data_2lo6_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 2lo6 _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 ' 6' ' ' ASP . . . . . 0.443 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 12.4 t70 . . . . . 0 CA--C 1.537 0.443 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.443 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 12.4 t80 -55.21 -14.19 1.61 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.167 0.587 . . . . 0.0 110.876 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -52.89 -37.09 60.13 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 124.396 1.078 . . . . 0.0 111.214 175.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -65.18 -43.88 90.27 Favored 'General case' 0 N--CA 1.457 -0.101 0 CA-C-N 119.328 0.967 . . . . 0.0 110.342 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -65.65 -50.52 64.68 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -177.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 99.7 t -63.13 -54.52 32.32 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -178.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.51 -33.62 70.03 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 119.437 -0.316 . . . . 0.0 111.654 -178.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 67.1 m -70.65 -43.98 68.04 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 118.62 0.646 . . . . 0.0 110.495 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.3 tp -65.59 -33.99 77.19 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.208 0.528 . . . . 0.0 110.064 -179.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -66.62 -45.72 78.16 Favored 'General case' 0 CA--C 1.522 -0.101 0 C-N-CA 124.164 0.985 . . . . 0.0 110.063 177.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 74.2 m -65.43 -26.36 67.93 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 110.371 -0.233 . . . . 0.0 110.371 176.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -68.03 -45.06 75.02 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 174.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt . . . . . 0 CA--C 1.529 0.157 0 C-N-CA 123.768 0.827 . . . . 0.0 111.659 177.663 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 18.7 mm . . . . . 0 CA--C 1.529 0.151 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.5 m -51.7 132.06 30.67 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.354 0.661 . . . . 0.0 112.049 -174.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -70.04 -16.0 72.41 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-O 118.909 -0.939 . . . . 0.0 113.366 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.412 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 41.2 t -65.93 -42.79 89.63 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-N 118.974 1.387 . . . . 0.0 110.625 -177.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -68.04 -37.46 81.36 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 62.8 mt -63.59 -41.71 93.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -58.39 -43.28 88.46 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 118.561 -0.733 . . . . 0.0 111.967 176.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.408 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -65.62 -43.54 89.23 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 119.735 1.152 . . . . 0.0 111.102 178.459 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.3 mt -61.44 -57.08 13.65 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.612 0.244 . . . . 0.0 110.413 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 43.3 p -56.69 -41.17 76.9 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.474 0.31 . . . . 0.0 111.748 177.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.9 m -56.02 -56.23 23.29 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 119.143 -0.456 . . . . 0.0 110.698 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -67.27 -33.64 75.75 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 118.971 -1.091 . . . . 0.0 111.548 -175.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.426 ' HB2' ' HH ' ' A' ' 76' ' ' TYR . . . -60.52 -59.76 4.89 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 118.225 0.466 . . . . 0.0 110.817 174.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 53.9 mt -71.62 -14.66 62.13 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.181 0.992 . . . . 0.0 112.889 -173.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -55.82 -34.85 65.75 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -178.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -153.11 -17.9 0.15 Allowed 'General case' 0 C--N 1.34 0.155 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -177.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 31.3 mm 47.75 75.91 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-O 121.829 0.823 . . . . 0.0 111.417 -178.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -132.09 8.19 4.37 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.911 0.884 . . . . 0.0 109.83 177.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.504 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.8 pt -144.54 123.72 6.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 C-N-CA 125.301 1.44 . . . . 0.0 108.145 -178.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.22 -66.72 1.04 Allowed 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 179.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 50.8 m -66.85 -22.47 65.99 Favored 'General case' 0 N--CA 1.46 0.051 0 C-N-CA 122.714 0.406 . . . . 0.0 111.844 -174.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.572 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -75.17 -52.99 9.59 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 123.996 0.918 . . . . 0.0 109.203 179.012 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.464 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 10.8 mt -58.95 -45.81 91.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 C-N-CA 123.041 0.536 . . . . 0.0 110.025 175.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.401 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 12.3 mm -69.59 -46.28 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-O 119.298 -0.382 . . . . 0.0 111.517 -177.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 40.4 t -58.68 -36.59 74.44 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 118.712 0.687 . . . . 0.0 109.697 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.9 tp -67.87 -45.01 75.74 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 118.754 -0.641 . . . . 0.0 112.282 -178.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 28.5 pt -73.41 -37.07 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-N 119.608 1.095 . . . . 0.0 111.893 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 97.4 mt -63.25 -52.65 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -66.91 -25.63 66.47 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.516 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -61.49 -43.68 98.44 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 173.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.505 ' HB2' ' HG ' ' A' ' 65' ' ' SER . 22.3 t -64.51 -42.78 95.59 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 120.747 0.308 . . . . 0.0 110.346 175.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.64 -48.91 76.51 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 124.809 1.244 . . . . 0.0 112.536 -176.042 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 78.4 mt -81.89 -14.59 55.98 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -174.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 78.9 m -108.91 156.17 39.51 Favored Pre-proline 0 CA--C 1.535 0.375 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -169.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_exo -55.77 -179.87 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.351 1 C-N-CA 126.069 4.513 . . . . 0.0 115.409 176.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -55.46 -43.65 75.67 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.574 1.55 . . . . 0.0 114.036 -174.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.9 p -58.7 -28.44 65.79 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 31.8 m80 -92.02 -14.93 28.6 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 118.861 -0.59 . . . . 0.0 111.208 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -69.15 -47.47 64.95 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 169.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.1 tp -66.14 -45.41 81.11 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.383 177.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.94 -43.65 96.65 Favored Glycine 0 C--N 1.336 0.556 0 N-CA-C 111.124 -0.79 . . . . 0.0 111.124 178.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.505 ' HG ' ' HB2' ' A' ' 54' ' ' SER . 21.7 t -67.0 -37.72 84.72 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 117.579 0.689 . . . . 0.0 110.608 179.158 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 28.5 mt -57.89 -39.58 78.21 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.317 0.962 . . . . 0.0 110.579 174.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -71.57 -32.03 67.63 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.251 0.932 . . . . 0.0 111.835 178.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 83.7 mt -70.96 -47.02 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 O-C-N 121.609 -0.682 . . . . 0.0 110.18 176.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 79.7 mt -61.02 -36.05 69.64 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 C-N-CA 124.208 1.003 . . . . 0.0 109.156 176.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -62.9 -50.05 72.39 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 123.729 0.812 . . . . 0.0 110.656 176.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.5 t -70.47 -49.07 52.37 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 118.887 -1.125 . . . . 0.0 111.952 -175.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 46.2 mt -65.33 -37.55 80.4 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.8 -48.97 58.28 Favored Glycine 0 CA--C 1.523 0.583 0 CA-C-O 119.596 -0.558 . . . . 0.0 112.309 -178.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.5 mtp-105 -66.12 -38.53 88.43 Favored 'General case' 0 CA--C 1.522 -0.106 0 CA-C-N 117.845 0.823 . . . . 0.0 110.92 178.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.74 -42.57 81.62 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 121.091 -0.243 . . . . 0.0 110.47 178.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.426 ' HH ' ' HB2' ' A' ' 36' ' ' ALA . 8.0 m-30 -61.39 -47.52 85.42 Favored 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 175.638 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.0 tp -59.09 -44.94 91.97 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.743 0.417 . . . . 0.0 110.813 -176.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -67.62 -41.65 83.63 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.631 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 59.2 tt0 -65.95 -38.96 89.94 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.502 -176.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.3 t -82.93 -23.17 33.61 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 117.928 0.331 . . . . 0.0 111.303 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 28.9 ttp180 . . . . . 0 N--CA 1.463 0.177 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 172.204 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.531 0.229 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.9 p -50.95 -30.01 13.76 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.088 0.955 . . . . 0.0 113.416 -175.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.98 -46.83 89.14 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 118.753 0.706 . . . . 0.0 109.579 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -74.72 -23.09 58.52 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.987 178.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.401 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -64.29 -45.59 87.33 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 175.356 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.77 -42.25 91.99 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -59.35 -34.97 73.03 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 121.303 -0.159 . . . . 0.0 110.969 178.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.3 m -76.61 -40.77 48.36 Favored 'General case' 0 C--O 1.227 -0.098 0 O-C-N 122.288 -0.258 . . . . 0.0 111.244 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.8 mt -61.41 -29.49 69.97 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 174.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.47 -14.58 28.25 Favored Glycine 0 CA--C 1.529 0.95 0 CA-C-O 119.016 -0.88 . . . . 0.0 113.816 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -100.51 -6.79 24.94 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 118.776 1.288 . . . . 0.0 111.689 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.3 m -123.72 -18.28 4.13 Favored 'Isoleucine or valine' 0 C--N 1.339 0.134 0 N-CA-C 112.5 0.555 . . . . 0.0 112.5 -178.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -54.53 -28.08 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 118.48 0.582 . . . . 0.0 111.548 -177.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -62.29 -51.79 66.29 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.778 0.431 . . . . 0.0 111.215 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -77.94 -28.49 49.62 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 122.093 -0.379 . . . . 0.0 111.008 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.0 mt -65.25 -49.78 68.32 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 178.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 69.2 mt -65.56 -60.14 3.24 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 118.5 -0.762 . . . . 0.0 110.31 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.9 p -53.67 -40.37 65.87 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 119.011 -1.076 . . . . 0.0 112.199 -173.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -72.67 -45.0 61.11 Favored 'General case' 0 C--N 1.342 0.24 0 CA-C-N 119.44 1.018 . . . . 0.0 111.095 178.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.96 -33.98 65.26 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.148 0.579 . . . . 0.0 111.635 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -79.2 -41.97 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 CA-C-N 119.345 0.975 . . . . 0.0 112.019 173.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.54 -27.08 66.66 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.001 0.364 . . . . 0.0 111.746 -177.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.33 -18.41 45.8 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.647 0.779 . . . . 0.0 110.653 177.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.2 m -80.44 164.63 22.91 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -173.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -101.4 -179.41 4.02 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 169.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 15.9 tp60 -51.33 -39.92 58.01 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.639 0.654 . . . . 0.0 111.592 -178.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -69.08 -54.56 14.38 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -177.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -64.87 -35.87 82.52 Favored 'General case' 0 C--N 1.339 0.131 0 O-C-N 122.2 -0.312 . . . . 0.0 110.4 -178.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 11.9 ttpt -56.71 -51.9 67.04 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 175.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.5 -35.29 78.91 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.885 -176.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -63.59 -39.64 94.91 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 122.215 -0.303 . . . . 0.0 111.239 175.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.5 mt -68.88 -37.38 77.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 49.7 tpt85 -60.89 -41.41 95.97 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 122.792 0.437 . . . . 0.0 109.967 175.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 65.9 ttp -68.42 -37.67 80.5 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 122.62 0.368 . . . . 0.0 110.611 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 8.4 tt -59.48 -51.71 68.72 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.4 mt -71.03 -25.87 62.85 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 120.444 -0.502 . . . . 0.0 111.446 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 13.4 t70 . . . . . 0 N--CA 1.455 -0.179 0 CA-C-N 118.285 0.493 . . . . 0.0 109.874 175.775 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 160' ' ' PRO . . . . . 0.412 ' HD2' ' N ' ' A' ' 27' ' ' SER . 80.7 Cg_endo . . . . . 0 N--CA 1.451 -0.975 0 N-CA-C 109.742 -0.907 . . . . 0.0 109.742 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 45.5 m -65.74 144.9 56.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -151.23 142.6 23.4 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.634 0.254 . . . . 0.0 111.326 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 163' ' ' SER . . . . . 0.402 ' C ' ' H ' ' B' ' 165' ' ' THR . 36.5 p -144.09 159.71 51.83 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-O 120.996 0.427 . . . . 0.0 111.328 177.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -57.02 -0.91 0.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 124.335 3.357 . . . . 0.0 113.464 174.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 165' ' ' THR . . . . . 0.402 ' H ' ' C ' ' B' ' 163' ' ' SER . 26.9 m . . . . . 0 N--CA 1.455 -0.215 0 CA-C-N 118.045 0.384 . . . . 0.0 110.877 178.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 36.2 t70 . . . . . 0 N--CA 1.455 -0.218 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -56.97 -17.12 8.53 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.018 0.372 . . . . 0.0 110.469 174.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -55.52 -42.75 74.95 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.109 0.564 . . . . 0.0 110.327 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -56.55 -43.32 79.82 Favored 'General case' 0 C--N 1.337 0.064 0 CA-C-N 118.264 0.484 . . . . 0.0 110.506 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -66.91 -52.68 40.22 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 110.576 -0.157 . . . . 0.0 110.576 -177.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 67.1 t -61.44 -53.49 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 -179.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.6 -34.66 71.37 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.921 0.488 . . . . 0.0 111.906 -177.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 78.4 m -72.03 -41.03 67.97 Favored 'General case' 0 CA--C 1.523 -0.079 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.707 177.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.3 tp -65.36 -33.05 75.04 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -68.42 -44.76 74.31 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.934 0.894 . . . . 0.0 109.941 176.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 72.1 m -64.36 -26.31 68.41 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 175.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.1 -45.82 69.28 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 174.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt . . . . . 0 CA--C 1.53 0.201 0 C-N-CA 122.967 0.507 . . . . 0.0 111.197 177.698 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 15.8 mm . . . . . 0 CA--C 1.529 0.161 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.4 m -54.88 132.05 45.65 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.045 0.538 . . . . 0.0 111.988 -176.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.14 -19.23 63.6 Favored Glycine 0 C--N 1.338 0.658 0 C-N-CA 124.542 1.067 . . . . 0.0 113.208 -178.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.421 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 63.1 p -67.32 -39.54 85.89 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 118.707 1.253 . . . . 0.0 110.649 -176.037 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -67.55 -40.24 84.97 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 178.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.5 mt -63.72 -39.48 85.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 177.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 47.5 mmtt -63.41 -40.19 96.53 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-O 118.939 -0.553 . . . . 0.0 110.77 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.95 -47.29 75.15 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 118.822 0.737 . . . . 0.0 110.554 175.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.7 mt -59.23 -58.77 7.16 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 122.452 -0.155 . . . . 0.0 110.833 -178.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.4 p -57.39 -49.13 77.17 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 t -62.53 -43.98 97.48 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 119.965 -0.694 . . . . 0.0 111.282 -175.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -77.27 -21.38 53.72 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -178.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.29 -55.81 10.83 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 119.029 0.831 . . . . 0.0 110.019 169.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.5 mt -65.46 -26.14 67.81 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.178 0.991 . . . . 0.0 111.334 -176.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -76.06 -16.81 59.86 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.077 0.551 . . . . 0.0 111.654 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -145.65 48.95 1.24 Allowed 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.206 0.203 . . . . 0.0 111.436 -173.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 43.9 mm -63.07 79.05 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-O 121.468 0.651 . . . . 0.0 110.45 171.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -153.36 18.15 0.55 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.068 1.747 . . . . 0.0 108.538 176.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.567 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.8 OUTLIER -147.09 36.88 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.065 0 C-N-CA 125.542 1.537 . . . . 0.0 108.541 -171.965 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.414 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -51.37 -53.81 32.75 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -175.237 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 85.6 p -75.4 -23.62 57.08 Favored 'General case' 0 CA--C 1.522 -0.107 0 O-C-N 121.577 -0.702 . . . . 0.0 112.369 -173.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.622 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -86.25 -41.61 14.47 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 -179.323 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 45.4 mt -57.37 -50.84 75.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 171.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 13.9 mm -66.85 -50.4 65.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 CA-C-O 119.128 -0.463 . . . . 0.0 112.094 -177.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 87.6 p -58.95 -31.98 69.2 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 118.973 -1.091 . . . . 0.0 110.438 178.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 57.1 tp -68.97 -44.7 72.4 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 118.765 -0.636 . . . . 0.0 112.145 178.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.0 pt -72.01 -34.71 51.49 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 119.682 1.128 . . . . 0.0 112.0 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.4 mt -64.86 -50.83 73.32 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.103 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 177.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -58.43 -41.2 84.48 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.498 177.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -57.95 -40.86 81.57 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 176.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.637 ' HB2' ' HG ' ' A' ' 65' ' ' SER . 9.2 t -64.21 -53.57 47.09 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 121.245 -0.182 . . . . 0.0 111.42 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -72.4 -23.42 61.09 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 113.761 1.022 . . . . 0.0 113.761 -172.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.9 mt -84.03 -15.06 48.96 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.412 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 95.0 m -112.45 158.31 37.66 Favored Pre-proline 0 CA--C 1.533 0.318 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -171.008 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.412 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 74.3 Cg_endo -66.51 -177.47 0.91 Allowed 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 125.09 3.86 . . . . 0.0 113.486 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -55.18 -41.15 71.52 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.114 1.365 . . . . 0.0 114.26 -171.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.4 p -59.74 -32.33 70.46 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 28.9 m170 -88.99 -15.95 32.9 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 119.086 -0.483 . . . . 0.0 111.527 -178.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -68.87 -46.35 68.68 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 170.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 64.3 tp -66.5 -46.66 75.5 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.81 0.338 . . . . 0.0 110.111 177.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.81 -44.07 96.14 Favored Glycine 0 C--N 1.337 0.592 0 N-CA-C 110.7 -0.96 . . . . 0.0 110.7 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.637 ' HG ' ' HB2' ' A' ' 54' ' ' SER . 18.3 t -66.18 -38.53 88.24 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 117.467 0.633 . . . . 0.0 110.367 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 23.3 mt -58.62 -40.12 82.4 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 119.123 0.874 . . . . 0.0 110.717 175.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -69.02 -32.46 71.99 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 119.137 0.881 . . . . 0.0 111.497 178.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 70.8 mt -71.38 -48.21 54.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 O-C-N 121.639 -0.663 . . . . 0.0 110.252 177.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.6 mt -59.56 -36.15 63.32 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.176 0 C-N-CA 124.111 0.964 . . . . 0.0 109.307 176.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -64.33 -52.46 58.34 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.597 0.759 . . . . 0.0 110.54 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.8 t -66.14 -50.56 63.56 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 118.855 -1.138 . . . . 0.0 111.93 -176.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 52.2 mt -65.07 -37.43 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 110.289 -0.263 . . . . 0.0 110.289 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.41 -48.48 57.47 Favored Glycine 0 C--N 1.338 0.658 0 N-CA-C 111.95 -0.46 . . . . 0.0 111.95 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.8 mtp-105 -67.61 -35.11 78.34 Favored 'General case' 0 C--O 1.23 0.061 0 CA-C-N 117.685 0.742 . . . . 0.0 110.701 179.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.61 -42.77 81.86 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 177.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 -62.43 -46.84 86.71 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 176.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 57.6 tp -58.63 -45.1 89.99 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 123.461 0.476 . . . . 0.0 110.424 -177.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -65.79 -46.56 78.27 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.553 -0.092 . . . . 0.0 110.878 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -69.89 -30.9 68.44 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -174.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.5 t -86.35 -26.58 24.77 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 118.61 0.641 . . . . 0.0 111.37 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 . . . . . 0 CA--C 1.529 0.152 0 O-C-N 122.206 -0.309 . . . . 0.0 110.326 174.142 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.274 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 26.3 p -50.24 -30.37 11.52 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.98 -41.37 95.49 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.308 -0.87 . . . . 0.0 110.152 176.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 -66.11 -34.72 78.7 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.111 0.481 . . . . 0.0 110.33 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.56 -45.15 91.81 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.964 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 98.3 mt -63.54 -42.92 97.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 175.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -61.03 -33.24 72.98 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 122.379 -0.201 . . . . 0.0 110.852 179.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 86.1 m -75.48 -41.33 55.73 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.467 0.307 . . . . 0.0 111.191 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.5 mt -62.01 -30.29 70.85 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 174.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.08 -14.58 25.51 Favored Glycine 0 CA--C 1.53 1.014 0 CA-C-O 119.174 -0.792 . . . . 0.0 113.668 178.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -101.95 -3.73 27.32 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.846 1.323 . . . . 0.0 112.136 -179.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 26.8 m -125.86 -18.82 3.0 Favored 'Isoleucine or valine' 0 C--N 1.338 0.074 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -178.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.4 tp -50.83 -27.12 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -177.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -64.98 -46.35 81.83 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 118.03 0.377 . . . . 0.0 110.886 178.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -74.23 -40.81 62.16 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -178.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 89.5 mt -60.32 -50.3 74.18 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.422 -177.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 78.0 mt -66.51 -59.62 3.48 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 118.383 -0.818 . . . . 0.0 110.245 177.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 62.2 p -49.45 -42.09 42.05 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 118.951 0.796 . . . . 0.0 111.898 -173.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -70.57 -51.69 26.77 Favored 'General case' 0 C--O 1.226 -0.152 0 CA-C-N 118.638 0.654 . . . . 0.0 110.863 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.06 -32.43 64.08 Favored 'General case' 0 C--O 1.228 -0.078 0 C-N-CA 123.836 0.854 . . . . 0.0 113.044 -178.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -86.94 -36.43 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.151 0 CA-C-N 119.446 1.021 . . . . 0.0 112.35 175.237 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.92 -28.37 66.6 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.395 0.543 . . . . 0.0 111.0 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.0 -18.12 54.18 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.0 0.92 . . . . 0.0 110.843 178.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 14.9 m -79.07 166.4 22.33 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -174.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -107.93 -174.15 2.45 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.307 1.443 . . . . 0.0 107.886 173.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -50.89 -55.22 18.15 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.349 0.66 . . . . 0.0 112.097 -177.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -68.79 -32.74 72.69 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 122.004 -0.435 . . . . 0.0 111.617 -176.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 58.8 m-70 -76.67 -42.04 43.31 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 118.796 -0.621 . . . . 0.0 111.419 -177.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.73 -33.19 75.09 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 119.328 0.967 . . . . 0.0 108.787 176.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.07 -46.21 90.12 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.172 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -62.42 -42.33 99.37 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.352 176.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.6 mt -66.19 -35.06 74.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -67.43 -38.31 84.36 Favored 'General case' 0 C--O 1.227 -0.107 0 O-C-N 121.986 -0.446 . . . . 0.0 110.637 178.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 64.6 ttp -66.07 -40.99 91.33 Favored 'General case' 0 N--CA 1.457 -0.116 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 176.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.9 tt -59.24 -45.01 92.31 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 177.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 91.2 mt -71.36 -28.68 64.22 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.1 t70 . . . . . 0 N--CA 1.453 -0.291 0 CA-C-N 118.482 0.583 . . . . 0.0 109.506 176.578 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 160' ' ' PRO . . . . . 0.508 ' HG2' ' H ' ' B' ' 161' ' ' SER . 58.4 Cg_endo . . . . . 0 N--CA 1.457 -0.62 0 N-CA-C 111.698 -0.155 . . . . 0.0 111.698 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 161' ' ' SER . . . . . 0.508 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 65.9 p -170.47 148.48 3.14 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.18 0.992 . . . . 0.0 108.997 175.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -158.62 137.96 11.62 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 120.677 0.275 . . . . 0.0 111.628 172.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 16.3 t -137.69 144.76 45.93 Favored Pre-proline 0 CA--C 1.529 0.138 0 C-N-CA 123.743 0.817 . . . . 0.0 110.152 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -66.23 -1.46 5.46 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 123.305 2.67 . . . . 0.0 111.712 177.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 39.4 p . . . . . 0 CA--C 1.53 0.211 0 CA-C-O 119.125 -0.464 . . . . 0.0 111.414 178.234 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.0 p30 . . . . . 0 CA--C 1.53 0.175 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -54.98 -16.41 2.73 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.199 0.6 . . . . 0.0 110.776 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -54.53 -39.16 67.4 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 118.944 -0.551 . . . . 0.0 110.289 173.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 -64.82 -42.31 95.08 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-N 118.947 0.794 . . . . 0.0 110.216 178.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -64.89 -50.32 67.0 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 118.087 0.403 . . . . 0.0 110.425 -178.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 93.0 t -63.75 -54.15 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.6 -30.69 67.42 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 122.781 0.432 . . . . 0.0 111.589 -178.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 54.0 m -74.64 -41.91 59.5 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.268 0.485 . . . . 0.0 110.594 177.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.4 tp -67.05 -29.75 69.62 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -71.04 -39.92 71.99 Favored 'General case' 0 CA--C 1.523 -0.09 0 C-N-CA 124.032 0.933 . . . . 0.0 109.868 175.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.6 t -63.78 -28.75 70.09 Favored 'General case' 0 N--CA 1.456 -0.134 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 173.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.52 -32.25 60.42 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 110.002 -0.369 . . . . 0.0 110.002 174.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt . . . . . 0 N--CA 1.455 -0.185 0 C-N-CA 122.678 0.391 . . . . 0.0 110.203 176.395 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 20.7 mm . . . . . 0 N--CA 1.457 -0.083 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.406 ' HB2' HH11 ' A' ' 28' ' ' ARG . 73.8 m -59.35 132.41 53.93 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.112 0.565 . . . . 0.0 112.41 -175.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.73 -23.62 72.44 Favored Glycine 0 C--N 1.337 0.627 0 C-N-CA 124.117 0.865 . . . . 0.0 112.581 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.449 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 36.6 t -65.08 -41.12 95.32 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 118.533 1.167 . . . . 0.0 110.46 -175.372 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.406 HH11 ' HB2' ' A' ' 25' ' ' SER . 81.0 mtt85 -69.57 -38.8 77.54 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 75.9 mt -64.17 -39.42 85.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 176.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp -67.7 -36.86 81.41 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.348 -0.358 . . . . 0.0 111.412 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.446 ' HE3' ' O ' ' A' ' 27' ' ' SER . 0.0 OUTLIER -68.98 -43.93 73.94 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.676 0.671 . . . . 0.0 110.703 175.484 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.4 mt -62.85 -56.47 17.05 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 110.605 -0.146 . . . . 