 109.92 0.94 Allowed 'Trans proline' 0 N--CA 1.464 -0.263 0 C-N-CA 122.899 2.399 . . . . 72.340000000000003 112.699 -176.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 186' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -84.42 121.5 27.64 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.904 -0.589 . . . . 74.140000000000001 109.658 176.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 187' ' ' LYS . . . . . . . . . . . . . 24.8 mtmt -59.76 -59.13 5.93 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.66 -0.7 . . . . 51.219999999999999 109.536 177.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 . . . . . 0 C--O 1.251 1.163 0 CA-C-N 114.812 -1.086 . . . . 63.520000000000003 110.18 -175.405 . . . . . . . . 0 0 . 1 stop_ save_