0.0 110.605 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.441 HG23 ' HB2' ' A' ' 71' ' ' SER . 50.8 p -56.3 -49.18 75.04 Favored 'General case' 0 CA--C 1.522 -0.13 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 177.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 t -62.28 -43.86 97.86 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.964 -174.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -68.47 -35.54 77.71 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 118.721 -1.192 . . . . 0.0 111.503 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.86 -58.0 10.57 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.132 0.424 . . . . 0.0 110.226 174.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.83 -16.23 63.23 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -176.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -59.62 -27.25 66.15 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.3 t-80 -152.3 -23.63 0.17 Allowed 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 -176.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 33.5 mm 46.51 74.96 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 123.431 0.693 . . . . 0.0 111.675 -178.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -147.24 20.57 1.22 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.857 0.863 . . . . 0.0 109.8 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.579 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.3 pt -147.45 35.33 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 C-N-CA 124.291 1.036 . . . . 0.0 109.805 -171.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.457 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -50.61 -58.16 6.5 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.205 1.002 . . . . 0.0 113.601 -177.05 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 52.9 m -73.09 -26.8 61.38 Favored 'General case' 0 CA--C 1.52 -0.192 0 O-C-N 121.864 -0.523 . . . . 0.0 112.4 -174.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.619 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.76 -44.12 15.95 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 119.305 -0.378 . . . . 0.0 109.989 -178.741 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 16.7 mt -56.22 -51.93 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.125 0 CA-C-N 118.303 0.502 . . . . 0.0 109.711 171.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 13.4 mm -66.8 -49.45 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -176.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 34.2 t -56.66 -36.72 69.88 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 119.987 -0.685 . . . . 0.0 109.646 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.1 tp -69.71 -42.37 74.12 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 118.444 -0.789 . . . . 0.0 112.63 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 32.1 pt -72.99 -37.64 54.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 120.003 1.274 . . . . 0.0 111.773 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 95.5 mt -63.39 -49.6 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -59.21 -41.72 89.28 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.762 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -55.83 -40.13 72.38 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 176.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -67.9 -52.6 34.47 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -69.0 -23.03 64.05 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -173.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 55.9 mt -81.33 -14.84 56.85 Favored 'General case' 0 C--O 1.231 0.113 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 177.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.524 ' HB3' ' CG ' ' A' ' 61' ' ' HIS . 76.4 m -126.39 157.89 68.91 Favored Pre-proline 0 CA--C 1.539 0.554 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -170.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.438 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 64.0 Cg_endo -74.76 -166.56 0.35 Allowed 'Trans proline' 0 CA--C 1.537 0.665 1 C-N-CA 125.34 4.027 . . . . 0.0 114.648 -176.07 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -38.77 -57.2 1.24 Allowed 'General case' 0 C--O 1.236 0.358 0 C-N-CA 128.167 2.587 . . . . 0.0 115.342 -173.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.3 t -58.92 -31.49 68.7 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.774 0.321 . . . . 0.0 110.46 -175.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.524 ' CG ' ' HB3' ' A' ' 57' ' ' CYS . 16.2 m80 -82.49 -23.9 34.45 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.076 0.551 . . . . 0.0 111.272 -178.219 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -68.31 -44.67 74.89 Favored 'General case' 0 C--N 1.342 0.25 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 172.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 49.2 tp -66.39 -46.2 77.42 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.271 178.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.63 -44.0 97.22 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.153 -1.179 . . . . 0.0 110.153 177.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.3 t -55.82 -50.51 70.32 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.941 0.371 . . . . 0.0 110.064 177.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 37.5 mt -58.58 -39.94 81.74 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 118.692 -0.671 . . . . 0.0 111.645 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -69.2 -29.36 67.32 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.081 0.855 . . . . 0.0 111.789 179.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 64.1 mt -79.1 -39.24 21.18 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 O-C-N 121.797 -0.564 . . . . 0.0 110.588 178.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 75.9 mt -64.81 -35.8 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 175.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.12 -52.79 53.25 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.102 1.361 . . . . 0.0 110.127 177.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.441 ' HB2' HG23 ' A' ' 33' ' ' THR . 81.3 p -66.38 -52.52 45.96 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 120.049 -0.66 . . . . 0.0 112.015 -175.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 37.6 mt -67.86 -34.43 67.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 CA-C-N 117.641 0.2 . . . . 0.0 110.649 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.98 -50.16 59.27 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 111.692 -0.563 . . . . 0.0 111.692 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.7 mtp-105 -68.02 -36.96 80.82 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-N 117.364 0.582 . . . . 0.0 110.866 178.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.95 -40.95 83.14 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 117.623 0.192 . . . . 0.0 110.551 179.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.8 m-30 -64.79 -45.45 86.24 Favored 'General case' 0 CA--C 1.516 -0.332 0 O-C-N 122.147 -0.346 . . . . 0.0 110.093 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 48.4 tp -59.34 -44.7 92.61 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 123.37 0.419 . . . . 0.0 110.209 -177.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -66.3 -43.74 85.42 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 122.259 -0.276 . . . . 0.0 110.315 177.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.1 tp10 -67.03 -27.71 67.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 119.485 -0.293 . . . . 0.0 111.745 -176.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.9 t -94.04 -23.76 17.88 Favored 'General case' 0 CA--C 1.528 0.115 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 69.9 mtm180 . . . . . 0 C--N 1.342 0.245 0 CA-C-N 119.097 0.862 . . . . 0.0 112.592 176.377 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.232 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.9 p -48.35 -32.58 7.67 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -176.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.82 -46.73 83.8 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.835 0.743 . . . . 0.0 110.074 176.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 66.9 m80 -67.07 -29.79 69.67 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.005 0.522 . . . . 0.0 110.593 178.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.14 -46.6 80.25 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 122.99 0.516 . . . . 0.0 110.462 177.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.8 -42.77 97.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 176.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -61.48 -33.94 74.63 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 122.257 -0.277 . . . . 0.0 111.165 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.1 m -73.36 -42.16 62.56 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.161 -0.337 . . . . 0.0 110.889 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 47.8 mt -60.09 -31.4 69.99 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 174.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.55 -14.53 14.47 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-O 119.019 -0.878 . . . . 0.0 114.23 178.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -101.63 -6.25 24.03 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.957 1.379 . . . . 0.0 112.059 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 30.1 m -121.75 -19.36 4.56 Favored 'Isoleucine or valine' 0 C--N 1.337 0.048 0 C-N-CA 123.099 0.56 . . . . 0.0 111.846 -178.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.9 tp -52.14 -26.99 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 C-N-CA 122.891 0.476 . . . . 0.0 112.055 -178.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -59.44 -57.21 14.0 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 122.896 0.479 . . . . 0.0 111.499 177.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -76.37 -32.81 58.82 Favored 'General case' 0 N--CA 1.457 -0.115 0 O-C-N 122.137 -0.352 . . . . 0.0 111.409 -177.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.4 mt -61.65 -49.48 76.39 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 70.7 mt -65.41 -58.18 6.49 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.343 -0.836 . . . . 0.0 109.989 177.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 98.0 p -50.33 -43.93 54.14 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.093 0.861 . . . . 0.0 111.735 -173.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -68.49 -52.53 31.32 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 118.422 0.555 . . . . 0.0 110.776 177.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.447 ' O ' ' HE3' ' A' ' 115' ' ' LYS . . . -56.19 -33.06 64.96 Favored 'General case' 0 N--CA 1.457 -0.107 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -177.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -87.15 -36.16 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 119.853 1.206 . . . . 0.0 112.374 175.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.44 -25.49 63.22 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 119.771 -0.772 . . . . 0.0 110.747 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.447 ' HE3' ' O ' ' A' ' 112' ' ' ALA . 0.1 OUTLIER -80.2 -20.09 45.52 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.629 0.772 . . . . 0.0 110.536 177.277 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.7 m -77.08 159.18 30.03 Favored 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -171.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -90.62 175.79 6.91 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.831 1.253 . . . . 0.0 107.859 170.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -55.97 -40.76 73.73 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.832 -0.542 . . . . 0.0 112.069 -177.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -69.7 -36.77 76.22 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.958 -0.464 . . . . 0.0 110.654 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -75.3 -42.92 53.63 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 118.734 -0.651 . . . . 0.0 110.843 -178.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.88 -33.66 76.54 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 119.539 1.063 . . . . 0.0 109.78 176.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.1 -46.5 87.04 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.023 177.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -63.89 -37.59 87.97 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.688 177.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 92.7 mt -68.58 -35.55 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -65.44 -40.1 92.86 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 176.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 24.2 ttt -62.41 -43.13 99.55 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 176.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.0 tt -58.04 -44.63 87.52 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 178.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.9 mt -71.45 -32.13 67.97 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.3 t70 . . . . . 0 N--CA 1.456 -0.174 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.019 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 160' ' ' PRO . . . . . 0.565 ' HG2' ' H ' ' B' ' 161' ' ' SER . 63.5 Cg_endo . . . . . 0 N--CA 1.456 -0.69 0 N-CA-C 110.864 -0.475 . . . . 0.0 110.864 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 161' ' ' SER . . . . . 0.565 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 41.2 t -168.43 145.55 3.96 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 124.186 0.994 . . . . 0.0 108.585 175.109 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -157.75 137.84 12.52 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 117.842 0.292 . . . . 0.0 111.434 174.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 12.2 t -135.37 144.98 51.87 Favored Pre-proline 0 N--CA 1.454 -0.227 0 C-N-CA 123.773 0.829 . . . . 0.0 110.362 -178.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -67.81 -0.09 4.95 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 123.186 2.591 . . . . 0.0 110.707 178.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 37.9 m . . . . . 0 CA--C 1.532 0.262 0 C-N-CA 122.582 0.353 . . . . 0.0 110.568 178.688 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.433 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 14.8 t70 . . . . . 0 CA--C 1.535 0.376 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.433 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 16.0 t80 -55.81 -14.77 2.55 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.768 -0.583 . . . . 0.0 111.189 177.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.5 tp60 -55.3 -40.18 70.79 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.265 0.626 . . . . 0.0 110.836 177.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -64.44 -38.64 91.72 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.754 0.706 . . . . 0.0 111.004 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -64.46 -55.13 22.86 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.501 0.591 . . . . 0.0 109.897 178.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.8 t -60.04 -55.37 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 -178.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.12 -33.28 67.19 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 123.248 0.619 . . . . 0.0 112.026 -178.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 53.5 m -70.22 -45.17 67.11 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.847 0.749 . . . . 0.0 110.415 177.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.8 tp -65.6 -33.06 75.04 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.216 0.531 . . . . 0.0 109.741 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -66.72 -45.92 77.15 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 123.916 0.886 . . . . 0.0 110.325 178.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 73.1 m -63.23 -29.45 70.79 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 174.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.79 -29.62 64.66 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.545 0.338 . . . . 0.0 110.264 176.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt . . . . . 0 CA--C 1.53 0.174 0 C-N-CA 122.894 0.478 . . . . 0.0 111.635 176.116 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.4 mm . . . . . 0 CA--C 1.531 0.222 0 CA-C-O 120.967 0.413 . . . . 0.0 110.389 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.0 t -57.53 136.56 56.74 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 120.974 0.416 . . . . 0.0 110.844 -177.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.59 -24.12 72.4 Favored Glycine 0 CA--C 1.526 0.731 0 CA-C-O 118.999 -0.889 . . . . 0.0 113.911 -172.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.412 ' O ' ' HE3' ' A' ' 31' ' ' LYS . 81.0 p -63.36 -35.89 81.9 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 118.958 1.379 . . . . 0.0 111.217 -175.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -65.52 -44.54 86.65 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 178.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 48.7 mt -61.5 -40.59 86.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -63.68 -38.5 91.36 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 119.241 -0.409 . . . . 0.0 111.415 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.412 ' HE3' ' O ' ' A' ' 27' ' ' SER . 0.0 OUTLIER -64.28 -47.32 79.96 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 118.627 0.649 . . . . 0.0 109.85 175.194 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 92.8 mt -60.28 -56.82 16.89 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 122.395 -0.191 . . . . 0.0 110.973 -178.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 75.9 p -58.28 -48.06 81.65 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 t -63.27 -42.48 99.13 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.247 -0.581 . . . . 0.0 111.453 -175.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -75.56 -22.94 56.57 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.99 -55.6 13.77 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 119.043 0.838 . . . . 0.0 109.166 167.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 61.8 mt -69.78 -15.72 63.17 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.21 1.004 . . . . 0.0 113.05 -175.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -57.07 -29.49 63.49 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -178.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.5 t-160 -150.91 -24.65 0.22 Allowed 'General case' 0 N--CA 1.461 0.122 0 N-CA-C 113.994 1.109 . . . . 0.0 113.994 -176.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 40.3 mm 45.73 73.92 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-O 122.06 0.933 . . . . 0.0 111.351 -179.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -138.02 8.63 2.75 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.23 1.012 . . . . 0.0 109.83 178.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.493 HG21 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -142.72 109.61 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 125.142 1.377 . . . . 0.0 107.913 -178.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.433 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -104.92 -67.96 0.88 Allowed 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -177.342 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.422 ' H ' ' HG2' ' A' ' 43' ' ' GLU . 81.6 p -68.29 -23.16 64.71 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 122.98 0.512 . . . . 0.0 111.894 -173.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.571 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -73.36 -54.8 7.45 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.799 0.84 . . . . 0.0 109.299 178.377 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.459 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 8.6 mt -57.25 -45.79 84.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 C-N-CA 122.836 0.454 . . . . 0.0 110.143 175.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 14.6 mm -69.5 -47.98 69.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 CA-C-O 119.143 -0.456 . . . . 0.0 111.988 -177.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 95.5 p -63.02 -30.65 71.76 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-N 119.294 0.952 . . . . 0.0 110.227 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 46.4 tp -68.66 -45.72 71.0 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 119.15 -0.452 . . . . 0.0 111.772 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.5 pt -73.08 -36.77 51.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 119.192 0.905 . . . . 0.0 111.677 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 93.7 mt -62.03 -53.33 49.23 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.124 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -62.67 -31.47 72.37 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.517 179.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -61.14 -41.42 96.72 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.4 ' HB2' ' HG ' ' A' ' 65' ' ' SER . 26.1 t -69.36 -35.99 76.4 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.935 175.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 50.9 tpt85 -66.53 -41.82 88.15 Favored 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -174.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 71.7 mt -96.06 -14.51 22.86 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 113.952 1.093 . . . . 0.0 113.952 -172.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 82.0 m -101.61 162.48 20.31 Favored Pre-proline 0 CA--C 1.536 0.432 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -170.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_exo -55.68 177.49 0.13 Allowed 'Trans proline' 0 N--CA 1.461 -0.431 1 C-N-CA 125.637 4.225 . . . . 0.0 115.188 179.261 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -56.88 -46.2 82.03 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.28 1.032 . . . . 0.0 113.293 -175.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 73.1 m -60.87 -26.88 67.72 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 5.5 m80 -81.77 -23.74 36.43 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 119.243 -0.408 . . . . 0.0 110.803 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -73.82 -44.77 54.77 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.877 0.762 . . . . 0.0 109.23 175.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.99 -50.09 65.51 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 177.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.59 -41.85 93.8 Favored Glycine 0 C--N 1.337 0.619 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.4 ' HG ' ' HB2' ' A' ' 54' ' ' SER . 20.8 t -67.55 -37.76 83.16 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.713 0.756 . . . . 0.0 110.538 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 32.1 mt -59.79 -36.12 76.07 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 119.522 1.056 . . . . 0.0 110.756 175.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -73.08 -32.76 65.2 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 119.485 -0.886 . . . . 0.0 111.644 176.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 79.0 mt -67.04 -48.03 80.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 118.819 0.736 . . . . 0.0 109.915 175.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 72.1 mt -61.12 -35.9 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 C-N-CA 124.226 1.01 . . . . 0.0 109.431 178.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -66.91 -45.49 77.77 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 118.88 -0.581 . . . . 0.0 110.418 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.5 t -63.86 -54.52 33.63 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 118.794 0.724 . . . . 0.0 111.336 -178.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 55.5 mt -63.16 -33.77 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.22 -51.95 34.96 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-O 119.545 -0.586 . . . . 0.0 112.437 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.636 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -70.51 -31.83 69.08 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 118.056 0.928 . . . . 0.0 110.625 -178.525 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.71 -46.75 71.33 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -61.29 -46.95 88.21 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 176.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 66.4 tp -56.91 -45.63 82.53 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.587 0.355 . . . . 0.0 110.483 -177.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -66.61 -48.28 70.0 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.761 179.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.9 mm-40 -61.87 -27.77 69.03 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -175.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.2 t -97.79 -24.84 15.27 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 36.9 ptt180 . . . . . 0 N--CA 1.462 0.155 0 CA-C-N 119.346 0.976 . . . . 0.0 111.408 177.358 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.462 0.152 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.5 p -50.06 -31.54 13.33 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 -173.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.08 -47.52 82.54 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.872 0.76 . . . . 0.0 109.981 176.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -67.69 -31.29 71.15 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.3 0.572 . . . . 0.0 110.4 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.37 -45.93 82.16 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.366 -178.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.6 mt -64.72 -42.73 95.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 174.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -59.75 -32.81 70.91 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 122.546 -0.096 . . . . 0.0 111.034 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.9 m -76.39 -41.39 48.07 Favored 'General case' 0 C--O 1.227 -0.08 0 C-N-CA 122.421 0.288 . . . . 0.0 111.162 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 58.4 mt -61.79 -29.26 70.02 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-N 118.867 0.758 . . . . 0.0 109.166 174.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.99 -14.38 31.11 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-O 119.199 -0.779 . . . . 0.0 113.562 178.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -101.84 -3.81 27.36 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 118.806 1.303 . . . . 0.0 112.136 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.4 m -125.86 -17.97 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.1 tp -48.96 -30.5 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 C-N-CA 123.171 0.588 . . . . 0.0 112.458 -178.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -64.23 -45.42 88.26 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.24 0.473 . . . . 0.0 110.713 178.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -74.07 -38.95 63.78 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.282 0.633 . . . . 0.0 110.082 -178.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.0 mt -62.92 -53.04 60.2 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.24 -178.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 81.0 mt -63.82 -59.11 4.96 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.71 -0.662 . . . . 0.0 109.463 177.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 77.7 p -48.82 -45.53 40.63 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 119.008 0.822 . . . . 0.0 112.457 -174.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 89.5 m-20 -69.13 -44.76 71.72 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 118.852 0.751 . . . . 0.0 110.764 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.05 -44.88 94.39 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 118.306 0.503 . . . . 0.0 111.434 -177.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.73 -33.44 31.24 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.13 0 CA-C-N 118.661 0.664 . . . . 0.0 112.138 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.21 -26.94 65.97 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.572 176.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.75 -17.65 57.34 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 125.963 1.705 . . . . 0.0 110.842 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 37.6 m -83.48 155.89 23.15 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -172.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 -103.32 -175.94 2.94 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 169.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 22.2 tm0? -55.54 -41.2 72.87 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 119.398 0.999 . . . . 0.0 110.982 -178.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.81 -45.85 87.77 Favored 'General case' 0 C--O 1.233 0.206 0 O-C-N 121.583 -0.698 . . . . 0.0 110.891 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 46.6 m170 -73.29 -37.6 66.19 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 118.783 -0.627 . . . . 0.0 111.737 -176.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.72 -34.03 76.95 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 119.278 0.945 . . . . 0.0 109.0 176.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -66.04 -41.69 90.54 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -65.39 -42.63 92.42 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 176.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.4 -35.87 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 80.1 ttt-85 -67.77 -34.34 76.61 Favored 'General case' 0 N--CA 1.453 -0.316 0 O-C-N 122.31 -0.244 . . . . 0.0 110.708 177.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.2 ttt -66.1 -44.37 84.53 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 176.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 6.4 tt -56.29 -48.9 75.7 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 79.0 mt -73.03 -26.54 61.34 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -178.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 24.6 t70 . . . . . 0 N--CA 1.455 -0.179 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 175.979 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_endo . . . . . 0 N--CA 1.457 -0.675 0 N-CA-C 110.743 -0.522 . . . . 0.0 110.743 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 38.9 t -68.02 152.47 45.47 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 174.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 162' ' ' TYR . . . . . 0.464 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 17.8 t80 -143.81 132.13 22.03 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 29.2 t -127.59 144.36 50.77 Favored Pre-proline 0 N--CA 1.452 -0.365 0 C-N-CA 123.348 0.659 . . . . 0.0 110.619 177.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -65.54 -7.01 14.91 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 122.888 2.392 . . . . 0.0 111.564 175.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 80.6 p . . . . . 0 CA--C 1.531 0.249 0 C-N-CA 123.043 0.537 . . . . 0.0 111.975 179.193 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.447 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 16.4 t70 . . . . . 0 CA--C 1.533 0.299 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.447 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 18.1 t80 -55.54 -16.03 3.47 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.351 0.66 . . . . 0.0 111.636 179.205 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -56.04 -43.43 77.84 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.737 0.415 . . . . 0.0 111.018 177.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -63.4 -36.87 85.17 Favored 'General case' 0 C--O 1.227 -0.118 0 CA-C-N 118.321 0.509 . . . . 0.0 110.542 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -65.85 -54.44 26.77 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 117.812 0.278 . . . . 0.0 110.366 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 63.9 t -60.63 -53.73 44.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.03 -32.81 68.33 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 123.453 0.701 . . . . 0.0 112.162 -177.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 88.1 m -73.71 -40.88 63.27 Favored 'General case' 0 C--N 1.338 0.101 0 CA-C-N 118.557 0.617 . . . . 0.0 110.469 176.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.1 tp -66.7 -30.55 70.81 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.957 0.408 . . . . 0.0 110.061 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -72.65 -40.38 66.4 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.03 0.932 . . . . 0.0 109.691 176.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.0 t -62.12 -30.4 71.0 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 174.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.64 -41.53 68.7 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 122.917 0.487 . . . . 0.0 109.89 175.316 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt . . . . . 0 CA--C 1.529 0.164 0 C-N-CA 123.821 0.848 . . . . 0.0 111.269 178.577 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.8 mm . . . . . 0 CA--C 1.528 0.107 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.2 m -49.9 124.55 10.11 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.025 0.53 . . . . 0.0 111.951 -174.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.86 -19.41 63.19 Favored Glycine 0 CA--C 1.525 0.659 0 CA-C-O 119.584 -0.565 . . . . 0.0 112.301 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.428 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 42.0 t -66.31 -39.2 89.14 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.173 0.987 . . . . 0.0 110.169 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.6 mmp_? -60.09 -45.66 92.19 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 58.3 mt -65.65 -34.51 70.84 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.924 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.7 tmtt? -63.02 -43.75 97.85 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 122.084 -0.385 . . . . 0.0 110.466 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.4 OUTLIER -65.26 -43.73 90.38 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 118.152 0.433 . . . . 0.0 110.705 176.251 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.5 mt -62.17 -57.93 9.65 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 121.261 -0.176 . . . . 0.0 110.875 -178.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.436 HG21 ' HB2' ' A' ' 71' ' ' SER . 51.5 p -56.29 -48.98 75.55 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 178.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.3 t -63.44 -44.86 93.32 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 120.021 -0.672 . . . . 0.0 111.6 -174.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -76.78 -21.33 55.31 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.07 -56.66 9.09 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 167.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 46.9 mt -68.97 -17.51 63.94 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.524 1.13 . . . . 0.0 113.075 -175.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -59.9 -26.14 65.66 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -178.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -149.04 -28.46 0.28 Allowed 'General case' 0 C--N 1.34 0.154 0 N-CA-C 113.84 1.052 . . . . 0.0 113.84 -175.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 37.9 mm 44.87 74.76 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-O 121.923 0.868 . . . . 0.0 111.605 -179.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -147.98 22.41 1.1 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.354 1.062 . . . . 0.0 109.234 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.548 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -148.63 38.83 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.116 0 C-N-CA 124.765 1.226 . . . . 0.0 109.251 -171.176 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.563 ' CD ' ' H ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -52.95 -57.13 11.35 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -174.508 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.563 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 88.4 p -72.67 -26.35 61.6 Favored 'General case' 0 CA--C 1.521 -0.144 0 O-C-N 121.489 -0.757 . . . . 0.0 112.37 -173.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.643 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.18 -44.35 16.53 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 119.189 -0.434 . . . . 0.0 109.932 -179.074 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 38.0 mt -55.48 -50.85 63.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 171.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 15.9 mm -66.92 -51.81 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -176.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 73.8 m -57.68 -33.59 68.52 Favored 'General case' 0 N--CA 1.458 -0.058 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.324 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.1 tp -69.4 -45.41 69.3 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 118.582 -0.723 . . . . 0.0 112.083 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 38.1 pt -71.35 -34.42 53.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 119.63 1.105 . . . . 0.0 111.699 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 97.7 mt -63.05 -55.49 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -64.51 -27.12 68.75 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.308 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -62.78 -45.56 92.1 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 175.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.461 ' HB2' ' HG ' ' A' ' 65' ' ' SER . 27.7 t -61.2 -43.37 98.99 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.903 0.382 . . . . 0.0 110.154 175.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 14.7 tpp180 -59.31 -44.86 92.51 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.801 0.84 . . . . 0.0 112.698 -176.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 70.2 mt -89.66 -15.04 33.54 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 -173.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 72.5 m -100.5 165.28 14.67 Favored Pre-proline 0 CA--C 1.537 0.461 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -172.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.68 177.31 0.24 Allowed 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 125.298 3.998 . . . . 0.0 115.036 -178.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -58.78 -41.47 86.74 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.853 0.861 . . . . 0.0 111.875 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.9 m -60.09 -21.3 61.33 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 177.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -93.55 -20.13 20.54 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 118.848 -0.596 . . . . 0.0 111.141 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.8 mptt -64.49 -46.63 82.15 Favored 'General case' 0 C--N 1.342 0.239 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 167.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -65.15 -52.46 55.01 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.47 -42.51 93.91 Favored Glycine 0 C--N 1.338 0.641 0 N-CA-C 111.581 -0.608 . . . . 0.0 111.581 -179.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.461 ' HG ' ' HB2' ' A' ' 54' ' ' SER . 19.9 t -68.83 -34.81 76.11 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 117.735 0.767 . . . . 0.0 110.493 179.59 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.4 mt -62.57 -32.45 73.43 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 119.47 1.032 . . . . 0.0 110.818 174.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -73.81 -31.47 63.26 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.845 0.748 . . . . 0.0 111.417 175.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 80.7 mt -72.58 -40.43 62.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 118.622 0.646 . . . . 0.0 110.769 175.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.7 mt -66.63 -35.05 73.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -67.17 -45.47 76.89 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 119.023 -0.513 . . . . 0.0 110.82 176.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.436 ' HB2' HG21 ' A' ' 33' ' ' THR . 79.3 p -66.03 -57.14 8.42 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 118.534 0.606 . . . . 0.0 110.832 -176.275 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 59.3 mt -64.19 -32.07 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.76 -55.87 17.69 Favored Glycine 0 CA--C 1.527 0.796 0 CA-C-O 119.813 -0.437 . . . . 0.0 112.52 178.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.622 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -66.6 -30.8 71.17 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-N 117.964 0.882 . . . . 0.0 110.561 -178.929 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.03 -44.93 71.72 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 122.574 -0.078 . . . . 0.0 110.828 176.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -64.05 -48.24 77.02 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 177.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 57.5 tp -58.26 -47.52 83.33 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 122.834 0.454 . . . . 0.0 110.08 -176.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -64.12 -43.15 96.18 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.407 -0.183 . . . . 0.0 110.599 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -65.18 -34.58 78.71 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -175.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.5 t -94.6 -18.63 21.2 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -177.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? . . . . . 0 N--CA 1.464 0.229 0 CA-C-N 119.027 0.83 . . . . 0.0 112.802 178.231 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.226 -0.166 0 CA-C-O 119.718 -0.182 . . . . 0.0 110.868 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.6 p -47.37 -31.74 4.27 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -176.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.27 -45.61 87.34 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.807 0.73 . . . . 0.0 109.943 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 46.1 t60 -66.87 -29.62 69.57 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 123.482 0.713 . . . . 0.0 109.927 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.17 -43.82 77.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 123.045 0.538 . . . . 0.0 110.548 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.17 -43.58 98.91 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.069 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 174.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -59.53 -33.83 71.87 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.682 -0.236 . . . . 0.0 111.13 178.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.1 m -73.72 -42.05 61.72 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 122.302 -0.249 . . . . 0.0 111.218 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 48.7 mt -60.39 -30.21 69.44 Favored 'General case' 0 C--N 1.339 0.126 0 O-C-N 121.418 -0.802 . . . . 0.0 109.274 173.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.43 -14.91 22.15 Favored Glycine 0 CA--C 1.531 1.076 0 CA-C-O 119.112 -0.827 . . . . 0.0 113.918 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -100.82 -6.92 24.15 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.016 1.408 . . . . 0.0 112.074 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.1 m -123.42 -17.91 4.42 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -177.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.0 tp -55.22 -26.08 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 CA-C-N 118.246 0.476 . . . . 0.0 111.527 -177.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -61.54 -53.32 57.86 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.379 0.672 . . . . 0.0 111.65 176.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -75.55 -34.48 60.73 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 122.002 -0.436 . . . . 0.0 110.912 -178.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 88.9 mt -62.38 -46.94 86.37 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 55.9 mt -71.31 -53.95 12.49 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 118.532 -0.747 . . . . 0.0 111.19 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 69.2 p -55.06 -35.76 64.86 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 119.033 0.833 . . . . 0.0 111.118 -176.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -70.1 -48.62 56.87 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-N 118.798 0.726 . . . . 0.0 110.269 173.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.96 -34.39 65.64 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.984 0.914 . . . . 0.0 113.369 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -84.5 -38.08 13.27 Favored 'Isoleucine or valine' 0 C--N 1.343 0.288 0 C-N-CA 117.482 -1.687 . . . . 0.0 112.667 170.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.27 -22.42 66.94 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.881 0.764 . . . . 0.0 110.85 -178.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.04 -17.11 30.02 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.064 0.946 . . . . 0.0 110.995 178.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 53.1 p -85.41 167.57 15.4 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -172.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -102.5 177.17 4.94 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 168.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.3 -33.27 63.13 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 118.546 0.612 . . . . 0.0 112.32 -176.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -70.63 -49.93 42.36 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 122.03 -0.419 . . . . 0.0 111.312 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 6.2 m170 -67.56 -34.07 76.31 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-O 119.052 -0.499 . . . . 0.0 110.41 179.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.5 ttpt -55.67 -51.94 65.55 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 118.736 0.698 . . . . 0.0 109.204 171.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -58.94 -38.96 80.22 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 120.674 -0.411 . . . . 0.0 110.864 -176.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.8 mtpp -63.06 -41.59 99.5 Favored 'General case' 0 N--CA 1.455 -0.187 0 O-C-N 122.338 -0.226 . . . . 0.0 110.955 175.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 97.9 mt -67.65 -36.45 76.13 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 O-C-N 121.863 -0.523 . . . . 0.0 109.595 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -66.26 -32.58 74.08 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 176.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.4 ttt -65.67 -42.68 91.04 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 175.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 89.2 mt -58.99 -43.32 91.46 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.119 175.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.1 mt -65.62 -36.1 82.73 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 117.676 0.216 . . . . 0.0 111.315 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.0 t70 . . . . . 0 N--CA 1.454 -0.24 0 CA-C-N 118.05 0.386 . . . . 0.0 110.51 178.313 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo . . . . . 0 N--CA 1.451 -1.001 0 N-CA-C 110.119 -0.762 . . . . 0.0 110.119 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 36.5 t -69.12 156.83 38.02 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 176.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 162' ' ' TYR . . . . . 0.418 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 13.0 t80 -145.99 131.89 19.14 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.575 0.35 . . . . 0.0 110.988 -179.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 31.2 t -119.65 128.83 25.69 Favored Pre-proline 0 N--CA 1.452 -0.329 0 C-N-CA 122.95 0.5 . . . . 0.0 110.153 175.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.15 -16.25 48.41 Favored 'Trans proline' 0 N--CA 1.449 -1.091 0 C-N-CA 122.64 2.227 . . . . 0.0 109.696 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 2.1 m . . . . . 0 N--CA 1.453 -0.304 0 C-N-CA 123.972 0.909 . . . . 0.0 112.47 -175.367 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.418 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 15.2 t70 . . . . . 0 CA--C 1.536 0.429 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.418 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 14.9 t80 -55.18 -14.38 1.67 Allowed 'General case' 0 C--N 1.339 0.111 0 C-N-CA 123.483 0.713 . . . . 0.0 111.507 178.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -54.56 -42.88 71.5 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.264 0.626 . . . . 0.0 110.481 177.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 56.1 m-20 -55.91 -46.35 78.42 Favored 'General case' 0 C--O 1.227 -0.104 0 CA-C-N 118.285 0.493 . . . . 0.0 110.51 177.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -65.98 -50.03 65.74 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 117.777 0.262 . . . . 0.0 110.591 -176.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.8 t -63.72 -54.6 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 -178.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.89 -32.72 67.99 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.069 0.548 . . . . 0.0 111.897 -178.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 80.0 m -73.02 -41.46 64.21 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 118.312 0.505 . . . . 0.0 110.525 177.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.2 tp -66.12 -32.7 74.31 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.086 0.47 . . . . 0.0 110.097 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -68.58 -43.49 76.41 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.967 0.907 . . . . 0.0 109.616 175.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 65.4 m -64.39 -26.36 68.43 Favored 'General case' 0 C--O 1.227 -0.105 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 175.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.425 ' CE2' HD12 ' A' ' 68' ' ' ILE . 0.1 OUTLIER -71.81 -40.55 69.06 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 175.574 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 87.4 tttt . . . . . 0 N--CA 1.456 -0.157 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 176.123 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 19.7 mm . . . . . 0 CA--C 1.528 0.109 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.0 m -50.56 127.99 19.18 Favored 'General case' 0 CA--C 1.522 -0.099 0 C-N-CA 122.954 0.502 . . . . 0.0 111.641 -174.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.55 -20.11 67.59 Favored Glycine 0 CA--C 1.526 0.758 0 CA-C-O 119.098 -0.834 . . . . 0.0 112.546 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.427 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 40.3 t -66.05 -37.19 85.23 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 118.801 1.3 . . . . 0.0 110.059 -178.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.5 mmp_? -61.99 -49.0 77.83 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 176.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.6 mt -61.5 -38.53 80.33 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.883 -179.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -65.76 -38.96 90.51 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 118.954 -0.546 . . . . 0.0 111.291 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.427 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.1 OUTLIER -66.61 -41.38 88.51 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 119.279 0.945 . . . . 0.0 110.238 175.52 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.2 mt -62.0 -57.47 11.55 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 119.55 -0.262 . . . . 0.0 111.042 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.435 HG22 ' HB2' ' A' ' 71' ' ' SER . 66.6 p -56.85 -42.46 79.74 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 118.228 0.467 . . . . 0.0 111.707 177.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.7 m -55.44 -56.27 22.1 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 119.234 -0.413 . . . . 0.0 110.873 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -69.35 -32.72 71.97 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 118.524 -1.27 . . . . 0.0 111.815 -175.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.29 -58.4 8.78 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 174.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.7 mt -71.36 -15.81 62.4 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.711 0.804 . . . . 0.0 112.697 -174.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -61.09 -28.42 69.07 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 25.0 t60 -150.76 -24.37 0.22 Allowed 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -175.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 30.3 mm 46.65 74.67 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-O 121.645 0.736 . . . . 0.0 111.522 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -147.62 21.16 1.17 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.898 0.879 . . . . 0.0 109.918 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.552 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.01 37.76 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.087 0 C-N-CA 124.331 1.052 . . . . 0.0 109.365 -171.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.422 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -53.2 -54.19 39.67 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -174.676 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 81.0 p -75.22 -28.42 59.92 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -173.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.657 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -79.44 -45.41 19.5 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -179.247 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 24.4 mt -56.11 -51.76 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 172.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 11.7 mm -66.17 -50.83 65.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-O 119.02 -0.514 . . . . 0.0 112.124 -176.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 63.6 m -58.03 -33.55 69.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 119.198 0.908 . . . . 0.0 110.558 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 54.1 tp -70.06 -43.36 71.37 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 36.5 pt -73.24 -35.48 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-N 119.588 1.086 . . . . 0.0 111.927 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.02 -52.37 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 178.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -62.39 -30.53 71.27 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.286 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -61.37 -42.51 98.82 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 175.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.488 ' HB2' ' HG ' ' A' ' 65' ' ' SER . 32.1 t -68.39 -35.73 78.1 Favored 'General case' 0 C--N 1.338 0.098 0 O-C-N 122.097 -0.377 . . . . 0.0 110.701 175.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -64.82 -42.24 95.12 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.925 0.89 . . . . 0.0 113.056 -174.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 79.6 mt -91.24 -14.31 31.19 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -174.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 71.1 m -106.1 155.53 38.32 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -170.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.69 -174.95 0.79 Allowed 'Trans proline' 0 N--CA 1.459 -0.52 1 C-N-CA 125.788 4.325 . . . . 0.0 113.823 -179.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -53.77 -45.1 70.54 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 125.732 1.613 . . . . 0.0 114.738 -170.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 73.3 m -61.21 -27.33 68.36 Favored 'General case' 0 CA--C 1.523 -0.06 0 CA-C-N 118.484 0.584 . . . . 0.0 110.152 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 24.0 m170 -91.58 -16.99 26.29 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.263 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -66.09 -47.57 73.79 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 169.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 58.4 tp -66.86 -48.64 68.17 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.449 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.11 -46.45 92.67 Favored Glycine 0 C--N 1.338 0.643 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.488 ' HG ' ' HB2' ' A' ' 54' ' ' SER . 11.8 t -62.65 -45.22 93.85 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 117.495 0.647 . . . . 0.0 110.069 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 25.2 mt -54.22 -41.18 68.37 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 119.162 0.892 . . . . 0.0 110.774 176.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -68.31 -27.0 65.91 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.028 0.831 . . . . 0.0 111.263 178.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.425 HD12 ' CE2' ' A' ' 17' ' ' PHE . 72.0 mt -75.12 -44.4 43.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 CA-C-N 118.247 0.476 . . . . 0.0 111.23 174.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 1.6 mp -60.33 -34.69 58.49 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 175.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.444 ' CG ' HH22 ' A' ' 74' ' ' ARG . 38.3 t70 -71.53 -45.4 62.47 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.744 1.218 . . . . 0.0 111.584 -178.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.435 ' HB2' HG22 ' A' ' 33' ' ' THR . 65.8 p -67.29 -56.04 11.42 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 119.009 0.822 . . . . 0.0 110.478 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 49.2 mt -63.37 -32.27 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.6 -55.68 21.44 Favored Glycine 0 CA--C 1.525 0.677 0 CA-C-O 119.65 -0.528 . . . . 0.0 112.02 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.444 HH22 ' CG ' ' A' ' 70' ' ' ASP . 5.1 ptp85 -67.14 -32.85 74.24 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 118.086 0.943 . . . . 0.0 110.658 -178.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.87 -44.7 69.26 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 121.514 -0.074 . . . . 0.0 110.803 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.2 m-30 -62.45 -47.93 81.86 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 176.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -59.17 -47.76 84.12 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 123.344 0.402 . . . . 0.0 110.144 -176.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -62.27 -47.74 83.01 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 120.515 0.198 . . . . 0.0 110.651 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -66.11 -38.04 87.23 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 121.039 -0.264 . . . . 0.0 111.591 -175.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 6.2 t -82.61 -19.42 38.41 Favored 'General case' 0 C--O 1.226 -0.138 0 CA-C-N 118.108 0.413 . . . . 0.0 111.592 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 79.8 ttt-85 . . . . . 0 C--N 1.339 0.133 0 CA-C-N 117.978 0.354 . . . . 0.0 111.351 174.763 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.307 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.6 p -52.52 -28.88 22.44 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.162 0.985 . . . . 0.0 113.546 -176.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.11 -46.17 88.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.819 0.736 . . . . 0.0 109.758 176.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 9.4 m170 -73.38 -24.28 60.29 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.506 178.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.67 -46.45 85.5 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 175.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.1 mt -64.46 -44.24 96.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.171 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 176.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -58.17 -36.39 72.98 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 122.516 -0.115 . . . . 0.0 111.042 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.3 m -74.04 -41.03 62.41 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-O 119.626 -0.226 . . . . 0.0 111.482 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.4 mt -60.36 -30.21 69.41 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.824 0.738 . . . . 0.0 109.348 174.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.0 -15.44 21.13 Favored Glycine 0 CA--C 1.528 0.861 0 CA-C-O 119.222 -0.765 . . . . 0.0 113.967 179.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -101.3 -6.02 24.68 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.01 1.405 . . . . 0.0 112.28 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 35.0 m -123.02 -16.72 5.14 Favored 'Isoleucine or valine' 0 C--N 1.339 0.135 0 C-N-CA 122.941 0.496 . . . . 0.0 112.005 -178.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -52.2 -26.34 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 122.884 0.474 . . . . 0.0 111.58 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.2 pt20 -63.89 -48.03 78.25 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.037 0.535 . . . . 0.0 111.57 178.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -79.39 -31.39 42.78 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 118.107 0.412 . . . . 0.0 110.721 -178.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.0 mp -61.67 -53.3 57.93 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 85.5 mt -66.07 -56.72 10.13 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 118.621 -0.704 . . . . 0.0 110.389 178.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 80.9 p -54.02 -40.57 67.15 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 119.238 0.926 . . . . 0.0 112.229 -174.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -71.04 -47.04 60.82 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 119.465 1.029 . . . . 0.0 110.357 176.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.22 -37.92 72.95 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 118.949 -0.548 . . . . 0.0 111.904 -177.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -82.92 -33.93 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 119.058 0.845 . . . . 0.0 111.925 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.84 -28.22 67.37 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 119.789 -0.764 . . . . 0.0 111.028 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.21 -14.76 45.82 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.466 0.707 . . . . 0.0 111.053 177.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 32.4 p -74.39 159.57 32.16 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 -171.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.1 t-20 -96.25 174.39 6.91 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 169.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -55.42 -43.58 75.45 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.231 0.923 . . . . 0.0 111.507 -176.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -66.01 -40.78 91.38 Favored 'General case' 0 CA--C 1.527 0.093 0 O-C-N 121.856 -0.528 . . . . 0.0 110.529 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -69.94 -38.77 76.28 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.376 -0.345 . . . . 0.0 110.996 -178.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -39.3 90.14 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 174.295 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -66.06 -38.35 88.1 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.563 -178.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -64.33 -42.79 96.11 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 121.071 -0.251 . . . . 0.0 111.013 175.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.7 mt -67.17 -34.81 71.8 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -66.54 -36.06 81.76 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 122.75 0.42 . . . . 0.0 110.454 176.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.3 ttt -65.56 -42.13 92.16 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 109.668 -0.494 . . . . 0.0 109.668 176.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.2 tt -58.05 -49.9 75.28 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 176.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.79 -30.29 69.69 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 122.264 -0.273 . . . . 0.0 111.715 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 36.7 t70 . . . . . 0 N--CA 1.454 -0.245 0 CA-C-N 118.144 0.429 . . . . 0.0 110.058 177.63 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 160' ' ' PRO . . . . . 0.404 ' HD2' ' N ' ' A' ' 27' ' ' SER . 85.3 Cg_endo . . . . . 0 N--CA 1.456 -0.68 0 N-CA-C 109.509 -0.997 . . . . 0.0 109.509 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 67.9 p -72.83 157.29 37.77 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.675 0.274 . . . . 0.0 111.12 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 162' ' ' TYR . . . . . 0.411 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 4.2 t80 -144.25 129.62 18.87 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 123.338 0.655 . . . . 0.0 109.771 178.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 28.8 t -125.65 138.16 31.37 Favored Pre-proline 0 N--CA 1.454 -0.246 0 C-N-CA 123.144 0.577 . . . . 0.0 111.512 -177.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -67.83 -1.59 7.11 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 123.556 2.837 . . . . 0.0 111.44 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 57.2 p . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 118.673 -0.68 . . . . 0.0 112.145 -179.642 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.464 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 27.2 t70 . . . . . 0 CA--C 1.533 0.323 0 N-CA-C 109.182 -0.674 . . . . 0.0 109.182 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.464 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 19.9 t80 -55.79 -14.44 2.34 Favored 'General case' 0 CA--C 1.532 0.28 0 O-C-N 121.721 -0.612 . . . . 0.0 111.484 178.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.8 tp60 -54.25 -40.23 67.57 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.678 0.791 . . . . 0.0 110.877 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -63.42 -39.48 94.6 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 118.779 0.718 . . . . 0.0 110.703 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.1 t80 -64.6 -54.3 34.18 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 118.464 0.575 . . . . 0.0 109.795 179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.6 t -59.57 -55.67 22.32 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.145 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 -178.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.1 -33.17 67.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.507 0.723 . . . . 0.0 112.197 -178.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 60.2 m -70.73 -44.97 65.74 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.705 0.684 . . . . 0.0 110.33 176.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.7 tp -65.36 -33.72 76.63 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.235 0.54 . . . . 0.0 110.071 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -66.34 -46.87 75.31 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.49 0.716 . . . . 0.0 109.757 177.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 61.6 m -63.86 -26.52 68.65 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -69.54 -45.7 68.17 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 177.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 15.7 pttm . . . . . 0 CA--C 1.529 0.167 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -177.594 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.5 mm . . . . . 0 CA--C 1.533 0.317 0 CA-C-O 120.842 0.353 . . . . 0.0 110.408 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.4 t -57.12 136.21 56.38 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.963 0.411 . . . . 0.0 111.146 -177.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -71.95 -22.18 78.84 Favored Glycine 0 CA--C 1.524 0.643 0 CA-C-O 119.072 -0.849 . . . . 0.0 114.601 -170.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 79.7 p -64.39 -38.7 91.96 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 119.384 1.592 . . . . 0.0 111.635 -174.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.6 mpt_? -65.69 -40.74 92.66 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 42.4 mt -64.89 -36.07 76.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 178.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.3 mmtt -65.35 -39.87 92.89 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.606 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.36 -48.57 77.39 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 118.746 0.703 . . . . 0.0 110.382 174.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.1 mt -59.66 -59.16 5.88 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 122.293 -0.255 . . . . 0.0 110.872 -178.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.408 HG22 ' HG ' ' A' ' 71' ' ' SER . 59.4 p -55.67 -47.62 76.4 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.8 t -63.9 -43.04 97.2 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.528 -176.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -74.56 -22.78 58.81 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.695 0.68 . . . . 0.0 112.811 -178.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.5 -56.46 9.45 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.895 0.77 . . . . 0.0 109.545 167.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 65.6 mt -69.88 -14.89 62.95 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.931 0.892 . . . . 0.0 113.076 -175.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -55.81 -30.59 61.61 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -178.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.9 t-80 -151.9 -23.61 0.19 Allowed 'General case' 0 C--N 1.34 0.174 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -176.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 41.1 mm 46.18 73.51 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 121.941 0.877 . . . . 0.0 111.446 -178.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -136.63 9.33 3.11 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.272 1.029 . . . . 0.0 109.207 177.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.512 HG23 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -142.97 111.77 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 C-N-CA 125.125 1.37 . . . . 0.0 107.692 -177.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.421 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -108.13 -64.05 1.26 Allowed 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.686 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 74.0 p -68.75 -24.15 64.41 Favored 'General case' 0 CA--C 1.521 -0.15 0 C-N-CA 123.096 0.558 . . . . 0.0 111.909 -173.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.576 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -74.82 -53.72 8.61 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.995 0.918 . . . . 0.0 109.143 179.715 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.449 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 10.1 mt -57.22 -47.08 84.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 C-N-CA 123.129 0.572 . . . . 0.0 110.165 175.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.407 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 12.7 mm -69.47 -46.95 74.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-O 119.067 -0.492 . . . . 0.0 111.652 -176.688 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.0 m -61.31 -33.4 73.52 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 119.318 -0.953 . . . . 0.0 109.891 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.6 tp -68.07 -44.97 75.1 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 119.183 -0.437 . . . . 0.0 112.037 -178.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.5 pt -73.51 -35.69 45.86 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-N 119.207 0.912 . . . . 0.0 111.871 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.0 mt -64.29 -49.34 81.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -58.32 -40.8 83.01 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.777 177.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -57.68 -42.46 83.65 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 175.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.0 t -65.41 -47.05 77.61 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -75.48 -24.74 56.96 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -174.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 53.6 mt -81.53 -15.44 54.85 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 178.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 74.4 m -120.78 153.77 57.12 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -171.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -74.23 -169.54 0.6 Allowed 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 125.178 3.919 . . . . 0.0 114.26 -175.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -35.02 -59.99 0.48 Allowed 'General case' 0 C--O 1.236 0.345 0 C-N-CA 128.258 2.623 . . . . 0.0 115.787 -172.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.8 p -59.79 -26.29 65.61 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 122.309 -0.245 . . . . 0.0 110.987 -175.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 52.5 m-70 -89.6 -18.87 25.73 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 119.625 -0.226 . . . . 0.0 110.946 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -66.04 -49.1 68.9 Favored 'General case' 0 C--N 1.343 0.322 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 171.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.5 mt -67.27 -44.6 78.91 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.502 178.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.71 -50.88 61.67 Favored Glycine 0 C--N 1.335 0.504 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 9.9 t -65.75 -36.88 84.83 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 118.749 -0.644 . . . . 0.0 110.963 -178.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 36.2 mt -60.99 -39.11 88.38 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 119.655 1.116 . . . . 0.0 111.635 176.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -72.21 -31.67 66.07 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.349 0.977 . . . . 0.0 111.094 177.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 64.3 mt -71.91 -47.63 54.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 O-C-N 121.895 -0.503 . . . . 0.0 110.529 177.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.4 mt -59.84 -37.19 70.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.179 0 C-N-CA 124.258 1.023 . . . . 0.0 109.213 176.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -66.19 -47.48 73.79 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 118.987 -0.53 . . . . 0.0 110.868 178.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.408 ' HG ' HG22 ' A' ' 33' ' ' THR . 7.8 t -64.52 -53.73 43.4 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 118.615 0.643 . . . . 0.0 111.129 -176.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 57.2 mt -63.27 -34.2 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 179.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.06 -51.35 39.78 Favored Glycine 0 CA--C 1.526 0.734 0 CA-C-O 119.823 -0.432 . . . . 0.0 112.492 -178.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.622 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -71.17 -31.46 67.68 Favored 'General case' 0 C--N 1.338 0.085 0 CA-C-N 117.996 0.898 . . . . 0.0 111.008 -178.894 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.87 -43.84 74.51 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 176.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.0 m-30 -62.38 -45.89 91.12 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 175.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.11 -46.57 87.99 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 123.358 0.411 . . . . 0.0 110.287 -176.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -64.18 -45.17 89.56 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.598 0.237 . . . . 0.0 110.565 178.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -62.75 -39.51 94.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -175.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.6 t -84.33 -28.08 27.31 Favored 'General case' 0 C--O 1.232 0.148 0 O-C-N 122.093 -0.38 . . . . 0.0 111.8 -177.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 . . . . . 0 C--N 1.341 0.238 0 CA-C-N 118.412 0.551 . . . . 0.0 111.523 175.64 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.533 0.289 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.0 p -50.22 -32.85 17.63 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.475 1.51 . . . . 0.0 114.813 -172.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.54 -47.0 87.54 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.225 0.921 . . . . 0.0 109.799 177.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 55.3 m-70 -78.15 -17.37 56.93 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.235 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.407 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -66.75 -44.67 80.87 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 173.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.6 mt -63.61 -44.35 98.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -57.78 -35.28 70.58 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.981 -0.099 . . . . 0.0 111.154 178.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.9 m -74.39 -41.77 60.39 Favored 'General case' 0 C--N 1.339 0.15 0 O-C-N 122.291 -0.256 . . . . 0.0 111.309 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 52.1 mt -60.28 -30.15 69.28 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 174.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.44 -14.63 28.31 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-O 119.08 -0.844 . . . . 0.0 113.641 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -100.81 -4.76 27.32 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.95 1.375 . . . . 0.0 112.075 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 34.5 m -124.48 -21.8 2.68 Favored 'Isoleucine or valine' 0 C--N 1.338 0.086 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -178.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.0 tp -52.83 -26.67 11.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 123.277 0.631 . . . . 0.0 112.294 -175.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.2 pt20 -62.85 -45.2 93.7 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 122.942 0.497 . . . . 0.0 111.255 177.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -74.01 -39.2 63.77 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.091 0.472 . . . . 0.0 110.132 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 68.8 mt -62.05 -50.49 71.77 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.459 -177.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 66.2 mt -65.63 -56.79 10.32 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.286 176.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 87.5 p -50.66 -41.65 55.65 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 119.181 0.9 . . . . 0.0 111.893 -174.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -70.74 -50.79 32.36 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 118.791 0.723 . . . . 0.0 111.148 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.463 ' O ' ' HE3' ' A' ' 115' ' ' LYS . . . -56.24 -32.4 64.42 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.599 0.76 . . . . 0.0 112.855 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -84.85 -38.35 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 CA-C-N 119.673 1.124 . . . . 0.0 111.788 174.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.25 -26.44 65.68 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 121.956 -0.465 . . . . 0.0 111.186 -179.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.463 ' HE3' ' O ' ' A' ' 112' ' ' ALA . 0.2 OUTLIER -80.73 -21.01 41.54 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.13 0.572 . . . . 0.0 110.075 177.414 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.412 ' HG ' ' HE3' ' A' ' 115' ' ' LYS . 11.3 m -80.93 169.86 17.0 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 122.063 0.935 . . . . 0.0 113.494 -173.307 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -105.78 -176.89 3.21 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 114.124 -1.398 . . . . 0.0 107.262 169.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . 0.428 ' O ' ' HE2' ' A' ' 121' ' ' LYS . 50.4 mm-40 -55.97 -35.91 67.25 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.789 -0.569 . . . . 0.0 112.031 -177.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -71.36 -49.6 40.61 Favored 'General case' 0 N--CA 1.456 -0.173 0 O-C-N 121.932 -0.48 . . . . 0.0 111.475 -177.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 49.4 m-70 -69.39 -34.6 74.75 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 122.191 -0.318 . . . . 0.0 110.679 -179.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' A' ' 118' ' ' GLN . 4.7 ttpt -56.67 -48.35 77.8 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 108.301 -0.999 . . . . 0.0 108.301 171.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -59.56 -39.73 85.0 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.919 -176.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -60.72 -44.37 96.69 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.28 175.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.8 mt -68.35 -34.26 64.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-O 120.757 0.313 . . . . 0.0 110.164 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 69.6 ttt-85 -69.66 -35.33 75.08 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.077 0.551 . . . . 0.0 109.908 178.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 62.8 ttp -68.37 -38.8 81.73 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 176.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.6 tt -58.95 -45.75 89.7 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 81.6 mt -66.31 -34.27 77.61 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 177.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.9 t70 . . . . . 0 CA--C 1.536 0.411 0 CA-C-N 118.205 0.457 . . . . 0.0 110.446 178.4 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo . . . . . 0 N--CA 1.458 -0.579 0 N-CA-C 110.494 -0.618 . . . . 0.0 110.494 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 50.1 m -63.74 147.32 51.99 Favored 'General case' 0 C--O 1.231 0.096 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 175.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 162' ' ' TYR . . . . . 0.464 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 17.2 t80 -145.93 131.12 18.42 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 178.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 29.4 t -135.44 135.45 22.37 Favored Pre-proline 0 C--O 1.234 0.265 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.878 176.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -56.58 -17.34 21.89 Favored 'Trans proline' 0 N--CA 1.451 -1.009 0 C-N-CA 123.23 2.62 . . . . 0.0 112.443 175.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 73.3 p . . . . . 0 C--N 1.341 0.227 0 N-CA-C 113.196 0.814 . . . . 0.0 113.196 -174.043 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.478 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 17.3 t70 . . . . . 0 CA--C 1.535 0.367 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.478 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 13.3 t80 -55.62 -14.82 2.36 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.335 0.654 . . . . 0.0 111.036 178.288 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -55.33 -34.56 64.31 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.505 1.122 . . . . 0.0 111.304 176.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 40.8 m-20 -66.38 -44.2 83.79 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 119.2 0.909 . . . . 0.0 109.927 178.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -64.44 -50.23 68.38 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 -178.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 88.1 t -62.53 -57.71 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 -179.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.42 -32.32 64.75 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -177.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 78.9 m -72.43 -44.03 62.99 Favored 'General case' 0 C--N 1.338 0.079 0 O-C-N 121.798 -0.564 . . . . 0.0 110.78 176.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.0 tp -65.62 -31.59 72.71 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -69.73 -43.1 73.01 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 124.001 0.921 . . . . 0.0 109.546 176.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.8 t -60.07 -31.47 70.04 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -36.91 68.63 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.231 0.212 . . . . 0.0 110.592 175.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt . . . . . 0 C--N 1.339 0.134 0 C-N-CA 123.808 0.843 . . . . 0.0 111.18 179.186 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 17.4 mm . . . . . 0 CA--C 1.528 0.12 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.4 m -54.21 123.38 12.62 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-O 121.063 0.459 . . . . 0.0 111.481 -175.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -69.77 -14.98 70.82 Favored Glycine 0 CA--C 1.525 0.675 0 CA-C-O 119.13 -0.817 . . . . 0.0 113.288 -177.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.404 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 43.1 t -64.02 -43.63 95.04 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 118.914 1.357 . . . . 0.0 109.816 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 83.6 mtt85 -65.32 -41.42 94.01 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 53.1 mt -59.01 -41.46 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.103 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 176.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.3 tmtt? -60.79 -44.72 96.45 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.772 0.429 . . . . 0.0 111.256 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.404 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.3 OUTLIER -63.66 -40.99 98.23 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 118.72 0.691 . . . . 0.0 110.925 177.909 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 92.2 mt -63.66 -53.4 51.93 Favored 'General case' 0 C--O 1.233 0.202 0 O-C-N 122.534 -0.104 . . . . 0.0 110.782 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 48.4 p -60.94 -39.65 90.27 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.1 m -55.5 -57.7 10.8 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 122.876 0.47 . . . . 0.0 110.572 178.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -67.95 -35.09 77.81 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 118.908 -1.117 . . . . 0.0 111.942 -175.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.95 -58.3 9.27 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.422 0.556 . . . . 0.0 110.336 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 53.0 mt -72.21 -15.74 61.94 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.847 0.859 . . . . 0.0 112.913 -174.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -61.94 -24.69 67.14 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -150.85 -26.69 0.22 Allowed 'General case' 0 C--N 1.338 0.102 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -175.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 34.9 mm 44.97 73.59 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-O 121.768 0.794 . . . . 0.0 111.283 -178.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -137.53 9.26 2.89 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.114 0.966 . . . . 0.0 110.137 178.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.503 HG23 ' HE2' ' A' ' 45' ' ' LYS . 1.5 pt -143.64 119.62 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 C-N-CA 125.205 1.402 . . . . 0.0 107.837 -178.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.92 -66.89 1.04 Allowed 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -179.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 79.4 p -67.84 -23.19 65.13 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 122.851 0.46 . . . . 0.0 111.774 -173.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.578 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -75.46 -52.63 10.25 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.263 1.025 . . . . 0.0 109.399 179.475 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.461 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 7.4 mt -59.72 -44.33 93.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 C-N-CA 123.02 0.528 . . . . 0.0 110.352 176.207 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 12.3 mm -71.33 -47.63 58.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 O-C-N 122.258 -0.276 . . . . 0.0 111.681 -177.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.3 t -57.68 -35.02 70.03 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 176.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.4 tp -68.26 -45.67 72.51 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 118.442 -0.789 . . . . 0.0 112.184 -179.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 26.3 pt -73.01 -35.77 49.39 Favored 'Isoleucine or valine' 0 C--N 1.342 0.258 0 CA-C-N 120.03 1.286 . . . . 0.0 112.149 -179.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 95.8 mt -66.15 -50.73 66.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-O 121.431 0.634 . . . . 0.0 109.336 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -60.77 -40.38 92.3 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.317 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -55.67 -43.08 76.0 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 175.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.1 p -62.49 -51.5 67.2 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 119.442 -0.314 . . . . 0.0 110.96 -177.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.42 -20.45 66.37 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 118.585 0.63 . . . . 0.0 112.314 -177.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 69.8 mt -79.27 -14.74 58.84 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 173.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 59.6 m -95.17 163.49 21.67 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -173.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -74.04 -137.81 0.02 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.62 1 C-N-CA 125.606 4.204 . . . . 0.0 109.25 170.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -55.54 -26.89 45.75 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 119.361 0.982 . . . . 0.0 111.966 178.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 25.5 m -58.51 -21.27 51.48 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.962 0.505 . . . . 0.0 110.564 175.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -55.21 -72.36 0.07 Allowed 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 174.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -59.11 -60.37 3.97 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -175.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 35.1 tp -73.58 -47.47 40.26 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 119.619 -0.832 . . . . 0.0 112.203 -170.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.55 -41.78 93.91 Favored Glycine 0 C--N 1.335 0.479 0 N-CA-C 110.586 -1.005 . . . . 0.0 110.586 -175.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.4 t -68.2 -44.03 76.75 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 117.76 0.78 . . . . 0.0 110.4 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 49.6 mt -55.48 -42.04 73.83 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 119.704 -0.799 . . . . 0.0 111.178 178.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -71.12 -40.93 71.13 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.327 0.967 . . . . 0.0 112.372 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 89.1 mt -65.56 -45.9 91.19 Favored 'Isoleucine or valine' 0 C--N 1.341 0.228 0 CA-C-N 118.868 0.758 . . . . 0.0 109.847 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.0 mt -59.64 -36.63 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 C-N-CA 123.368 0.667 . . . . 0.0 109.432 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -66.44 -46.52 76.2 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 119.144 -0.455 . . . . 0.0 111.019 -179.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.6 m -67.63 -51.23 52.61 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 118.955 0.798 . . . . 0.0 111.443 -178.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 39.4 mt -66.94 -39.1 82.73 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 C-N-CA 120.56 -0.456 . . . . 0.0 109.999 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.48 -39.73 86.92 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 111.926 -0.47 . . . . 0.0 111.926 -179.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 42.9 ttm-85 -67.75 -42.25 82.1 Favored 'General case' 0 CA--C 1.523 -0.08 0 CA-C-N 117.52 0.66 . . . . 0.0 110.016 178.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.86 -41.47 82.84 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.324 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -63.7 -45.54 89.55 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 175.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 55.8 tp -59.38 -43.64 92.87 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 123.205 0.316 . . . . 0.0 110.184 -177.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -64.26 -46.63 82.89 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 120.776 0.322 . . . . 0.0 110.25 176.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -58.4 -41.84 85.83 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.543 -176.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 15.0 t -87.34 -20.48 26.7 Favored 'General case' 0 CA--C 1.528 0.101 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 51.2 tpt85 . . . . . 0 C--O 1.232 0.155 0 CA-C-N 118.503 0.592 . . . . 0.0 110.131 175.634 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.531 0.22 0 N-CA-C 114.36 1.244 . . . . 0.0 114.36 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.5 p -50.65 -31.73 17.03 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.585 1.154 . . . . 0.0 114.114 -173.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.52 -45.36 90.97 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 118.752 0.706 . . . . 0.0 110.006 177.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -68.18 -32.32 72.48 Favored 'General case' 0 CA--C 1.52 -0.204 0 C-N-CA 122.904 0.482 . . . . 0.0 110.215 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.79 -43.99 91.42 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.395 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.71 -42.08 91.81 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 175.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -59.15 -35.0 72.74 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 122.493 -0.129 . . . . 0.0 110.961 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 62.2 m -76.81 -43.05 38.11 Favored 'General case' 0 CA--C 1.524 -0.049 0 CA-C-O 119.689 -0.196 . . . . 0.0 111.413 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.1 mt -60.96 -27.78 68.51 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.553 -0.717 . . . . 0.0 109.137 174.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.1 -15.35 36.2 Favored Glycine 0 CA--C 1.528 0.889 0 CA-C-O 119.228 -0.762 . . . . 0.0 113.458 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -97.82 -5.33 34.97 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.664 1.232 . . . . 0.0 111.652 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.9 m -123.45 -26.81 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.338 0.102 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.5 tp -55.78 -27.46 22.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 CA-C-N 118.123 0.42 . . . . 0.0 111.588 -178.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -60.84 -47.5 86.05 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.262 0.625 . . . . 0.0 110.606 178.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -75.19 -38.71 60.7 Favored 'General case' 0 CA--C 1.522 -0.116 0 C-N-CA 123.022 0.529 . . . . 0.0 110.502 -179.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 89.0 mt -59.41 -49.67 76.9 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.409 -178.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 58.6 mt -67.73 -51.87 44.17 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-O 118.458 -0.782 . . . . 0.0 110.462 177.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 91.2 p -53.52 -49.05 68.4 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 119.227 -0.989 . . . . 0.0 111.313 -176.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -69.65 -35.11 74.88 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 121.882 -0.511 . . . . 0.0 111.467 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.87 -48.26 81.3 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 118.225 0.466 . . . . 0.0 111.17 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.88 -33.21 29.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.743 -177.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.03 -27.56 65.77 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 119.522 -0.871 . . . . 0.0 110.646 178.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 4.5 ttpt -80.69 -23.81 39.3 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.205 1.002 . . . . 0.0 110.583 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.9 m -78.04 158.72 29.11 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -170.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -100.12 -179.87 4.27 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 170.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -36.59 68.08 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.547 1.067 . . . . 0.0 112.858 -175.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -69.66 -42.78 73.74 Favored 'General case' 0 N--CA 1.456 -0.166 0 O-C-N 121.618 -0.676 . . . . 0.0 110.698 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 60.6 m80 -73.57 -37.67 65.45 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 119.573 -0.251 . . . . 0.0 111.136 -177.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.422 ' HD2' ' C ' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -64.92 -37.2 86.84 Favored 'General case' 0 C--N 1.34 0.184 0 N-CA-C 108.469 -0.938 . . . . 0.0 108.469 176.321 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -62.3 -43.62 98.4 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 178.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -62.35 -38.92 91.38 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 122.119 -0.363 . . . . 0.0 111.424 176.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.6 -43.32 80.46 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 118.526 0.603 . . . . 0.0 111.13 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -70.68 -26.18 63.32 Favored 'General case' 0 C--O 1.225 -0.236 0 O-C-N 121.329 -0.857 . . . . 0.0 110.645 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.1 ttt -68.58 -41.04 80.23 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 174.108 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 33.2 tp -57.19 -49.3 76.42 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.121 0.568 . . . . 0.0 109.609 176.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 85.7 mt -72.92 -31.89 64.94 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -178.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 32.2 t70 . . . . . 0 N--CA 1.452 -0.327 0 CA-C-N 118.274 0.488 . . . . 0.0 109.813 177.743 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo . . . . . 0 N--CA 1.456 -0.734 0 N-CA-C 110.646 -0.559 . . . . 0.0 110.646 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 32.5 t -81.89 164.0 21.86 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 122.521 0.328 . . . . 0.0 110.519 176.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -131.5 127.18 36.76 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.841 0.456 . . . . 0.0 110.713 177.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 21.8 t -104.07 131.14 22.22 Favored Pre-proline 0 N--CA 1.453 -0.295 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 174.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -57.48 -10.45 6.8 Favored 'Trans proline' 0 N--CA 1.448 -1.183 0 C-N-CA 122.854 2.369 . . . . 0.0 112.943 176.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 52.4 p . . . . . 0 C--N 1.34 0.154 0 CA-C-N 118.865 0.757 . . . . 0.0 112.21 -177.302 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 . . . . . 0 CA--C 1.532 0.28 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -54.79 -14.35 1.37 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.525 0.73 . . . . 0.0 111.053 177.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -53.63 -34.6 59.12 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.367 0.667 . . . . 0.0 110.506 175.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 34.4 m-20 -64.47 -48.5 75.01 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 118.962 0.801 . . . . 0.0 110.16 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -63.1 -49.06 75.93 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 110.466 -0.198 . . . . 0.0 110.466 -177.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 86.2 t -63.45 -57.75 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.22 -29.54 67.58 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 119.395 -0.336 . . . . 0.0 111.802 -177.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 61.9 m -71.53 -46.04 60.69 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.35 0.523 . . . . 0.0 110.48 176.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.5 tp -65.89 -33.84 76.76 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.077 0.465 . . . . 0.0 110.167 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -68.42 -43.27 77.53 Favored 'General case' 0 CA--C 1.522 -0.108 0 C-N-CA 123.93 0.892 . . . . 0.0 109.648 178.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.6 t -62.88 -31.75 72.86 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 174.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.83 -32.86 70.04 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 177.214 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt . . . . . 0 C--O 1.23 0.06 0 C-N-CA 123.019 0.528 . . . . 0.0 111.655 176.675 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 21.3 mm . . . . . 0 CA--C 1.53 0.206 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.7 t -64.24 124.52 21.92 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 120.882 0.372 . . . . 0.0 110.139 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.401 ' C ' ' HD2' ' B' ' 160' ' ' PRO . . . -68.79 -25.79 74.96 Favored Glycine 0 CA--C 1.524 0.604 0 CA-C-O 119.603 -0.554 . . . . 0.0 112.534 -176.132 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 83.1 p -64.22 -33.96 77.0 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 118.549 1.174 . . . . 0.0 111.079 -175.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -69.98 -39.19 76.09 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 54.7 mt -63.98 -38.08 81.47 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.07 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 176.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -60.8 -45.24 95.17 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 118.92 -0.562 . . . . 0.0 110.654 176.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.95 -40.34 97.38 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 119.256 0.934 . . . . 0.0 111.396 178.05 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 99.4 mt -64.52 -58.56 6.05 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 119.709 -0.186 . . . . 0.0 111.044 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.424 HG23 ' HB2' ' A' ' 71' ' ' SER . 44.2 p -54.18 -41.36 68.47 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-N 118.0 0.363 . . . . 0.0 111.693 175.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.0 m -55.53 -60.18 3.79 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 119.227 -0.416 . . . . 0.0 111.104 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -67.15 -32.69 73.98 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 119.134 -1.026 . . . . 0.0 111.711 -174.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.425 ' HB3' ' HH ' ' A' ' 76' ' ' TYR . . . -59.38 -58.14 9.91 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 122.029 -0.42 . . . . 0.0 110.109 174.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.0 mt -70.45 -17.02 62.99 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.637 0.775 . . . . 0.0 112.47 -175.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -66.9 -21.76 65.98 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -178.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.4 t60 -148.17 -30.03 0.3 Allowed 'General case' 0 C--N 1.34 0.169 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -175.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 33.4 mm 43.86 73.95 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 121.583 0.706 . . . . 0.0 111.436 -178.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -149.49 21.12 0.93 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.705 0.802 . . . . 0.0 109.754 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.585 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.24 36.85 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 C-N-CA 124.539 1.135 . . . . 0.0 109.183 -172.109 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.449 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -50.95 -56.12 13.92 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -175.899 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 79.2 p -75.29 -25.78 58.22 Favored 'General case' 0 CA--C 1.522 -0.129 0 N-CA-C 112.33 0.492 . . . . 0.0 112.33 -173.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.642 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -83.07 -42.3 17.6 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -179.3 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 21.0 mt -57.61 -52.77 53.21 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.123 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 171.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 13.3 mm -65.81 -47.05 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 CA-C-O 119.494 -0.288 . . . . 0.0 111.514 -176.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.6 t -56.21 -40.1 73.52 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 120.034 -0.667 . . . . 0.0 109.859 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.7 tp -68.3 -41.72 80.53 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 118.834 -0.603 . . . . 0.0 112.543 -176.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.7 pt -74.67 -36.4 40.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 CA-C-N 119.688 1.131 . . . . 0.0 111.946 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.0 mt -63.97 -48.59 85.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 177.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -59.47 -43.72 93.17 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.778 177.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -55.73 -40.1 72.02 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 177.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.7 t -65.34 -55.41 18.36 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -69.15 -21.17 64.02 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -173.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 50.2 mt -81.55 -14.8 56.41 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 179.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 78.8 m -125.04 163.73 35.9 Favored Pre-proline 0 CA--C 1.539 0.546 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 -169.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -59.11 174.26 1.0 Allowed 'Trans proline' 0 C--N 1.348 0.549 1 C-N-CA 126.041 4.494 . . . . 0.0 114.645 -179.231 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.573 ' HB3' ' HE2' ' A' ' 115' ' ' LYS . 4.6 p-10 -59.42 -30.18 68.29 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -174.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 25.3 t -63.53 -36.88 85.25 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -78.49 -28.13 46.3 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.034 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -63.05 -45.31 92.83 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-N 119.013 0.824 . . . . 0.0 109.104 173.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.7 tp -63.32 -48.27 78.73 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.76 -41.86 96.14 Favored Glycine 0 C--N 1.336 0.579 0 N-CA-C 111.111 -0.796 . . . . 0.0 111.111 178.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.2 m -63.63 -43.97 95.26 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 117.043 0.422 . . . . 0.0 110.443 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 81.6 mt -62.34 -37.02 84.04 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 118.086 0.403 . . . . 0.0 110.749 179.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -70.81 -33.28 70.54 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.64 0.654 . . . . 0.0 111.344 177.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 69.9 mt -71.3 -41.38 74.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 176.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 66.8 mt -65.25 -33.72 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 123.516 0.726 . . . . 0.0 109.412 177.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -75.18 -42.48 55.74 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 119.606 -0.235 . . . . 0.0 111.361 -178.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.424 ' HB2' HG23 ' A' ' 33' ' ' THR . 10.9 p -68.42 -49.77 57.53 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-N 118.592 0.633 . . . . 0.0 110.731 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 54.8 mt -67.4 -42.67 87.6 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.096 0 CA-C-N 117.725 0.239 . . . . 0.0 110.466 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.22 -39.66 94.54 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 -178.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.0 ttm-85 -70.1 -40.02 75.19 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.181 0.592 . . . . 0.0 110.314 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.92 -40.38 83.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 178.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.425 ' HH ' ' HB3' ' A' ' 36' ' ' ALA . 8.1 m-30 -62.36 -49.43 75.59 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 175.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.6 tp -57.61 -48.39 79.54 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.017 0.527 . . . . 0.0 110.25 -176.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -64.51 -43.86 92.74 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.808 -0.178 . . . . 0.0 110.811 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -67.9 -39.25 83.65 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 121.127 -0.229 . . . . 0.0 111.506 -175.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.1 t -80.17 -24.28 40.45 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.872 -178.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 . . . . . 0 C--N 1.341 0.212 0 CA-C-N 118.438 0.563 . . . . 0.0 111.621 172.456 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.316 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.2 p -53.0 -30.17 33.65 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.034 0.934 . . . . 0.0 113.434 -175.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.74 -46.32 90.13 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 118.97 0.804 . . . . 0.0 109.859 175.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -73.78 -23.04 59.65 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.897 178.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.75 -45.89 84.5 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 175.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.6 mt -64.45 -43.0 96.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 176.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -60.18 -34.12 73.15 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 121.309 -0.156 . . . . 0.0 111.33 178.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.6 m -74.92 -41.29 59.96 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-O 119.517 -0.278 . . . . 0.0 111.342 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.2 mt -61.39 -30.5 70.59 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 174.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.68 -14.92 31.38 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 119.277 -0.735 . . . . 0.0 113.637 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.78 -6.92 24.23 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.701 1.25 . . . . 0.0 111.959 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.3 m -121.18 -20.29 4.36 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -178.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.5 tp -51.42 -27.66 7.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 C-N-CA 123.027 0.531 . . . . 0.0 112.099 -177.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -64.1 -56.22 16.42 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 122.765 0.426 . . . . 0.0 110.81 177.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -66.31 -40.32 89.9 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 73.5 mt -58.59 -55.68 31.94 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 119.05 -0.5 . . . . 0.0 110.946 -177.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.3 mt -69.45 -51.8 32.78 Favored 'General case' 0 N--CA 1.457 -0.08 0 CA-C-N 118.581 0.628 . . . . 0.0 111.565 -177.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 80.4 p -55.06 -49.82 70.66 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 120.116 -0.634 . . . . 0.0 111.706 -178.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -69.69 -45.76 67.58 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 118.897 0.772 . . . . 0.0 111.513 -178.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -51.91 -55.88 17.51 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 118.11 0.414 . . . . 0.0 110.955 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 25.7 mt -69.19 -37.28 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 O-C-N 122.955 0.159 . . . . 0.0 110.821 -178.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.61 -21.46 61.84 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.143 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.573 ' HE2' ' HB3' ' A' ' 59' ' ' ASP . 0.1 OUTLIER -98.39 -15.17 19.79 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.649 0.38 . . . . 0.0 111.929 -175.736 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 87.8 p -84.34 167.99 16.03 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -174.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . 0.515 HD22 ' CD2' ' A' ' 120' ' ' HIS . 11.6 p30 -86.72 174.42 8.85 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 49.9 mm-40 -55.89 -40.31 72.81 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.558 0.617 . . . . 0.0 112.04 -175.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -71.42 -42.6 68.08 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.514 0.597 . . . . 0.0 111.001 -179.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.515 ' CD2' HD22 ' A' ' 117' ' ' ASN . 11.4 m-70 -71.17 -42.42 69.1 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.149 -0.345 . . . . 0.0 110.543 -178.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.4 ttpt -51.36 -49.88 60.6 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 169.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -61.12 -37.82 84.14 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 120.93 -0.308 . . . . 0.0 111.33 -175.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -63.03 -43.33 98.99 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 122.365 -0.209 . . . . 0.0 111.483 175.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 69.4 mt -69.59 -34.24 60.58 Favored 'Isoleucine or valine' 0 C--N 1.338 0.096 0 C-N-CA 119.869 -0.733 . . . . 0.0 109.05 178.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -35.75 81.95 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 177.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 19.9 ttt -66.27 -43.72 85.6 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 123.132 0.573 . . . . 0.0 110.316 175.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.41 -41.29 84.62 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 176.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 75.9 mt -70.43 -31.23 68.33 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 178.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.2 t70 . . . . . 0 N--CA 1.455 -0.178 0 CA-C-N 117.941 0.337 . . . . 0.0 110.135 178.394 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 160' ' ' PRO . . . . . 0.401 ' HD2' ' C ' ' A' ' 26' ' ' GLY . 44.5 Cg_endo . . . . . 0 N--CA 1.455 -0.764 0 N-CA-C 110.854 -0.479 . . . . 0.0 110.854 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 18.8 t 62.82 171.56 0.14 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.901 1.28 . . . . 0.0 112.108 -171.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -144.52 148.53 34.58 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.753 0.821 . . . . 0.0 110.306 -178.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 16.1 t -124.44 130.51 24.29 Favored Pre-proline 0 N--CA 1.45 -0.43 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.72 -10.8 4.19 Favored 'Trans proline' 0 N--CA 1.452 -0.952 0 C-N-CA 123.292 2.661 . . . . 0.0 113.054 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 67.2 p . . . . . 0 CA--C 1.53 0.201 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -177.333 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 . . . . . 0 CA--C 1.534 0.34 0 CA-C-O 120.77 0.319 . . . . 0.0 110.282 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -54.28 -15.06 1.37 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.928 0.891 . . . . 0.0 111.957 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.4 tp60 -55.64 -41.8 74.1 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.191 0.596 . . . . 0.0 111.13 177.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -65.47 -38.75 90.72 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 118.637 0.653 . . . . 0.0 110.521 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -64.44 -55.13 22.96 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 120.726 0.298 . . . . 0.0 110.235 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 96.6 t -59.16 -54.65 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.52 -32.1 68.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.938 0.495 . . . . 0.0 112.08 -177.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 58.9 m -72.56 -44.44 62.08 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 118.45 0.568 . . . . 0.0 110.707 177.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.9 tp -67.72 -33.38 74.76 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.424 0.631 . . . . 0.0 109.854 -179.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -65.15 -45.45 84.9 Favored 'General case' 0 CA--C 1.521 -0.159 0 C-N-CA 123.842 0.857 . . . . 0.0 109.216 176.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.3 t -61.6 -32.13 72.23 Favored 'General case' 0 N--CA 1.457 -0.079 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 175.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -61.58 -49.92 74.7 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 176.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt . . . . . 0 C--N 1.339 0.129 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 179.731 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.5 mm . . . . . 0 CA--C 1.532 0.278 0 CA-C-O 120.688 0.28 . . . . 0.0 110.71 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.6 m -54.95 128.51 33.78 Favored 'General case' 0 C--N 1.339 0.134 0 O-C-N 121.959 -0.463 . . . . 0.0 110.241 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.81 -15.27 62.03 Favored Glycine 0 C--N 1.337 0.584 0 CA-C-O 119.166 -0.796 . . . . 0.0 113.761 -174.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.1 p -62.38 -40.08 95.27 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 119.155 1.478 . . . . 0.0 110.823 -177.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -68.16 -42.72 79.64 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 56.1 mt -63.77 -36.04 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.3 mmtt -66.5 -42.21 87.73 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 118.743 -0.646 . . . . 0.0 110.864 179.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.13 -41.77 94.51 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.213 0.915 . . . . 0.0 111.039 175.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.2 mt -61.81 -57.28 12.47 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 122.563 -0.086 . . . . 0.0 110.929 -179.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.464 HG21 ' HB2' ' A' ' 71' ' ' SER . 41.3 p -55.67 -43.97 76.85 Favored 'General case' 0 CA--C 1.523 -0.071 0 O-C-N 122.152 -0.343 . . . . 0.0 111.641 177.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 m -55.38 -58.8 6.23 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 122.396 0.278 . . . . 0.0 110.799 -178.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -78.59 -14.62 59.24 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -172.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.42 -58.51 3.65 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 166.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.4 mt -65.62 -20.69 66.41 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.901 0.88 . . . . 0.0 112.284 -176.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -72.59 -14.89 61.72 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -133.71 -46.11 0.81 Allowed 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 119.011 0.823 . . . . 0.0 112.964 -176.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 39.8 mm 40.27 66.32 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 122.304 1.05 . . . . 0.0 111.529 -174.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -150.34 21.62 0.84 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.663 1.185 . . . . 0.0 108.655 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.574 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -148.8 35.52 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 C-N-CA 125.069 1.347 . . . . 0.0 109.063 -170.562 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.45 -52.81 43.17 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -175.044 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 83.5 p -76.57 -24.06 53.54 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -173.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.61 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -86.2 -41.76 14.39 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -179.584 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 48.8 mt -56.27 -52.77 47.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 118.259 0.481 . . . . 0.0 109.817 170.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 14.8 mm -67.09 -48.12 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.139 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.582 -177.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 48.4 t -55.76 -37.64 68.8 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 120.001 -0.68 . . . . 0.0 109.722 178.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.4 tp -69.31 -43.12 74.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.551 -0.738 . . . . 0.0 112.613 -177.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 31.3 pt -72.41 -35.53 52.05 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 120.047 1.294 . . . . 0.0 111.781 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 94.9 mt -64.24 -49.66 80.13 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-O 121.593 0.711 . . . . 0.0 109.257 178.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -57.92 -41.97 83.83 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.474 177.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -56.45 -41.07 75.88 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 176.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.4 t -66.22 -48.42 70.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 112.135 0.421 . . . . 0.0 112.135 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -73.21 -23.97 60.45 Favored 'General case' 0 C--O 1.231 0.081 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -175.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 51.4 mt -80.49 -15.1 57.55 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 178.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.403 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 73.4 m -119.87 157.36 52.74 Favored Pre-proline 0 CA--C 1.536 0.434 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -171.416 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.403 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 90.5 Cg_endo -72.62 -170.79 0.64 Allowed 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 125.045 3.83 . . . . 0.0 113.642 -176.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -50.67 -44.98 57.83 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.42 1.888 . . . . 0.0 114.462 -170.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.0 p -60.12 -31.4 70.03 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 65.1 m-70 -86.32 -14.7 42.84 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 118.921 -0.561 . . . . 0.0 111.136 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -69.85 -43.47 71.87 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 171.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 57.2 tp -66.44 -49.12 67.76 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.3 -38.32 93.15 Favored Glycine 0 C--N 1.336 0.552 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 178.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.1 t -60.94 -51.07 70.82 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 177.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 49.5 mt -58.59 -34.58 71.27 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.736 -0.65 . . . . 0.0 111.605 179.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -72.41 -33.53 67.21 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.389 0.995 . . . . 0.0 111.783 177.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 75.9 mt -75.69 -40.42 40.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 118.607 0.639 . . . . 0.0 110.378 178.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 84.6 mt -63.63 -36.68 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 174.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -67.8 -43.68 79.1 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.998 -0.525 . . . . 0.0 111.057 178.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.464 ' HB2' HG21 ' A' ' 33' ' ' THR . 89.3 p -67.17 -57.13 7.33 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 118.627 0.649 . . . . 0.0 111.289 -177.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 54.1 mt -64.88 -30.5 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 178.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.09 -54.67 19.81 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-O 119.851 -0.416 . . . . 0.0 112.541 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.614 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -66.49 -34.13 77.24 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 118.162 0.981 . . . . 0.0 110.754 -179.678 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.79 -45.96 76.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 110.318 -0.253 . . . . 0.0 110.318 177.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -63.71 -46.76 83.96 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 177.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 60.5 tp -55.93 -45.38 78.78 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 122.802 0.441 . . . . 0.0 110.507 -177.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -67.41 -46.94 71.7 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 120.775 -0.37 . . . . 0.0 110.811 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -64.68 -24.95 67.74 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -175.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.3 t -99.09 -27.77 13.68 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 118.798 0.726 . . . . 0.0 112.237 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 . . . . . 0 CA--C 1.531 0.231 0 O-C-N 121.948 -0.47 . . . . 0.0 111.882 -179.587 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.312 0 N-CA-C 114.093 1.145 . . . . 0.0 114.093 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.6 p -53.58 -28.46 32.14 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.153 0.981 . . . . 0.0 113.549 -174.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.74 -46.16 86.61 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 118.921 0.782 . . . . 0.0 109.952 176.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 3.2 m80 -73.96 -22.32 59.68 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.462 178.212 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.79 -46.57 78.18 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 175.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 94.9 mt -63.05 -41.69 93.8 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 175.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -63.51 -33.87 76.53 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 179.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.6 m -73.12 -39.7 65.55 Favored 'General case' 0 C--O 1.227 -0.126 0 O-C-N 122.342 -0.224 . . . . 0.0 110.654 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.1 mt -62.34 -31.58 72.24 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 173.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.46 -15.4 24.36 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-O 119.0 -0.889 . . . . 0.0 113.463 179.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -100.29 -4.74 28.68 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 119.263 1.531 . . . . 0.0 111.856 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 28.7 m -124.52 -20.55 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 122.823 0.449 . . . . 0.0 112.024 -179.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.8 tp -54.4 -23.4 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 C-N-CA 123.358 0.663 . . . . 0.0 112.222 -176.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -59.4 -54.01 51.56 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.623 0.369 . . . . 0.0 111.602 178.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -78.34 -29.16 47.42 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 121.124 -0.23 . . . . 0.0 110.795 -177.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.2 mt -63.16 -52.16 63.54 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 64.3 mt -64.79 -59.81 3.8 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 118.478 -0.773 . . . . 0.0 110.369 176.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 90.7 p -52.77 -42.32 64.89 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 118.97 -1.092 . . . . 0.0 111.857 -172.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -69.44 -47.49 63.88 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 119.16 0.891 . . . . 0.0 111.175 178.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.84 -34.58 65.53 Favored 'General case' 0 N--CA 1.458 -0.068 0 C-N-CA 123.503 0.721 . . . . 0.0 112.323 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -81.92 -39.75 16.92 Favored 'Isoleucine or valine' 0 C--N 1.337 0.041 0 CA-C-N 119.471 1.032 . . . . 0.0 112.048 175.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.64 -25.95 64.17 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.344 -178.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.94 -17.39 47.22 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.256 0.623 . . . . 0.0 110.731 178.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 13.3 m -80.88 160.85 24.62 Favored 'General case' 0 N--CA 1.457 -0.079 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -174.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -96.27 -179.2 4.57 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 170.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -55.47 -43.5 75.56 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.931 0.787 . . . . 0.0 111.828 -177.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -68.6 -41.39 79.66 Favored 'General case' 0 N--CA 1.453 -0.285 0 O-C-N 121.555 -0.715 . . . . 0.0 111.05 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -72.15 -38.27 69.24 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 122.158 -0.339 . . . . 0.0 111.176 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.73 -34.94 78.95 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -63.14 -42.51 99.48 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 178.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -61.59 -42.71 99.26 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 110.556 -0.165 . . . . 0.0 110.556 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.0 mt -65.89 -37.74 80.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 39.4 ttt180 -63.35 -33.26 75.13 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 176.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 62.4 ttp -67.79 -41.45 83.19 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 176.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 88.3 mt -58.76 -45.7 89.14 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.197 176.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.3 mt -67.33 -35.25 79.03 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 111.571 0.212 . . . . 0.0 111.571 -179.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.5 t70 . . . . . 0 CA--C 1.529 0.156 0 CA-C-N 117.999 0.363 . . . . 0.0 110.176 178.321 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo . . . . . 0 N--CA 1.456 -0.72 0 N-CA-C 110.37 -0.666 . . . . 0.0 110.37 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 36.6 m -76.6 163.71 26.61 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 120.819 0.343 . . . . 0.0 110.898 176.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 162' ' ' TYR . . . . . 0.464 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 7.9 t80 -143.22 138.22 29.51 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.116 0.566 . . . . 0.0 110.307 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 35.9 t -124.88 142.31 40.63 Favored Pre-proline 0 N--CA 1.454 -0.267 0 C-N-CA 122.976 0.51 . . . . 0.0 111.46 177.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -66.87 -5.93 14.54 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 123.388 2.725 . . . . 0.0 111.523 175.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 66.9 p . . . . . 0 N--CA 1.456 -0.172 0 C-N-CA 122.826 0.45 . . . . 0.0 111.642 179.583 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.463 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 12.9 t70 . . . . . 0 CA--C 1.536 0.436 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.463 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 13.5 t80 -55.58 -14.29 2.03 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.498 0.719 . . . . 0.0 111.142 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -51.4 -43.94 62.08 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.173 0.989 . . . . 0.0 110.609 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 44.7 m-20 -62.05 -44.2 97.2 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 118.042 0.383 . . . . 0.0 110.806 -179.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -64.88 -51.27 62.87 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 117.795 0.271 . . . . 0.0 110.566 -177.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.7 t -62.54 -55.09 26.08 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.05 -31.5 65.25 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.15 0.58 . . . . 0.0 111.802 -178.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 54.4 m -73.49 -43.0 61.14 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 118.387 0.54 . . . . 0.0 110.68 177.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.6 tp -66.72 -30.46 70.7 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -70.63 -43.83 68.44 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.167 0.987 . . . . 0.0 109.652 175.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -62.93 -26.77 68.97 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 175.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.49 -41.75 62.71 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 174.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.6 tttt . . . . . 0 CA--C 1.529 0.162 0 C-N-CA 123.087 0.555 . . . . 0.0 111.222 178.613 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.1 mm . . . . . 0 CA--C 1.531 0.224 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.3 m -49.89 127.25 15.9 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.401 0.68 . . . . 0.0 112.103 -174.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.56 -15.08 63.47 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-O 119.012 -0.882 . . . . 0.0 113.705 -176.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.416 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 46.5 t -62.46 -42.86 99.77 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 118.966 1.383 . . . . 0.0 110.301 -178.586 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -66.99 -40.87 87.48 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 46.0 mt -60.98 -37.58 77.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 176.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -60.74 -49.23 78.34 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.042 0.537 . . . . 0.0 110.783 177.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.416 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.5 OUTLIER -61.25 -43.51 98.76 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 118.366 0.53 . . . . 0.0 110.971 179.036 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.67 -61.92 2.09 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 122.356 -0.215 . . . . 0.0 110.635 -179.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 64.1 p -55.94 -46.02 78.65 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.3 t -63.32 -44.06 96.01 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.742 -176.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -68.19 -36.22 79.24 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 118.816 -1.153 . . . . 0.0 111.209 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.427 ' HB1' ' HH ' ' A' ' 76' ' ' TYR . . . -58.42 -56.29 24.08 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 174.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.9 mt -70.32 -17.89 63.08 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.477 0.711 . . . . 0.0 112.586 -175.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -63.76 -24.46 67.77 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -150.24 -26.15 0.24 Allowed 'General case' 0 C--N 1.342 0.253 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -176.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 32.6 mm 45.42 74.68 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 123.307 0.643 . . . . 0.0 111.484 -178.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -148.49 21.63 1.04 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.661 0.784 . . . . 0.0 109.964 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.572 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.13 36.69 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.134 0 C-N-CA 124.439 1.095 . . . . 0.0 109.566 -171.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.417 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -51.11 -55.27 18.58 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 -175.701 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 80.7 p -75.76 -25.76 56.79 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -173.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.622 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -83.03 -44.23 15.44 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.342 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 22.2 mt -56.23 -53.82 35.08 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 CA-C-N 118.178 0.445 . . . . 0.0 109.973 172.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.9 mm -65.33 -48.32 83.72 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.161 0 CA-C-O 119.209 -0.424 . . . . 0.0 111.523 -175.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 44.4 t -56.22 -40.43 74.05 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.167 178.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.2 tp -68.45 -41.46 80.21 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.4 pt -74.52 -35.0 37.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 CA-C-N 119.325 0.966 . . . . 0.0 111.906 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 97.4 mt -63.77 -50.68 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 177.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -58.14 -43.52 87.35 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.761 178.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.0 t80 -56.23 -41.65 76.05 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 176.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.7 t -64.69 -53.84 41.07 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -70.9 -23.7 62.34 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -173.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 51.2 mt -82.92 -15.95 49.34 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 76.3 m -118.55 159.15 45.07 Favored Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 -169.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -59.16 -171.5 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 1 C-N-CA 126.544 4.83 . . . . 0.0 116.582 -179.375 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -47.37 -58.79 3.75 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 126.719 2.008 . . . . 0.0 114.725 -175.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.2 p -58.81 -22.78 59.33 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.391 0.139 . . . . 0.0 110.668 -177.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 42.0 m-70 -88.84 -27.58 20.97 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 118.72 -0.657 . . . . 0.0 110.985 -178.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -66.52 -46.53 75.86 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 119.568 1.077 . . . . 0.0 108.215 172.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.0 tp -65.67 -48.89 70.55 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.853 0.359 . . . . 0.0 110.126 178.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.01 -40.19 95.2 Favored Glycine 0 C--N 1.336 0.553 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.4 m -65.68 -43.38 89.45 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 117.676 0.738 . . . . 0.0 110.564 178.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 72.1 mt -59.62 -35.46 74.4 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.866 0.757 . . . . 0.0 110.877 177.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -73.73 -35.34 65.06 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.516 0.598 . . . . 0.0 111.345 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 73.7 mt -70.09 -48.01 64.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 O-C-N 121.528 -0.732 . . . . 0.0 109.831 177.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 77.8 mt -59.1 -38.39 73.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 C-N-CA 124.283 1.033 . . . . 0.0 109.18 178.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -66.52 -46.81 74.94 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 118.676 -0.678 . . . . 0.0 111.084 177.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.0 t -62.37 -52.72 62.5 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 118.988 0.813 . . . . 0.0 110.887 -175.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 43.4 mt -63.8 -34.76 70.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.09 -51.24 46.38 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-O 119.739 -0.478 . . . . 0.0 112.665 -178.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.656 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -71.4 -32.34 68.31 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 117.994 0.897 . . . . 0.0 110.228 -178.055 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.66 -45.08 72.71 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 176.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.427 ' HH ' ' HB1' ' A' ' 36' ' ' ALA . 7.3 m-30 -61.57 -49.9 74.79 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 176.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.1 tp -60.75 -43.79 97.51 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.783 0.433 . . . . 0.0 110.931 -174.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -67.27 -45.24 77.22 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.471 178.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -64.32 -39.59 94.2 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 111.509 0.189 . . . . 0.0 111.509 -175.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.0 t -80.93 -33.79 33.83 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 118.037 0.38 . . . . 0.0 111.313 -179.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.7 ttt85 . . . . . 0 C--N 1.339 0.122 0 CA-C-N 118.406 0.548 . . . . 0.0 110.405 177.013 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.34 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 23.3 p -50.88 -30.34 14.33 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -175.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.82 -44.75 88.84 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.597 -0.689 . . . . 0.0 110.046 176.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -68.02 -30.29 69.5 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.931 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.49 -45.8 85.74 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 123.287 0.635 . . . . 0.0 110.143 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.6 mt -64.46 -42.23 94.65 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 175.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 44.6 t-20 -60.99 -33.62 73.52 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 121.255 -0.178 . . . . 0.0 110.725 178.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.8 m -73.54 -40.58 63.87 Favored 'General case' 0 N--CA 1.457 -0.097 0 CA-C-O 119.492 -0.29 . . . . 0.0 110.884 179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.1 mt -62.29 -29.65 70.58 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 173.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.69 -14.92 31.46 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 118.994 -0.892 . . . . 0.0 113.919 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -100.12 -6.24 26.58 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.016 1.408 . . . . 0.0 111.966 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.6 m -122.16 -18.57 4.74 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.163 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -178.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.7 tp -50.89 -28.46 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 CA-C-N 118.426 0.557 . . . . 0.0 111.602 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -59.35 -53.49 57.66 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.67 0.388 . . . . 0.0 110.849 177.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -80.72 -27.91 36.78 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 119.605 -0.236 . . . . 0.0 111.476 -177.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 82.0 mt -65.28 -50.84 64.18 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 178.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.414 ' O ' HG13 ' A' ' 113' ' ' ILE . 83.7 mt -64.37 -64.8 0.79 Allowed 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 175.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.2 t -34.4 -55.44 0.53 Allowed 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 179.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -73.12 -39.29 65.86 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-N 119.359 0.981 . . . . 0.0 112.054 -177.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.425 ' O ' ' HE2' ' A' ' 115' ' ' LYS . . . -57.56 -49.46 76.3 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.847 0.749 . . . . 0.0 110.216 179.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.2 OUTLIER -76.04 -32.57 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -179.119 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.35 -28.76 67.42 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.542 0.61 . . . . 0.0 109.841 179.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.425 ' HE2' ' O ' ' A' ' 112' ' ' ALA . 0.4 OUTLIER -79.21 -23.04 44.06 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.833 0.853 . . . . 0.0 110.374 175.12 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 35.5 m -76.87 154.95 33.28 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 113.75 1.018 . . . . 0.0 113.75 -172.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -92.1 -178.35 4.95 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 170.177 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -55.61 -43.82 76.44 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.094 0.407 . . . . 0.0 111.396 -178.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -66.71 -43.02 85.4 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 121.716 -0.615 . . . . 0.0 110.85 -178.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 55.7 m80 -70.25 -36.08 74.22 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 119.628 -0.225 . . . . 0.0 110.777 -178.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.08 -39.48 92.56 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 174.389 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -67.41 -38.65 84.95 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.689 -177.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -63.04 -44.47 95.8 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 121.209 -0.196 . . . . 0.0 111.169 175.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 97.5 mt -66.94 -35.92 75.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 80.0 ttt-85 -66.4 -32.19 73.42 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 122.079 -0.388 . . . . 0.0 110.181 176.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 58.3 ttp -67.19 -42.47 84.15 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 175.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 64.7 tp -57.34 -47.81 80.63 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.95 0.405 . . . . 0.0 110.221 176.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 84.1 mt -70.79 -27.79 64.16 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.443 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.6 t70 . . . . . 0 N--CA 1.454 -0.258 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 175.947 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo . . . . . 0 N--CA 1.455 -0.759 0 N-CA-C 110.103 -0.768 . . . . 0.0 110.103 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 38.1 m -68.4 154.9 40.91 Favored 'General case' 0 N--CA 1.457 -0.109 0 CA-C-O 120.679 0.276 . . . . 0.0 110.616 176.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 162' ' ' TYR . . . . . 0.423 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 3.2 t80 -150.58 138.53 20.04 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.911 0.484 . . . . 0.0 110.671 -179.145 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.4 t -133.46 134.67 24.07 Favored Pre-proline 0 N--CA 1.455 -0.195 0 C-N-CA 123.26 0.624 . . . . 0.0 111.4 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -58.42 -12.58 14.07 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.531 2.821 . . . . 0.0 112.593 174.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 2.8 m . . . . . 0 CA--C 1.531 0.247 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 -173.414 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.472 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 18.3 t70 . . . . . 0 CA--C 1.534 0.331 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.472 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 7.1 t80 -55.92 -13.65 1.99 Allowed 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.724 -0.61 . . . . 0.0 110.772 177.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -53.06 -37.98 62.09 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 124.367 1.067 . . . . 0.0 111.127 175.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -62.91 -45.02 94.46 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 119.217 0.917 . . . . 0.0 110.164 179.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -64.04 -51.34 64.6 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 117.693 0.224 . . . . 0.0 110.613 -178.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.2 t -64.72 -50.82 73.71 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.129 0 C-N-CA 121.002 -0.279 . . . . 0.0 110.773 -177.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.31 -29.47 69.89 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 119.537 -0.268 . . . . 0.0 111.683 -179.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 57.5 m -73.84 -43.55 58.34 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 118.456 0.571 . . . . 0.0 110.389 176.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.536 ' HG ' ' CD2' ' A' ' 53' ' ' TYR . 21.3 tp -66.32 -28.47 68.71 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.163 0.506 . . . . 0.0 109.741 179.228 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -70.64 -46.71 62.78 Favored 'General case' 0 C--N 1.337 0.035 0 C-N-CA 123.773 0.829 . . . . 0.0 109.35 175.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 64.8 m -63.4 -22.77 67.08 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.059 175.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -76.72 -39.56 51.49 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.484 0.314 . . . . 0.0 110.28 175.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.1 ttpp . . . . . 0 CA--C 1.531 0.216 0 C-N-CA 123.264 0.625 . . . . 0.0 111.05 175.938 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 29.9 mt . . . . . 0 CA--C 1.532 0.261 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.0 t -140.06 125.1 18.56 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 175.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -61.39 -31.22 76.56 Favored Glycine 0 CA--C 1.524 0.615 0 CA-C-O 119.26 -0.744 . . . . 0.0 112.805 -175.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 88.8 p -63.47 -35.5 80.64 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 118.795 1.298 . . . . 0.0 110.879 -174.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.0 mmt-85 -68.39 -45.5 72.51 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 177.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 41.4 mt -62.59 -35.15 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.1 mmtt -71.22 -37.85 72.02 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 118.998 -0.525 . . . . 0.0 111.25 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.58 -42.73 91.4 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.065 0.848 . . . . 0.0 110.183 175.062 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.8 mt -64.15 -59.68 4.14 Favored 'General case' 0 N--CA 1.456 -0.156 0 O-C-N 122.611 -0.056 . . . . 0.0 111.149 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 56.3 p -56.26 -46.38 79.67 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 178.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 t -63.47 -44.69 93.69 Favored 'General case' 0 CA--C 1.521 -0.142 0 C-N-CA 119.814 -0.754 . . . . 0.0 111.295 -177.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -67.34 -35.95 80.43 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 118.928 -1.109 . . . . 0.0 111.12 -178.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.433 ' HB3' ' HH ' ' A' ' 76' ' ' TYR . . . -58.92 -57.56 12.51 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.743 0.306 . . . . 0.0 110.434 174.092 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 63.9 mt -70.51 -16.59 62.91 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.927 0.891 . . . . 0.0 113.045 -174.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -61.92 -29.56 70.3 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -178.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.5 p80 -152.62 -17.01 0.16 Allowed 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 115.243 1.572 . . . . 0.0 115.243 -177.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 27.5 mm 44.82 77.07 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 121.662 0.744 . . . . 0.0 112.084 178.05 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -147.32 21.13 1.21 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.406 0.682 . . . . 0.0 110.367 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.539 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -147.41 37.62 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 C-N-CA 124.407 1.083 . . . . 0.0 109.362 -171.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.431 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -51.11 -57.6 8.29 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -175.47 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 85.2 p -74.38 -25.85 59.75 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -173.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.62 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.04 -45.07 15.79 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 18.9 mt -55.58 -50.87 63.73 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 172.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 14.9 mm -67.99 -48.04 76.44 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -176.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.2 t -55.47 -42.81 74.86 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 119.96 -0.696 . . . . 0.0 109.96 179.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 73.9 mt -61.27 -62.02 2.14 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.021 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.5 pt -58.77 -35.49 56.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 119.621 1.1 . . . . 0.0 112.144 -174.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 76.2 mt -60.83 -59.18 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 178.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -63.98 -31.88 73.22 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.769 -178.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.536 ' CD2' ' HG ' ' A' ' 14' ' ' LEU . 3.7 m-85 -66.16 -34.23 77.56 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 122.092 -0.38 . . . . 0.0 110.162 178.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 29.5 t -68.89 -46.76 67.54 Favored 'General case' 0 C--O 1.231 0.087 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 173.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.6 tpp180 -56.14 -37.76 69.91 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 124.959 1.303 . . . . 0.0 112.519 -177.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 69.6 mt -78.35 -14.28 59.48 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 115.068 1.507 . . . . 0.0 115.068 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.447 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 82.4 m -115.18 160.08 35.42 Favored Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -169.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 93.9 Cg_endo -70.89 179.79 4.03 Favored 'Trans proline' 0 C--N 1.348 0.531 1 C-N-CA 125.344 4.029 . . . . 0.0 113.028 -179.234 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.558 ' HB3' ' HE3' ' A' ' 115' ' ' LYS . 5.0 p-10 -55.53 -34.51 64.74 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 114.53 1.308 . . . . 0.0 114.53 -171.152 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.2 t -63.77 -35.3 80.13 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.902 0.774 . . . . 0.0 109.452 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 62.8 t-80 -83.99 -31.1 25.68 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.078 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -58.71 -44.97 90.52 Favored 'General case' 0 C--N 1.341 0.219 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 53.5 tp -66.92 -52.05 47.83 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 122.757 0.423 . . . . 0.0 111.187 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.83 -39.63 97.75 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 -179.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.0 t -70.51 -33.52 71.29 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 117.322 0.561 . . . . 0.0 110.061 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.4 mt -64.82 -33.65 76.5 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.511 173.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -66.42 -39.15 88.78 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 119.331 0.969 . . . . 0.0 109.697 174.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 83.9 mt -64.12 -50.29 77.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 O-C-N 122.146 -0.346 . . . . 0.0 111.116 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 60.1 mt -62.1 -34.95 66.07 Favored 'Isoleucine or valine' 0 C--O 1.231 0.115 0 C-N-CA 123.712 0.805 . . . . 0.0 109.681 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -67.76 -42.76 81.27 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.985 -0.531 . . . . 0.0 110.442 177.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.422 ' HA ' ' NH1' ' A' ' 74' ' ' ARG . 8.0 t -66.93 -50.65 61.7 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 119.25 -0.98 . . . . 0.0 111.338 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 47.0 mt -64.89 -35.74 76.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.201 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.0 -54.31 25.31 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.966 -0.454 . . . . 0.0 111.966 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.422 ' NH1' ' HA ' ' A' ' 71' ' ' SER . 4.0 mtp-105 -61.74 -37.53 84.57 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-N 117.294 0.547 . . . . 0.0 110.817 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.02 -44.44 72.73 Favored 'General case' 0 N--CA 1.451 -0.375 0 O-C-N 122.46 -0.15 . . . . 0.0 111.004 179.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.433 ' HH ' ' HB3' ' A' ' 36' ' ' ALA . 7.2 m-30 -61.8 -45.57 93.27 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 176.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.6 tt -58.83 -52.95 63.53 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -177.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -58.21 -44.97 88.4 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 121.154 -0.218 . . . . 0.0 110.556 179.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -63.61 -43.02 98.08 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -174.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.48 HG23 HH11 ' A' ' 81' ' ' ARG . 14.6 t -82.16 -26.36 33.52 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -176.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.48 HH11 HG23 ' A' ' 80' ' ' THR . 9.5 mpt_? . . . . . 0 C--N 1.339 0.147 0 CA-C-N 118.694 0.679 . . . . 0.0 110.206 175.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.243 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.0 p -51.13 -27.26 8.07 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -177.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.3 -39.07 82.17 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.253 -0.904 . . . . 0.0 110.126 176.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 -68.55 -34.48 75.91 Favored 'General case' 0 CA--C 1.519 -0.227 0 C-N-CA 122.981 0.512 . . . . 0.0 109.801 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.74 -43.75 95.57 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.349 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.5 -42.89 94.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 175.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -59.98 -33.98 72.68 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 121.393 -0.123 . . . . 0.0 111.022 179.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.7 m -76.0 -41.47 51.03 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-O 119.535 -0.269 . . . . 0.0 111.346 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 62.6 mt -61.7 -29.74 70.29 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 119.782 -0.767 . . . . 0.0 108.985 173.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.88 -14.87 39.67 Favored Glycine 0 CA--C 1.529 0.948 0 CA-C-O 119.171 -0.794 . . . . 0.0 113.672 179.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.67 -6.16 25.54 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.591 1.196 . . . . 0.0 111.562 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 32.2 m -124.02 -18.12 4.05 Favored 'Isoleucine or valine' 0 C--N 1.338 0.094 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.1 tp -53.15 -31.1 17.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 CA-C-N 118.751 0.705 . . . . 0.0 111.28 -177.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -60.83 -55.08 37.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.884 0.474 . . . . 0.0 110.829 178.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -75.94 -31.56 59.15 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.684 0.394 . . . . 0.0 111.773 -177.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 58.6 mt -64.81 -50.53 66.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 97.4 mt -70.29 -50.41 39.67 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.643 -178.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 88.9 p -52.21 -50.19 62.44 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 118.545 0.611 . . . . 0.0 111.852 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -68.29 -46.38 70.48 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 118.662 0.664 . . . . 0.0 111.167 -178.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -54.11 -54.12 43.9 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.844 0.458 . . . . 0.0 110.499 -179.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 10.8 mt -65.47 -46.0 91.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 CA-C-N 118.005 0.366 . . . . 0.0 110.801 -178.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.01 -21.47 66.4 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 119.74 -0.171 . . . . 0.0 111.292 -176.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.558 ' HE3' ' HB3' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -94.88 -13.68 25.25 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 117.69 0.223 . . . . 0.0 111.432 179.831 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.434 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 50.1 p -90.11 165.9 13.72 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -172.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -83.55 174.08 10.88 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.137 0.975 . . . . 0.0 109.894 179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.7 tt0 -55.55 -44.39 76.73 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.906 0.482 . . . . 0.0 111.851 -178.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -68.44 -37.46 80.26 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 121.964 -0.46 . . . . 0.0 110.606 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.434 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 56.4 m80 -71.51 -52.54 17.78 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 119.001 -0.523 . . . . 0.0 110.969 -177.773 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -36.99 65.74 Favored 'General case' 0 C--N 1.342 0.258 0 CA-C-N 119.238 0.927 . . . . 0.0 110.922 173.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.69 -43.57 98.47 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.566 178.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -64.7 -36.16 83.39 Favored 'General case' 0 C--O 1.227 -0.109 0 CA-C-O 119.549 -0.262 . . . . 0.0 111.685 177.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.4 mt -68.58 -40.5 81.96 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 178.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 15.4 ttp180 -60.55 -47.04 87.95 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.701 0.401 . . . . 0.0 110.766 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.72 -30.69 64.39 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.278 -178.139 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.6 tt -60.98 -47.67 85.36 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.621 0.646 . . . . 0.0 109.481 175.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 87.9 mt -70.09 -32.08 69.97 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.772 -0.194 . . . . 0.0 111.062 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.0 t70 . . . . . 0 N--CA 1.454 -0.256 0 N-CA-C 110.391 -0.225 . . . . 0.0 110.391 177.991 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 160' ' ' PRO . . . . . 0.555 ' HG2' ' H ' ' B' ' 161' ' ' SER . 61.1 Cg_endo . . . . . 0 N--CA 1.457 -0.62 0 N-CA-C 111.23 -0.335 . . . . 0.0 111.23 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 161' ' ' SER . . . . . 0.555 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 68.2 p -169.0 156.18 7.14 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 124.115 0.966 . . . . 0.0 109.377 176.037 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -158.33 139.43 13.19 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.63 0.252 . . . . 0.0 111.618 173.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 27.0 t -140.44 142.66 30.09 Favored Pre-proline 0 N--CA 1.454 -0.26 0 C-N-CA 123.749 0.82 . . . . 0.0 110.78 178.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.85 -7.71 2.55 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 123.776 2.984 . . . . 0.0 112.975 173.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 38.0 m . . . . . 0 CA--C 1.53 0.184 0 C-N-CA 122.967 0.507 . . . . 0.0 110.977 -179.382 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.1 t70 . . . . . 0 CA--C 1.531 0.249 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -55.64 -16.55 4.25 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 118.438 0.563 . . . . 0.0 111.077 175.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.7 tp60 -55.32 -40.1 70.77 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 123.106 0.563 . . . . 0.0 110.81 176.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -60.96 -40.59 93.93 Favored 'General case' 0 N--CA 1.458 -0.072 0 CA-C-N 118.516 0.598 . . . . 0.0 110.781 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -64.57 -55.73 18.56 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 57.6 t -59.09 -53.97 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.123 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -178.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.03 -33.07 70.33 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.165 0.586 . . . . 0.0 111.95 -177.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 56.3 m -70.26 -44.95 67.41 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 118.784 0.72 . . . . 0.0 110.047 177.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.6 tp -65.72 -34.51 78.35 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.385 0.612 . . . . 0.0 109.983 -179.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -67.57 -42.89 81.83 Favored 'General case' 0 CA--C 1.52 -0.2 0 C-N-CA 123.866 0.866 . . . . 0.0 109.763 178.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.0 m -63.94 -30.19 71.3 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 175.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.29 -36.27 76.88 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 176.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.9 tttm . . . . . 0 N--CA 1.456 -0.169 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 177.032 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.1 mm . . . . . 0 CA--C 1.53 0.186 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.3 m -50.53 127.94 18.98 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.836 0.454 . . . . 0.0 111.735 -175.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.22 -14.59 64.21 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-O 119.043 -0.865 . . . . 0.0 113.548 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 66.3 p -64.42 -42.25 96.14 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 119.272 1.536 . . . . 0.0 111.082 -177.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -64.3 -40.63 96.33 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 177.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 55.5 mt -64.03 -37.37 79.65 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -60.39 -47.44 86.07 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 122.722 0.409 . . . . 0.0 110.231 178.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.01 -46.53 88.79 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 118.025 0.375 . . . . 0.0 111.02 177.271 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 99.4 mt -61.6 -59.4 5.26 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 122.196 -0.315 . . . . 0.0 110.806 -177.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 67.3 p -56.36 -46.41 80.03 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.3 t -64.14 -44.28 92.65 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.182 -176.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -75.25 -18.56 60.07 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 120.205 -0.598 . . . . 0.0 112.349 -179.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.37 -59.25 3.56 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.699 0.681 . . . . 0.0 109.288 167.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.5 mp -70.92 -13.42 62.01 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -176.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -55.41 -26.64 42.92 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -153.08 -24.04 0.15 Allowed 'General case' 0 C--N 1.339 0.143 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -178.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 35.8 mm 45.44 72.45 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-O 121.837 0.827 . . . . 0.0 111.446 -177.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -146.6 21.69 1.31 Allowed 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.48 1.112 . . . . 0.0 109.229 179.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.572 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.57 33.24 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.231 0 C-N-CA 124.574 1.15 . . . . 0.0 109.209 -170.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.482 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.2 OUTLIER -49.12 -55.67 11.54 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -177.062 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 80.4 p -74.66 -27.15 60.3 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -173.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.615 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.48 -43.17 17.54 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 -179.306 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 39.2 mt -55.75 -51.77 55.7 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 14.9 mm -67.43 -49.3 72.68 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -176.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 72.2 m -57.53 -35.33 70.16 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 119.277 -0.969 . . . . 0.0 110.404 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.5 tp -70.0 -43.87 70.52 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 118.909 -0.567 . . . . 0.0 112.261 -178.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 36.8 pt -73.37 -33.21 39.89 Favored 'Isoleucine or valine' 0 C--N 1.34 0.187 0 CA-C-N 119.304 0.956 . . . . 0.0 111.809 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 97.3 mt -65.66 -52.59 48.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -63.06 -29.09 70.54 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.356 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 33.3 t80 -62.75 -47.71 82.34 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 174.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.9 t -62.23 -33.07 73.89 Favored 'General case' 0 C--N 1.338 0.087 0 CA-C-O 120.581 0.229 . . . . 0.0 110.567 176.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -69.23 -40.91 77.64 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.866 0.866 . . . . 0.0 112.597 -177.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.2 mt -91.92 -14.81 28.98 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -174.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 78.7 m -100.72 159.45 29.56 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -170.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -57.94 -178.66 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.367 1 C-N-CA 126.153 4.569 . . . . 0.0 115.406 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -62.84 -46.3 88.55 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.459 1.104 . . . . 0.0 112.766 -177.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 50.6 m -62.54 -30.53 71.37 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 20.6 m80 -79.17 -20.58 48.1 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 119.026 -0.512 . . . . 0.0 110.756 176.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.7 tppt? -67.63 -45.86 74.13 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 173.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.4 tp -63.91 -44.48 92.83 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.404 176.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.63 -40.96 95.38 Favored Glycine 0 C--N 1.339 0.712 0 N-CA-C 110.353 -1.099 . . . . 0.0 110.353 177.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 71.0 m -60.74 -44.15 97.05 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.93 -0.557 . . . . 0.0 109.792 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 20.8 mt -57.87 -42.29 84.22 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.586 0.63 . . . . 0.0 111.477 178.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -68.6 -34.99 76.73 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.026 0.83 . . . . 0.0 111.328 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 71.3 mt -69.98 -50.96 44.1 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 O-C-N 122.026 -0.421 . . . . 0.0 110.385 178.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 74.9 mt -60.11 -35.16 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.105 0 C-N-CA 124.211 1.004 . . . . 0.0 109.546 178.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -68.2 -45.99 71.85 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.848 -0.596 . . . . 0.0 110.871 178.18 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.5 t -64.57 -53.39 48.52 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 118.569 0.622 . . . . 0.0 110.955 -178.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 47.3 mt -63.68 -34.32 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.32 -52.79 37.18 Favored Glycine 0 CA--C 1.524 0.64 0 CA-C-O 119.927 -0.374 . . . . 0.0 112.43 -178.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.632 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -70.27 -33.79 72.01 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 117.961 0.88 . . . . 0.0 111.001 -178.857 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.42 -48.17 70.89 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 177.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 -60.02 -45.68 91.99 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 176.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -57.05 -46.19 82.64 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 119.363 -0.351 . . . . 0.0 110.601 -176.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -68.84 -41.7 78.15 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 119.732 -0.787 . . . . 0.0 111.005 178.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -65.77 -23.71 66.78 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -176.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.9 t -99.94 -21.71 15.56 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 118.583 0.629 . . . . 0.0 111.231 175.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 . . . . . 0 C--N 1.339 0.14 0 CA-C-N 117.908 0.322 . . . . 0.0 110.64 175.7 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.269 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.3 p -49.91 -30.09 9.5 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.194 0.906 . . . . 0.0 113.28 -177.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.56 -45.62 82.61 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.397 -0.814 . . . . 0.0 110.193 175.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -65.45 -31.61 72.78 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 123.579 0.752 . . . . 0.0 110.179 177.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.25 -45.29 81.07 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.617 0.767 . . . . 0.0 110.572 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.4 mt -64.31 -41.74 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 174.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -61.55 -33.48 73.92 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 120.476 0.179 . . . . 0.0 110.873 179.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.3 m -74.14 -41.75 61.07 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 122.085 -0.384 . . . . 0.0 110.928 179.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 61.2 mt -61.42 -30.89 70.85 Favored 'General case' 0 C--O 1.228 -0.074 0 CA-C-N 118.859 0.754 . . . . 0.0 109.014 173.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.93 -14.39 23.52 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-O 119.018 -0.879 . . . . 0.0 113.424 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -100.43 -3.94 29.94 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 118.961 1.38 . . . . 0.0 111.785 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 33.1 m -127.14 -19.98 2.24 Favored 'Isoleucine or valine' 0 C--N 1.339 0.15 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.1 tp -54.78 -28.39 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 C-N-CA 123.157 0.583 . . . . 0.0 111.891 -175.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -58.85 -58.23 9.56 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 120.739 0.304 . . . . 0.0 111.095 -179.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -78.05 -26.03 48.08 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 122.401 0.281 . . . . 0.0 111.219 -178.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.0 tt -66.45 -50.3 63.83 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 75.7 mt -69.7 -52.63 23.87 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.995 -0.526 . . . . 0.0 109.901 176.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.4 t -40.28 -49.39 2.73 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.073 0.397 . . . . 0.0 112.056 175.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -72.06 -48.48 43.97 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-N 118.222 0.465 . . . . 0.0 111.596 -178.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.04 -29.98 61.24 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 123.314 0.646 . . . . 0.0 112.277 179.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 2.5 mt -85.59 -41.18 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 118.855 0.752 . . . . 0.0 111.272 173.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.13 -25.93 67.21 Favored 'General case' 0 N--CA 1.454 -0.235 0 O-C-N 121.903 -0.498 . . . . 0.0 111.075 -177.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.21 -19.4 43.34 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.119 0.968 . . . . 0.0 110.93 177.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.475 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 24.4 p -83.44 163.13 20.72 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -172.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -94.62 175.45 6.66 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.676 1.191 . . . . 0.0 108.444 173.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -55.86 -38.96 70.8 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.831 0.741 . . . . 0.0 112.603 -176.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -73.29 -37.47 66.21 Favored 'General case' 0 C--O 1.232 0.132 0 O-C-N 121.526 -0.734 . . . . 0.0 110.514 -179.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.475 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 43.3 m170 -72.24 -44.12 63.34 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.856 -0.592 . . . . 0.0 110.857 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.4 ' C ' ' HD2' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -58.25 -38.66 77.33 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 119.573 1.079 . . . . 0.0 109.535 175.199 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -61.21 -44.11 97.81 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.129 177.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -64.17 -35.78 81.91 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 177.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 94.2 mt -74.59 -37.7 44.17 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.067 0 CA-C-N 118.359 0.527 . . . . 0.0 110.108 -178.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -63.68 -39.73 95.05 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 176.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 58.4 ttp -66.34 -42.43 88.14 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.369 0.268 . . . . 0.0 110.289 175.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.2 tt -59.93 -44.7 94.19 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 -178.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -69.36 -37.31 77.54 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 119.151 -0.452 . . . . 0.0 111.319 178.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 24.6 t70 . . . . . 0 N--CA 1.457 -0.102 0 CA-C-N 118.431 0.559 . . . . 0.0 110.119 177.897 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo . . . . . 0 N--CA 1.454 -0.852 0 N-CA-C 110.359 -0.67 . . . . 0.0 110.359 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 73.5 p -71.31 160.38 32.91 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 122.447 0.299 . . . . 0.0 111.229 178.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 162' ' ' TYR . . . . . 0.43 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 16.0 t80 -146.06 138.78 25.6 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.451 0.3 . . . . 0.0 111.477 -179.112 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.9 t -130.72 139.44 35.62 Favored Pre-proline 0 CA--C 1.53 0.197 0 C-N-CA 123.411 0.684 . . . . 0.0 110.619 176.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -58.77 -11.25 11.35 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.293 2.662 . . . . 0.0 112.318 173.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.535 0.371 0 C-N-CA 123.706 0.802 . . . . 0.0 111.872 -175.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.453 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 22.5 t70 . . . . . 0 CA--C 1.534 0.343 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.453 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 18.1 t80 -55.11 -14.65 1.7 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.227 1.011 . . . . 0.0 111.254 176.776 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.6 tp60 -54.59 -40.53 68.93 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.315 0.646 . . . . 0.0 111.15 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -58.1 -46.62 85.22 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 118.924 0.784 . . . . 0.0 110.811 177.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -63.96 -50.48 68.44 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 117.964 0.347 . . . . 0.0 110.803 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 62.1 t -62.69 -54.46 33.63 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 -178.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.12 -29.79 67.64 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.288 0.635 . . . . 0.0 111.819 -177.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 72.6 m -75.12 -41.36 58.68 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.255 0.479 . . . . 0.0 110.534 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.4 tp -65.85 -33.52 76.03 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -67.42 -42.91 82.43 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.915 0.886 . . . . 0.0 109.819 175.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.7 t -60.69 -31.16 70.42 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 174.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.422 ' CE2' HD12 ' A' ' 68' ' ' ILE . 0.1 OUTLIER -70.88 -38.04 73.05 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 176.479 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.8 tttm . . . . . 0 N--CA 1.455 -0.186 0 C-N-CA 122.501 0.32 . . . . 0.0 111.565 177.147 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 20.8 mm . . . . . 0 C--O 1.231 0.105 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.1 t -124.66 127.56 47.5 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 117.902 0.319 . . . . 0.0 110.203 -176.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.73 -32.44 78.09 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-O 119.497 -0.613 . . . . 0.0 112.468 -175.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 80.0 p -62.23 -39.28 92.29 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.404 1.102 . . . . 0.0 110.703 -175.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.4 mpt_? -68.71 -44.66 73.44 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.147 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 77.0 mt -59.91 -41.7 86.82 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.098 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -67.59 -36.97 81.89 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 118.9 -0.571 . . . . 0.0 111.569 -179.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.62 -41.41 88.39 Favored 'General case' 0 C--N 1.338 0.097 0 CA-C-N 119.534 1.061 . . . . 0.0 110.495 175.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.3 mt -62.14 -52.07 65.31 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 122.395 -0.191 . . . . 0.0 110.568 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 44.0 p -60.87 -42.01 97.08 Favored 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 122.087 -0.383 . . . . 0.0 110.753 179.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.9 m -55.41 -57.52 11.51 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 122.965 0.506 . . . . 0.0 111.101 179.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 63.9 m-85 -76.16 -18.65 59.01 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -173.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.43 -57.76 4.86 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 118.859 0.754 . . . . 0.0 109.141 168.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.5 mt -70.44 -15.2 62.8 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.851 0.86 . . . . 0.0 112.949 -175.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -55.6 -31.41 62.22 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -178.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.2 t-80 -152.74 -20.81 0.16 Allowed 'General case' 0 C--N 1.34 0.171 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 35.9 mm 46.8 73.78 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-O 121.82 0.819 . . . . 0.0 111.514 -178.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -143.97 22.65 1.74 Allowed 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.053 1.341 . . . . 0.0 108.656 178.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.561 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.8 pt -147.17 33.42 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 C-N-CA 124.679 1.192 . . . . 0.0 109.778 -170.117 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.432 ' N ' ' CD ' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -50.45 -54.41 22.27 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 -176.313 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 32.6 t -74.23 -32.6 63.06 Favored 'General case' 0 C--O 1.225 -0.193 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -174.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.661 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -76.77 -45.6 28.34 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -178.617 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 9.6 mm -56.44 -51.73 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 173.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.416 ' CG1' ' HB2' ' A' ' 97' ' ' ALA . 15.4 mm -66.84 -50.83 61.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -176.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.8 m -59.06 -33.54 70.91 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 119.635 -0.826 . . . . 0.0 110.762 179.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.1 tp -70.02 -43.29 71.63 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 33.1 pt -73.58 -35.13 43.91 Favored 'Isoleucine or valine' 0 C--N 1.341 0.226 0 CA-C-N 119.427 1.012 . . . . 0.0 111.481 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 97.6 mt -64.2 -52.53 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -63.44 -31.65 72.87 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.068 179.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -60.18 -46.13 90.77 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 175.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -64.64 -37.07 86.33 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-O 120.796 0.331 . . . . 0.0 110.578 177.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 52.3 tpt85 -67.15 -34.75 78.24 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 124.207 1.003 . . . . 0.0 112.834 -176.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 71.7 mt -92.25 -14.67 28.56 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -176.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 66.6 m -110.65 150.84 42.31 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -170.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -74.76 -170.67 0.8 Allowed 'Trans proline' 0 CA--C 1.536 0.617 1 C-N-CA 125.65 4.234 . . . . 0.0 114.303 -177.273 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -34.72 -64.38 0.26 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 128.122 2.569 . . . . 0.0 115.027 -175.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 37.5 m -58.09 -28.18 64.36 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 122.505 0.322 . . . . 0.0 110.896 -174.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -90.32 -16.73 28.66 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 118.522 -0.751 . . . . 0.0 111.923 -179.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -70.95 -42.32 69.95 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 169.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 59.9 tp -66.93 -47.49 71.53 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 176.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.64 -46.04 93.86 Favored Glycine 0 C--N 1.338 0.662 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 178.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 92.2 p -63.07 -41.45 99.44 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 117.574 0.687 . . . . 0.0 110.163 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 31.4 mt -61.68 -40.25 94.3 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 119.06 0.845 . . . . 0.0 111.487 177.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -67.84 -34.47 76.77 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 119.721 1.146 . . . . 0.0 111.147 177.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.422 HD12 ' CE2' ' A' ' 17' ' ' PHE . 69.3 mt -68.3 -49.05 70.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 O-C-N 121.72 -0.613 . . . . 0.0 110.497 177.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.25 -34.6 64.79 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.077 0 C-N-CA 124.13 0.972 . . . . 0.0 109.39 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -67.95 -44.17 77.41 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.162 0.585 . . . . 0.0 110.505 177.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 14.3 m -67.64 -49.88 60.71 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 119.725 -0.79 . . . . 0.0 111.038 -177.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 67.5 mt -67.11 -38.13 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 179.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.15 -46.7 78.2 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 -178.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.4 mtp-105 -69.22 -36.72 77.52 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 117.257 0.528 . . . . 0.0 110.773 178.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.16 -40.08 86.59 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 177.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.4 m-30 -64.99 -48.2 74.82 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 175.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.3 tp -56.9 -43.42 81.35 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 123.367 0.417 . . . . 0.0 109.968 -177.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -67.3 -42.43 83.75 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 122.523 -0.111 . . . . 0.0 110.874 178.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -62.8 -40.9 98.8 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 111.444 0.164 . . . . 0.0 111.444 -176.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.5 t -84.02 -26.99 28.68 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 13.7 tpp180 . . . . . 0 C--N 1.34 0.193 0 CA-C-N 118.26 0.482 . . . . 0.0 110.807 175.938 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.406 ' HB ' ' H ' ' A' ' 94' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.237 0 CA-C-O 119.034 -0.508 . . . . 0.0 109.883 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.406 ' H ' ' HB ' ' A' ' 93' ' ' THR . 23.0 p -48.61 -30.62 5.57 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.107 0.867 . . . . 0.0 113.248 -178.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.64 -46.62 81.77 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.313 -0.867 . . . . 0.0 109.922 175.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 41.0 t60 -65.81 -32.05 73.36 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.949 -0.568 . . . . 0.0 109.955 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.416 ' HB2' ' CG1' ' A' ' 47' ' ' ILE . . . -64.27 -45.35 88.43 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 123.686 0.794 . . . . 0.0 110.597 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.4 mt -63.01 -42.72 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.171 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 174.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -59.83 -35.31 74.48 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 121.232 -0.187 . . . . 0.0 111.156 179.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.6 m -72.49 -41.33 66.1 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-O 119.588 -0.244 . . . . 0.0 111.235 178.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 55.3 mt -60.97 -29.62 69.77 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 119.459 -0.896 . . . . 0.0 108.955 174.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.8 -14.45 16.02 Favored Glycine 0 CA--C 1.533 1.159 0 CA-C-O 118.928 -0.929 . . . . 0.0 113.923 178.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -104.64 -3.73 23.39 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.261 1.531 . . . . 0.0 112.135 -178.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 35.5 m -123.61 -17.06 4.66 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.149 0 C-N-CA 122.784 0.433 . . . . 0.0 111.949 -178.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -48.3 -28.64 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -58.73 -59.05 6.03 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 117.917 0.326 . . . . 0.0 111.497 -178.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -70.97 -30.71 67.06 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 117.841 0.291 . . . . 0.0 110.711 -177.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.1 mp -63.02 -55.14 28.24 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.497 -0.287 . . . . 0.0 110.44 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 62.3 mt -71.36 -49.18 44.9 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 118.137 0.426 . . . . 0.0 110.965 -178.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 66.0 p -49.94 -52.04 36.5 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 119.003 -0.522 . . . . 0.0 112.327 178.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -72.53 -41.99 65.24 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 119.187 0.903 . . . . 0.0 111.709 -177.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.69 -41.76 82.29 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.575 0.625 . . . . 0.0 111.221 -178.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 10.5 mt -78.55 -35.14 18.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 118.822 0.737 . . . . 0.0 111.12 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.01 -30.14 70.63 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 120.316 -0.554 . . . . 0.0 111.119 -178.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.42 -19.89 48.89 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.141 0.576 . . . . 0.0 110.303 176.353 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 40.3 m -78.16 156.14 30.05 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -173.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.1 t-20 -88.75 176.48 7.06 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 169.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -55.65 -38.47 69.61 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.916 0.78 . . . . 0.0 111.433 -178.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -66.62 -43.51 84.57 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.662 -0.649 . . . . 0.0 111.01 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -72.74 -35.01 67.43 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 119.493 -0.289 . . . . 0.0 110.683 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -41.57 87.98 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 118.828 0.74 . . . . 0.0 109.139 172.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -66.45 -39.21 88.74 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.222 -178.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -61.81 -39.95 93.53 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 119.372 -0.347 . . . . 0.0 111.196 175.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.2 mt -73.36 -34.97 44.93 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.11 0 CA-C-N 118.437 0.562 . . . . 0.0 109.709 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -66.65 -39.32 88.17 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 122.224 -0.298 . . . . 0.0 110.52 177.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 25.6 ttt -64.19 -46.28 84.63 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 176.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.5 tt -55.88 -47.45 77.34 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.942 0.497 . . . . 0.0 110.663 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.1 mt -75.51 -30.9 59.96 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -177.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.6 t70 . . . . . 0 N--CA 1.45 -0.436 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 177.782 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo . . . . . 0 N--CA 1.454 -0.819 0 N-CA-C 110.251 -0.711 . . . . 0.0 110.251 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 31.9 t -66.57 137.96 57.14 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -146.5 141.22 26.84 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 122.813 0.445 . . . . 0.0 111.44 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 16.4 t -133.8 145.69 57.08 Favored Pre-proline 0 C--O 1.233 0.213 0 C-N-CA 123.617 0.767 . . . . 0.0 111.093 -175.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.32 1.98 2.17 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 123.476 2.784 . . . . 0.0 111.341 177.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 24.2 p . . . . . 0 CA--C 1.529 0.171 0 CA-C-O 118.711 -0.661 . . . . 0.0 112.011 176.649 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.444 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 19.1 t70 . . . . . 0 CA--C 1.535 0.39 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.444 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 17.5 t80 -55.77 -13.05 1.51 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.546 0.739 . . . . 0.0 111.557 177.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -52.93 -44.53 67.11 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.512 0.725 . . . . 0.0 110.94 177.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -58.13 -41.74 84.33 Favored 'General case' 0 C--O 1.227 -0.095 0 CA-C-N 118.542 0.61 . . . . 0.0 111.523 177.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -64.86 -53.17 50.95 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 118.166 0.439 . . . . 0.0 110.302 -178.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.1 t -61.69 -53.73 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -178.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.51 -32.31 68.71 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 123.236 0.614 . . . . 0.0 111.916 -178.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 55.7 m -72.59 -44.95 61.34 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 118.403 0.547 . . . . 0.0 110.444 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.9 tp -65.47 -32.45 74.08 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.115 0.416 . . . . 0.0 109.975 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -67.81 -45.64 74.17 Favored 'General case' 0 N--CA 1.458 -0.058 0 C-N-CA 123.876 0.871 . . . . 0.0 109.777 176.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.0 t -63.43 -27.9 69.6 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.225 176.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.25 -43.57 70.28 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 175.646 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt . . . . . 0 CA--C 1.53 0.202 0 C-N-CA 124.014 0.926 . . . . 0.0 112.359 -179.982 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.8 mm . . . . . 0 CA--C 1.532 0.285 0 CA-C-O 121.13 0.49 . . . . 0.0 111.082 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.3 t -57.98 132.74 54.35 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.785 0.434 . . . . 0.0 111.01 -178.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.89 -27.62 71.5 Favored Glycine 0 C--N 1.339 0.697 0 C-N-CA 123.582 0.61 . . . . 0.0 113.177 -175.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.432 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 39.6 t -59.08 -43.84 91.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 117.901 0.851 . . . . 0.0 111.515 -174.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -65.5 -42.32 92.27 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -179.199 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 52.9 mt -62.53 -41.34 91.64 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.2 mmtt -64.59 -35.68 81.76 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 119.327 -0.368 . . . . 0.0 111.383 -179.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.432 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -65.93 -46.25 78.91 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 118.712 0.687 . . . . 0.0 110.115 174.025 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.22 -56.28 23.53 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 121.237 -0.185 . . . . 0.0 110.627 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 77.3 p -58.13 -48.29 80.69 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 t -63.02 -44.0 97.16 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 120.084 -0.646 . . . . 0.0 111.389 -176.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -73.57 -22.48 60.05 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.652 0.66 . . . . 0.0 112.418 -178.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.82 -56.45 9.1 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 118.991 0.814 . . . . 0.0 109.172 168.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 55.7 mt -68.89 -15.84 63.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.157 0.983 . . . . 0.0 112.666 -175.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -59.81 -25.81 65.26 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.6 t-160 -150.23 -27.81 0.24 Allowed 'General case' 0 C--N 1.34 0.16 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -176.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 42.2 mm 45.21 74.18 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-O 121.815 0.817 . . . . 0.0 111.899 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -149.41 22.84 0.92 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.435 1.094 . . . . 0.0 109.61 179.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.531 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -147.7 39.54 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 124.69 1.196 . . . . 0.0 109.131 -170.413 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.33 -54.87 26.08 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -174.002 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 78.9 p -75.77 -27.06 57.9 Favored 'General case' 0 CA--C 1.521 -0.166 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -172.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.654 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -81.49 -43.83 18.26 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.146 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 36.7 mt -55.91 -53.5 37.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 171.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.0 mm -66.58 -47.87 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 CA-C-O 119.078 -0.487 . . . . 0.0 112.027 -176.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 73.6 m -59.15 -35.5 73.62 Favored 'General case' 0 C--O 1.23 0.054 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.153 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.3 tp -68.53 -43.49 76.62 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 119.17 -0.443 . . . . 0.0 112.055 -178.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 33.2 pt -74.03 -33.33 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 119.217 0.917 . . . . 0.0 112.265 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 97.1 mt -66.3 -50.32 68.99 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 177.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -57.86 -42.1 83.81 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.266 178.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -58.39 -41.09 84.08 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 175.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.585 ' CB ' ' HG ' ' A' ' 65' ' ' SER . 7.5 t -63.31 -46.22 87.73 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -178.527 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -80.47 -23.14 40.39 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -175.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.3 mt -84.87 -19.51 32.25 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 179.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 72.9 m -104.2 156.22 36.07 Favored Pre-proline 0 CA--C 1.534 0.339 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -170.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -50.74 176.36 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.537 1 C-N-CA 126.498 4.798 . . . . 0.0 115.997 175.067 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.441 ' HB2' ' HE3' ' A' ' 115' ' ' LYS . 10.4 p-10 -56.18 -49.61 73.53 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 125.905 1.682 . . . . 0.0 114.069 -174.019 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 52.8 m -62.75 -27.55 69.36 Favored 'General case' 0 CA--C 1.522 -0.101 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -81.95 -18.68 42.7 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 118.688 -0.673 . . . . 0.0 111.057 178.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -74.72 -40.2 61.44 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 119.381 0.991 . . . . 0.0 108.525 171.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 61.5 tp -64.35 -51.49 63.08 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 174.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.5 -36.82 90.81 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.765 -0.934 . . . . 0.0 110.765 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.585 ' HG ' ' CB ' ' A' ' 54' ' ' SER . 30.7 t -60.58 -48.4 81.94 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.976 0.388 . . . . 0.0 110.137 177.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 31.1 mt -59.88 -35.55 75.06 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 118.55 0.614 . . . . 0.0 111.357 178.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -67.68 -37.23 82.04 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.117 0.872 . . . . 0.0 110.789 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 66.8 mt -70.31 -47.97 63.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 O-C-N 121.683 -0.635 . . . . 0.0 110.219 178.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 85.6 mt -59.98 -38.85 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 C-N-CA 123.993 0.917 . . . . 0.0 109.279 178.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -65.99 -42.97 89.12 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 118.787 -0.625 . . . . 0.0 110.555 178.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.6 t -65.66 -54.6 25.37 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.621 0.646 . . . . 0.0 111.74 -177.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 55.8 mt -62.82 -33.48 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.18 -50.99 41.53 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-O 119.612 -0.549 . . . . 0.0 112.451 -179.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.623 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -70.82 -33.6 70.85 Favored 'General case' 0 CA--C 1.523 -0.07 0 CA-C-N 118.184 0.992 . . . . 0.0 110.72 -178.475 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.79 -44.49 77.26 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 177.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -62.83 -47.02 85.23 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 176.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.5 tp -57.42 -46.57 83.37 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 123.38 0.425 . . . . 0.0 110.379 -176.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -68.61 -44.45 74.27 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.094 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -68.9 -21.65 64.22 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -176.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 6.9 t -96.55 -28.01 14.58 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-N 118.675 0.67 . . . . 0.0 111.978 178.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 . . . . . 0 C--N 1.341 0.215 0 CA-C-N 118.657 0.662 . . . . 0.0 111.58 176.555 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.227 -0.094 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 23.1 p -50.29 -32.03 15.89 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.058 1.343 . . . . 0.0 113.758 -172.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.14 -48.04 81.87 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.648 0.658 . . . . 0.0 109.973 176.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -75.34 -21.42 58.39 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.586 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.0 -44.88 83.49 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.2 mt -64.26 -43.7 97.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 174.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -58.97 -33.74 70.99 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.48 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.8 m -73.75 -42.6 60.88 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-O 119.301 -0.381 . . . . 0.0 110.887 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 56.8 mt -60.83 -29.55 69.56 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-N 119.053 0.842 . . . . 0.0 109.233 174.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.21 -14.31 25.17 Favored Glycine 0 CA--C 1.531 1.038 0 CA-C-O 119.104 -0.831 . . . . 0.0 113.635 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.8 -4.58 27.72 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.873 1.337 . . . . 0.0 112.044 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.0 m -126.18 -18.44 2.97 Favored 'Isoleucine or valine' 0 C--N 1.337 0.056 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -178.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.0 tp -49.62 -27.84 3.33 Favored 'Isoleucine or valine' 0 C--N 1.339 0.15 0 C-N-CA 123.753 0.821 . . . . 0.0 112.293 -175.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.9 pt20 -61.97 -49.69 75.1 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 117.764 0.256 . . . . 0.0 110.709 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -70.12 -36.51 74.86 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 -177.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.5 mt -63.81 -53.41 51.26 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.612 -177.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 65.2 mt -66.05 -64.41 0.86 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.536 -0.745 . . . . 0.0 109.358 177.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 84.6 p -39.91 -49.69 2.44 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -71.66 -44.41 64.33 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 119.496 1.044 . . . . 0.0 111.404 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.13 -43.02 82.0 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.717 0.689 . . . . 0.0 110.874 -178.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -76.88 -32.92 20.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 CA-C-N 119.01 0.823 . . . . 0.0 111.953 178.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.95 -30.05 68.41 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.34 0.518 . . . . 0.0 110.902 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.441 ' HE3' ' HB2' ' A' ' 59' ' ' ASP . 0.8 OUTLIER -77.62 -19.46 55.47 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.328 0.651 . . . . 0.0 110.227 175.577 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 56.0 m -81.29 153.96 26.81 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -173.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -92.35 177.61 6.09 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 170.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -55.36 -36.33 66.21 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.001 0.819 . . . . 0.0 111.608 -177.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -67.27 -47.13 71.58 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.779 -0.576 . . . . 0.0 110.382 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -70.11 -33.48 71.9 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 119.474 -0.298 . . . . 0.0 110.519 -179.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -42.25 93.21 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 118.591 0.632 . . . . 0.0 109.325 173.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -66.44 -40.25 89.37 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.149 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp -61.74 -43.83 98.08 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 119.661 -0.209 . . . . 0.0 110.996 176.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 95.6 mt -69.81 -38.38 75.77 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -63.95 -40.89 97.48 Favored 'General case' 0 CA--C 1.523 -0.091 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 60.9 ttp -63.27 -43.92 96.58 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 177.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 8.2 tt -58.76 -45.01 90.73 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 97.1 mt -73.19 -32.9 65.09 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.4 t70 . . . . . 0 N--CA 1.458 -0.051 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 177.455 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 160' ' ' PRO . . . . . 0.524 ' HG2' ' H ' ' B' ' 161' ' ' SER . 59.4 Cg_endo . . . . . 0 N--CA 1.453 -0.902 0 N-CA-C 110.868 -0.474 . . . . 0.0 110.868 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 161' ' ' SER . . . . . 0.524 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 34.2 t -175.53 168.3 3.21 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 125.14 1.376 . . . . 0.0 108.079 178.369 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 162' ' ' TYR . . . . . 0.415 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 48.4 t80 -152.02 132.92 14.17 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.187 -0.321 . . . . 0.0 111.804 171.551 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.1 t -135.29 140.98 36.07 Favored Pre-proline 0 N--CA 1.455 -0.224 0 C-N-CA 123.181 0.592 . . . . 0.0 110.791 177.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -65.71 -6.56 14.22 Favored 'Trans proline' 0 N--CA 1.45 -1.052 0 C-N-CA 122.734 2.29 . . . . 0.0 111.302 177.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 71.1 p . . . . . 0 C--O 1.233 0.2 0 N-CA-C 113.345 0.868 . . . . 0.0 113.345 -177.73 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.473 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 14.1 t70 . . . . . 0 CA--C 1.535 0.382 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.473 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 10.6 t80 -55.59 -14.49 2.15 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.863 0.865 . . . . 0.0 111.297 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -55.27 -35.25 64.83 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.908 0.883 . . . . 0.0 111.485 176.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.6 m-20 -61.82 -45.46 93.72 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.359 0.981 . . . . 0.0 109.292 178.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -66.18 -48.39 70.87 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 110.557 -0.164 . . . . 0.0 110.557 -177.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.6 t -65.92 -54.67 24.82 Favored 'Isoleucine or valine' 0 C--N 1.339 0.118 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 -178.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.59 -31.76 69.76 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.828 0.451 . . . . 0.0 111.737 -178.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 69.5 m -73.63 -40.35 63.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 120.214 -0.595 . . . . 0.0 110.336 176.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.9 tp -66.28 -31.86 72.93 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.009 0.433 . . . . 0.0 109.852 179.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -69.74 -44.19 70.78 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.787 0.835 . . . . 0.0 109.683 175.155 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.2 t -63.26 -26.06 68.61 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 175.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.432 ' CE2' HD13 ' A' ' 68' ' ' ILE . 0.2 OUTLIER -71.19 -45.81 62.61 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 174.992 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt . . . . . 0 N--CA 1.455 -0.199 0 C-N-CA 122.865 0.466 . . . . 0.0 110.783 177.454 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.8 mt . . . . . 0 CA--C 1.53 0.205 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.5 m -139.3 123.88 18.38 Favored 'General case' 0 CA--C 1.523 -0.093 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 176.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.14 -26.96 73.35 Favored Glycine 0 CA--C 1.525 0.714 0 CA-C-O 119.489 -0.617 . . . . 0.0 112.682 -174.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.414 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 83.4 p -65.28 -35.22 80.34 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 118.398 1.099 . . . . 0.0 109.87 -179.173 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.6 mmt-85 -68.08 -46.0 72.23 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 73.0 mt -60.87 -36.38 71.29 Favored 'Isoleucine or valine' 0 C--O 1.231 0.1 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.9 mmtt -69.26 -40.86 77.58 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 119.009 -0.52 . . . . 0.0 111.504 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.39 -38.48 87.61 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.188 0.904 . . . . 0.0 110.953 176.153 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.7 mt -63.32 -57.84 9.06 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 122.161 0.184 . . . . 0.0 110.797 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.4 HG21 ' HB2' ' A' ' 71' ' ' SER . 33.4 p -56.27 -42.12 76.95 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 118.074 0.397 . . . . 0.0 111.272 177.028 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.0 m -55.65 -55.08 36.38 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 119.01 -0.519 . . . . 0.0 110.913 -179.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -67.86 -37.18 81.5 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.326 -0.949 . . . . 0.0 111.584 -176.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.404 ' HB3' ' HH ' ' A' ' 76' ' ' TYR . . . -57.09 -58.66 7.22 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 118.063 0.392 . . . . 0.0 110.978 177.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.2 mp -67.95 -25.09 65.28 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -178.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -71.71 -19.15 62.1 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 117.857 0.299 . . . . 0.0 111.091 176.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -146.74 52.83 1.1 Allowed 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.36 0.264 . . . . 0.0 111.456 -175.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 33.3 mm -65.06 76.18 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-O 121.757 0.789 . . . . 0.0 109.908 171.133 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -144.13 10.96 1.53 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.597 1.559 . . . . 0.0 109.063 174.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.453 HG21 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -146.15 95.26 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 C-N-CA 125.68 1.592 . . . . 0.0 107.935 -176.572 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.581 ' CD ' ' H ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -91.76 -79.27 0.38 Allowed 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -177.18 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.581 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 46.1 m -57.72 -21.31 40.14 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 123.554 0.741 . . . . 0.0 112.96 -174.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.509 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -76.02 -54.07 7.41 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.349 0.659 . . . . 0.0 110.346 178.632 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 6.2 mt -56.36 -44.25 79.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 173.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.5 mm -67.14 -47.38 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.166 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.082 -179.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 42.7 t -58.95 -34.49 71.83 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-N 118.406 0.548 . . . . 0.0 109.968 178.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.9 tp -68.71 -45.42 71.64 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.811 -179.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.9 pt -72.3 -34.93 50.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 119.415 1.007 . . . . 0.0 112.183 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.3 mt -64.55 -51.71 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 178.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -64.91 -27.92 69.18 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.078 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -61.94 -46.81 87.68 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 175.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.7 t -61.86 -38.8 89.63 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.39 175.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -61.24 -42.77 99.19 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.621 0.769 . . . . 0.0 112.602 -176.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 83.7 mt -86.23 -14.76 42.9 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 -175.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.417 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 76.0 m -105.21 155.74 37.31 Favored Pre-proline 0 CA--C 1.533 0.309 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -170.569 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.417 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 92.3 Cg_endo -69.17 -176.44 1.32 Allowed 'Trans proline' 0 N--CA 1.459 -0.532 1 C-N-CA 125.431 4.088 . . . . 0.0 113.142 -178.882 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -54.82 -44.32 73.75 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.382 1.473 . . . . 0.0 113.98 -171.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.0 m -58.03 -29.32 65.25 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -92.86 -14.48 27.63 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 118.892 -0.575 . . . . 0.0 111.672 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -65.85 -49.0 69.73 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 169.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 44.5 tp -67.74 -48.21 67.1 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.346 179.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -56.84 -43.64 92.27 Favored Glycine 0 C--N 1.337 0.598 0 N-CA-C 110.73 -0.948 . . . . 0.0 110.73 179.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.2 t -67.5 -35.46 79.18 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.699 -0.667 . . . . 0.0 110.91 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 35.9 mt -60.9 -34.58 74.87 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 119.649 1.113 . . . . 0.0 110.66 173.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -71.67 -32.47 67.91 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.887 0.767 . . . . 0.0 111.347 175.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.432 HD13 ' CE2' ' A' ' 17' ' ' PHE . 92.6 mt -70.7 -44.07 76.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 CA-C-N 118.798 0.726 . . . . 0.0 110.413 176.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.1 mt -63.65 -35.41 72.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 177.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -70.07 -39.49 75.6 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 119.057 -0.496 . . . . 0.0 111.252 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.4 ' HB2' HG21 ' A' ' 33' ' ' THR . 95.8 p -69.72 -55.33 10.23 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 118.907 0.776 . . . . 0.0 110.5 -176.418 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 39.3 mt -64.75 -33.42 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.42 -52.21 45.59 Favored Glycine 0 CA--C 1.524 0.622 0 CA-C-O 119.846 -0.419 . . . . 0.0 112.239 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.639 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -72.06 -31.24 65.94 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 118.061 0.931 . . . . 0.0 111.115 -178.703 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.49 -41.89 72.08 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 177.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.404 ' HH ' ' HB3' ' A' ' 36' ' ' ALA . 6.6 m-30 -62.84 -48.49 78.82 Favored 'General case' 0 CA--C 1.519 -0.22 0 O-C-N 122.153 -0.342 . . . . 0.0 110.094 175.052 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 55.1 tp -58.04 -44.03 87.18 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 123.312 0.383 . . . . 0.0 110.277 -176.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -66.12 -46.02 79.06 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 110.598 -0.149 . . . . 0.0 110.598 179.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -64.39 -34.8 79.0 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -176.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.4 t -85.93 -23.7 26.86 Favored 'General case' 0 CA--C 1.527 0.082 0 CA-C-N 118.147 0.43 . . . . 0.0 112.022 -178.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.5 tpp180 . . . . . 0 C--O 1.232 0.157 0 CA-C-N 118.328 0.513 . . . . 0.0 112.003 176.852 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.296 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.6 p -52.53 -29.08 23.41 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -175.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.65 -44.57 85.97 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 118.842 0.746 . . . . 0.0 109.802 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -67.58 -30.44 70.05 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 120.99 0.424 . . . . 0.0 110.041 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.5 -43.63 80.42 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.344 -178.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.0 mt -63.66 -43.06 97.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 108.741 -0.836 . . . . 0.0 108.741 173.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -60.71 -32.76 71.99 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-O 120.572 0.225 . . . . 0.0 110.774 178.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.9 m -74.18 -40.25 62.65 Favored 'General case' 0 C--N 1.338 0.087 0 O-C-N 121.851 -0.531 . . . . 0.0 110.837 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 44.2 mt -61.56 -30.67 70.81 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 119.637 -0.825 . . . . 0.0 108.884 172.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.12 -14.6 18.7 Favored Glycine 0 CA--C 1.531 1.065 0 CA-C-O 119.027 -0.874 . . . . 0.0 114.019 178.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -102.48 -3.87 26.24 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 118.921 1.36 . . . . 0.0 112.307 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.8 m -123.9 -18.98 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.2 tp -49.99 -27.46 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 123.846 0.859 . . . . 0.0 112.796 -178.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -63.38 -46.54 86.02 Favored 'General case' 0 N--CA 1.453 -0.289 0 O-C-N 122.008 -0.433 . . . . 0.0 110.988 178.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -74.26 -39.04 63.27 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -178.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 97.1 mt -62.4 -51.02 69.22 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.419 -177.209 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 78.5 mt -66.3 -59.15 3.99 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.391 -0.814 . . . . 0.0 109.806 177.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.1 p -48.5 -46.04 37.85 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.526 1.057 . . . . 0.0 112.361 -175.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 -70.97 -45.57 63.85 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 119.192 0.906 . . . . 0.0 111.0 179.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.93 -37.83 74.8 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 119.02 -0.514 . . . . 0.0 112.035 -178.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -82.51 -32.29 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.154 0 C-N-CA 119.312 -0.955 . . . . 0.0 111.888 176.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.9 -29.45 66.64 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.469 -179.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.9 -16.56 53.26 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 122.853 0.461 . . . . 0.0 110.754 176.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 15.7 m -77.52 157.91 30.17 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -172.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -95.02 178.7 5.47 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 169.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -55.66 -39.58 71.1 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.64 -0.663 . . . . 0.0 111.949 -177.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -69.84 -37.25 76.12 Favored 'General case' 0 N--CA 1.456 -0.154 0 O-C-N 121.792 -0.567 . . . . 0.0 110.842 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -77.0 -39.15 51.44 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.169 -0.444 . . . . 0.0 111.322 -176.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.66 -34.35 78.0 Favored 'General case' 0 CA--C 1.522 -0.118 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 174.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -63.42 -45.06 92.72 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.478 176.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -61.95 -41.25 97.76 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.994 0.361 . . . . 0.0 111.436 177.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 95.6 mt -68.04 -40.58 83.37 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.117 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.6 tmm_? -62.51 -43.2 99.39 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 178.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -61.61 -45.68 93.04 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.387 0.675 . . . . 0.0 110.681 179.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.0 tt -60.49 -46.23 90.89 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.462 0.305 . . . . 0.0 110.458 177.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 98.1 mt -69.19 -29.98 68.07 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 119.796 -0.145 . . . . 0.0 111.363 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 29.1 t70 . . . . . 0 N--CA 1.453 -0.276 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 177.215 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 160' ' ' PRO . . . . . 0.414 ' HD2' ' N ' ' A' ' 27' ' ' SER . 67.1 Cg_endo . . . . . 0 N--CA 1.455 -0.785 0 N-CA-C 109.167 -1.128 . . . . 0.0 109.167 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 79.5 p -63.46 152.78 37.41 Favored 'General case' 0 N--CA 1.455 -0.186 0 O-C-N 121.983 -0.448 . . . . 0.0 110.451 179.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 162' ' ' TYR . . . . . 0.469 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 10.1 t80 -141.78 136.99 31.25 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.41 0.284 . . . . 0.0 111.439 -178.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 31.3 t -133.15 143.96 50.62 Favored Pre-proline 0 N--CA 1.455 -0.214 0 C-N-CA 123.262 0.625 . . . . 0.0 110.815 178.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -58.6 -11.29 11.07 Favored 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 123.251 2.634 . . . . 0.0 112.653 173.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 69.9 p . . . . . 0 CA--C 1.529 0.153 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.199 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.485 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 17.5 t70 . . . . . 0 CA--C 1.535 0.394 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.485 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 10.9 t80 -55.34 -15.1 2.22 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 121.712 -0.618 . . . . 0.0 111.386 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -55.27 -36.39 66.06 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 123.392 0.677 . . . . 0.0 110.681 175.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 42.9 m-20 -66.55 -44.86 81.21 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 118.952 0.796 . . . . 0.0 109.999 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -65.95 -47.85 73.3 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 117.903 0.32 . . . . 0.0 110.719 -176.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 98.6 t -65.27 -55.57 19.66 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -179.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.64 -31.07 65.91 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -178.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 62.3 m -74.6 -42.01 59.42 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 118.11 0.414 . . . . 0.0 111.051 177.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.7 tp -67.62 -31.08 70.86 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -68.76 -42.34 77.63 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.852 0.861 . . . . 0.0 109.653 174.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.0 t -62.84 -29.36 70.68 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 174.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.401 ' CD2' ' HB3' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -72.75 -36.61 67.74 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.182 0.193 . . . . 0.0 110.538 176.232 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt . . . . . 0 CA--C 1.529 0.161 0 C-N-CA 122.435 0.294 . . . . 0.0 110.217 175.653 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.2 mm . . . . . 0 CA--C 1.528 0.098 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.8 m -136.84 138.07 40.4 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.806 0.336 . . . . 0.0 110.588 179.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.76 -21.55 65.35 Favored Glycine 0 CA--C 1.523 0.538 0 CA-C-O 119.11 -0.828 . . . . 0.0 112.751 -178.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 59.6 p -66.19 -45.67 80.0 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.838 1.319 . . . . 0.0 110.907 -175.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.401 ' HB3' ' CD2' ' A' ' 17' ' ' PHE . 8.4 mpt_? -68.06 -41.47 81.95 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 74.3 mt -61.68 -39.49 83.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.2 mmtt -63.57 -45.55 89.92 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.556 0.742 . . . . 0.0 110.759 179.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.59 -39.09 91.21 Favored 'General case' 0 C--N 1.339 0.125 0 CA-C-N 118.226 0.466 . . . . 0.0 111.715 179.325 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 93.0 mt -65.79 -53.86 34.71 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 119.408 -0.33 . . . . 0.0 111.249 -179.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.419 HG21 ' HB2' ' A' ' 71' ' ' SER . 41.1 p -57.81 -41.25 81.79 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 118.491 0.587 . . . . 0.0 110.959 177.056 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.1 m -55.85 -57.78 10.63 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.307 179.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -68.67 -31.29 70.3 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 118.993 -1.083 . . . . 0.0 111.777 -175.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.84 -59.2 5.59 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.304 0.502 . . . . 0.0 109.739 174.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.7 mp -72.06 -14.35 61.84 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -177.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -57.76 -26.73 62.27 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -179.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -151.97 -24.4 0.18 Allowed 'General case' 0 C--N 1.339 0.135 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -177.288 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 25.8 mm 44.2 73.06 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-O 121.708 0.766 . . . . 0.0 111.186 -177.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -147.89 22.19 1.11 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.936 0.894 . . . . 0.0 109.556 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.558 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.3 pt -148.51 35.46 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 C-N-CA 124.562 1.145 . . . . 0.0 109.354 -170.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.416 ' N ' ' CD ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -50.99 -55.5 17.05 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 123.887 0.875 . . . . 0.0 113.262 -176.015 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 57.5 p -75.61 -28.32 58.82 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -173.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.641 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -79.51 -45.82 18.59 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -179.833 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 14.8 mt -55.69 -50.26 68.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 118.019 0.372 . . . . 0.0 110.169 172.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 12.9 mm -66.74 -50.2 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.225 0 CA-C-O 119.341 -0.361 . . . . 0.0 111.894 -176.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.4 m -57.07 -34.28 68.12 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 118.962 0.801 . . . . 0.0 110.491 178.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.3 tp -70.06 -45.02 67.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -179.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 38.2 pt -72.01 -32.57 44.37 Favored 'Isoleucine or valine' 0 C--N 1.341 0.202 0 CA-C-N 119.472 1.033 . . . . 0.0 111.848 -179.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 92.7 mt -66.53 -48.46 80.42 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -63.8 -25.81 68.34 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.876 177.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -66.37 -43.57 85.6 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 173.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.593 ' HG ' ' CB ' ' A' ' 65' ' ' SER . 17.5 m -59.36 -38.07 79.48 Favored 'General case' 0 C--N 1.341 0.229 0 O-C-N 122.15 -0.344 . . . . 0.0 110.645 174.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -68.17 -43.17 78.79 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.35 1.06 . . . . 0.0 112.859 -177.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 73.4 mt -89.55 -15.26 33.3 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -173.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 86.2 m -104.11 159.13 30.33 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -171.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -57.11 177.45 0.19 Allowed 'Trans proline' 0 N--CA 1.46 -0.468 1 C-N-CA 125.524 4.149 . . . . 0.0 115.071 179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.429 ' HB3' ' HE3' ' A' ' 115' ' ' LYS . 72.3 m-20 -58.06 -47.26 83.68 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.19 1.396 . . . . 0.0 112.873 -178.024 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.9 m -60.06 -25.14 65.13 Favored 'General case' 0 N--CA 1.457 -0.096 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 6.2 m80 -86.92 -14.8 40.81 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.707 -0.663 . . . . 0.0 111.172 178.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -72.87 -43.53 62.45 Favored 'General case' 0 C--N 1.342 0.245 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 170.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.2 tp -65.61 -45.4 83.28 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.869 174.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.93 -42.37 98.22 Favored Glycine 0 C--N 1.336 0.534 0 N-CA-C 111.294 -0.723 . . . . 0.0 111.294 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.593 ' CB ' ' HG ' ' A' ' 54' ' ' SER . 89.3 p -67.18 -35.55 79.88 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 117.623 0.712 . . . . 0.0 110.292 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 33.7 mt -60.65 -39.01 86.75 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 119.267 -0.973 . . . . 0.0 110.285 173.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -67.31 -35.72 80.01 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.476 1.035 . . . . 0.0 111.772 176.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 87.2 mt -69.03 -45.68 79.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 O-C-N 121.705 -0.622 . . . . 0.0 111.144 176.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 72.9 mt -63.24 -32.94 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 C-N-CA 123.619 0.768 . . . . 0.0 109.263 177.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -71.42 -40.43 70.46 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.188 0.595 . . . . 0.0 110.44 177.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.419 ' HB2' HG21 ' A' ' 33' ' ' THR . 98.6 p -69.45 -54.37 14.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 119.165 0.893 . . . . 0.0 110.523 -177.336 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 39.7 mt -65.07 -33.83 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 117.76 0.255 . . . . 0.0 110.555 176.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.57 -53.01 38.01 Favored Glycine 0 C--N 1.337 0.626 0 N-CA-C 111.909 -0.476 . . . . 0.0 111.909 -179.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.3 mtp-105 -66.49 -36.13 81.98 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 117.308 0.554 . . . . 0.0 110.445 178.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.45 -45.95 81.79 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 178.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.8 m-30 -62.94 -44.87 94.89 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 175.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.1 tp -55.96 -44.89 78.92 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 -177.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -69.64 -39.98 76.8 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.806 178.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -70.26 -15.02 62.85 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -178.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.6 t -107.48 -19.09 13.68 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.876 0.762 . . . . 0.0 111.928 173.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 . . . . . 0 C--N 1.34 0.193 0 C-N-CA 123.026 0.53 . . . . 0.0 111.697 177.72 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.262 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.8 p -50.49 -29.49 10.59 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -176.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.22 -45.73 86.95 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.851 0.75 . . . . 0.0 109.872 175.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 27.8 m80 -68.4 -28.6 67.24 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.311 177.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.25 -46.26 81.26 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 178.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 95.0 mt -63.32 -42.73 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.077 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 175.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -61.81 -33.0 73.35 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 122.359 -0.213 . . . . 0.0 111.261 179.115 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.8 m -74.35 -41.09 61.63 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.552 -0.261 . . . . 0.0 110.96 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 45.5 mt -60.87 -31.05 70.52 Favored 'General case' 0 C--O 1.226 -0.158 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 173.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.8 -14.4 9.89 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-O 119.021 -0.877 . . . . 0.0 113.813 178.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -103.41 -4.93 23.44 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.177 1.488 . . . . 0.0 112.371 -179.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 32.4 m -123.18 -18.18 4.43 Favored 'Isoleucine or valine' 0 C--N 1.339 0.141 0 C-N-CA 122.824 0.45 . . . . 0.0 111.964 -179.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.8 tp -50.94 -25.2 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 C-N-CA 123.984 0.913 . . . . 0.0 112.601 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -64.86 -49.15 71.67 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 118.079 0.399 . . . . 0.0 111.52 178.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -69.6 -39.85 77.0 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 -177.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 10.7 mp -66.33 -50.91 61.98 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.189 -176.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 65.8 mt -63.99 -60.75 2.87 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 118.767 -0.635 . . . . 0.0 109.78 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 89.4 p -54.88 -41.91 71.45 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 118.622 -1.231 . . . . 0.0 112.318 -172.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -69.79 -40.68 75.86 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-N 119.413 1.006 . . . . 0.0 111.385 178.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.34 -42.62 96.06 Favored 'General case' 0 N--CA 1.457 -0.102 0 CA-C-N 118.531 0.605 . . . . 0.0 110.618 -179.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -38.57 53.53 Favored 'Isoleucine or valine' 0 C--N 1.338 0.093 0 C-N-CA 120.003 -0.679 . . . . 0.0 111.636 178.58 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.99 -25.36 66.27 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 119.607 -0.837 . . . . 0.0 110.094 178.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.429 ' HE3' ' HB3' ' A' ' 59' ' ' ASP . 7.8 tmtt? -75.32 -23.12 57.25 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 125.018 1.327 . . . . 0.0 111.144 175.401 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 55.7 p -86.14 159.68 19.46 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -170.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.7 p30 -102.33 -175.02 2.71 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 170.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -55.75 -39.01 70.57 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.996 0.816 . . . . 0.0 112.445 -177.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -70.73 -46.4 63.1 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 121.54 -0.725 . . . . 0.0 110.45 -178.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 35.9 m170 -72.37 -32.49 66.48 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 119.106 -0.474 . . . . 0.0 111.257 -178.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -37.65 82.79 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 176.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -62.67 -41.94 99.35 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 110.248 -0.279 . . . . 0.0 110.248 177.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -61.79 -41.5 97.81 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 117.827 0.285 . . . . 0.0 111.072 176.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.5 mt -69.51 -39.02 78.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 CA-C-N 118.004 0.366 . . . . 0.0 110.196 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 37.9 ttt180 -63.86 -40.74 97.27 Favored 'General case' 0 C--O 1.23 0.068 0 C-N-CA 122.56 0.344 . . . . 0.0 110.47 178.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 16.0 tmm? -68.01 -41.97 81.38 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 122.701 0.4 . . . . 0.0 110.253 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.1 tt -60.34 -43.62 96.27 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 176.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 86.2 mt -70.8 -30.27 66.68 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 119.524 -0.274 . . . . 0.0 111.468 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.6 t70 . . . . . 0 N--CA 1.452 -0.342 0 CA-C-N 118.334 0.515 . . . . 0.0 109.96 177.007 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 160' ' ' PRO . . . . . 0.5 ' HG2' ' H ' ' B' ' 161' ' ' SER . 58.6 Cg_endo . . . . . 0 N--CA 1.456 -0.687 0 N-CA-C 110.452 -0.634 . . . . 0.0 110.452 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 161' ' ' SER . . . . . 0.5 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 36.8 t -171.55 141.13 1.46 Allowed 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.695 1.198 . . . . 0.0 108.415 174.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -156.54 133.31 10.26 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 118.362 0.528 . . . . 0.0 112.12 174.117 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 25.8 t -134.67 144.63 51.53 Favored Pre-proline 0 N--CA 1.454 -0.228 0 C-N-CA 123.765 0.826 . . . . 0.0 110.76 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -66.65 -1.62 6.12 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.257 2.638 . . . . 0.0 111.638 177.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 34.9 p . . . . . 0 C--N 1.338 0.093 0 O-C-N 121.845 -0.534 . . . . 0.0 112.042 177.804 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 32.8 t70 . . . . . 0 CA--C 1.531 0.232 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -57.11 -17.81 12.21 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.109 0.413 . . . . 0.0 111.196 176.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.4 tp60 -56.61 -45.31 81.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.218 -0.42 . . . . 0.0 110.31 175.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -57.51 -39.98 77.71 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.306 176.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -64.35 -54.04 39.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.888 0.767 . . . . 0.0 110.766 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 59.4 t -63.5 -50.44 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.179 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 -178.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.72 -32.26 69.03 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 123.268 0.627 . . . . 0.0 111.432 -179.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 52.3 m -72.27 -43.91 63.6 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 122.025 -0.422 . . . . 0.0 110.145 176.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 21.0 tp -64.73 -29.33 70.31 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 120.426 -0.51 . . . . 0.0 109.999 179.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -70.44 -41.81 72.35 Favored 'General case' 0 C--N 1.338 0.074 0 C-N-CA 123.667 0.787 . . . . 0.0 110.57 175.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.9 p -63.96 -29.0 70.2 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.067 174.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -33.41 63.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.316 0.647 . . . . 0.0 110.241 174.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt . . . . . 0 C--N 1.339 0.123 0 C-N-CA 123.384 0.674 . . . . 0.0 110.514 178.291 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.4 mm . . . . . 0 CA--C 1.533 0.306 0 CA-C-O 120.8 0.333 . . . . 0.0 110.699 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.0 t -59.5 137.73 57.92 Favored 'General case' 0 C--O 1.23 0.073 0 CA-C-O 120.968 0.413 . . . . 0.0 111.719 -175.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.95 -23.1 67.3 Favored Glycine 0 CA--C 1.526 0.721 0 CA-C-O 119.27 -0.739 . . . . 0.0 113.715 -173.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.467 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 38.5 t -59.01 -40.82 86.12 Favored 'General case' 0 N--CA 1.458 -0.065 0 CA-C-N 118.658 1.229 . . . . 0.0 110.633 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -69.45 -39.05 78.01 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -178.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 69.4 mt -65.61 -36.19 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -69.17 -36.06 76.97 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 119.459 -0.305 . . . . 0.0 111.369 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.467 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -65.85 -44.48 85.37 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 118.332 0.514 . . . . 0.0 110.342 174.626 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.7 mt -62.56 -52.33 63.86 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 122.291 -0.256 . . . . 0.0 110.957 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.404 HG22 ' HB2' ' A' ' 71' ' ' SER . 27.3 p -59.77 -50.72 72.7 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 118.413 0.552 . . . . 0.0 111.936 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.3 t -61.26 -45.13 95.76 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 120.092 -0.643 . . . . 0.0 111.623 -174.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -75.63 -21.46 57.7 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -178.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.06 -57.12 8.45 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 119.172 0.897 . . . . 0.0 109.031 167.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.3 mp -69.05 -14.75 63.21 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -177.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -64.94 -16.83 63.78 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.991 0.814 . . . . 0.0 113.065 178.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -140.4 -41.63 0.42 Allowed 'General case' 0 C--N 1.34 0.185 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -178.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 44.8 mm 43.06 67.0 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-O 122.352 1.072 . . . . 0.0 111.07 -172.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -147.34 20.65 1.21 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 114.709 -1.132 . . . . 0.0 108.865 179.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.607 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.38 33.85 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 C-N-CA 125.157 1.383 . . . . 0.0 109.456 -171.471 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.485 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.3 OUTLIER -49.57 -55.64 12.77 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -177.131 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 83.6 p -75.38 -24.73 57.28 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -173.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.607 ' HE2' ' HA ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -84.95 -42.72 14.68 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 -179.511 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 30.8 mt -56.21 -52.82 46.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 118.277 0.489 . . . . 0.0 109.752 171.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 15.4 mm -66.17 -48.94 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 CA-C-O 119.335 -0.364 . . . . 0.0 111.643 -177.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.0 t -56.53 -37.15 70.08 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 119.891 -0.724 . . . . 0.0 110.101 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.3 tp -70.55 -40.19 73.51 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 118.624 -0.703 . . . . 0.0 112.782 -177.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.8 pt -73.67 -37.52 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 119.775 1.17 . . . . 0.0 111.965 178.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 93.9 mt -63.4 -49.2 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.099 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -59.41 -41.43 89.48 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.855 177.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -55.73 -40.12 72.04 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 176.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.6 t -68.0 -53.63 24.53 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 179.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -68.63 -24.6 64.58 Favored 'General case' 0 C--O 1.228 -0.074 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -172.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 47.1 mt -80.56 -15.89 55.54 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 83.1 m -121.74 164.26 26.07 Favored Pre-proline 0 CA--C 1.536 0.426 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -169.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_exo -55.57 -177.83 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.407 1 C-N-CA 126.001 4.467 . . . . 0.0 116.072 -179.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -56.19 -40.44 73.97 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 125.611 1.565 . . . . 0.0 113.427 -176.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 74.9 m -61.5 -23.1 65.67 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 19.3 m80 -87.59 -23.63 24.24 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 118.906 -0.568 . . . . 0.0 110.928 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -67.18 -42.21 84.61 Favored 'General case' 0 C--N 1.343 0.321 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 169.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.7 tp -66.84 -51.99 48.92 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 120.915 0.388 . . . . 0.0 110.365 177.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.43 -39.65 90.91 Favored Glycine 0 C--N 1.336 0.574 0 N-CA-C 110.246 -1.142 . . . . 0.0 110.246 178.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 40.1 t -63.24 -45.65 90.6 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 117.483 0.641 . . . . 0.0 110.767 178.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 33.9 mt -57.93 -38.2 75.5 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 118.854 0.752 . . . . 0.0 111.403 178.146 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -74.45 -31.51 62.29 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 119.492 -0.883 . . . . 0.0 112.16 178.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 81.0 mt -73.47 -41.65 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 118.92 0.782 . . . . 0.0 110.669 176.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.8 mt -62.71 -40.06 87.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 176.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -66.8 -42.77 85.42 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 119.278 -0.391 . . . . 0.0 110.959 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.404 ' HB2' HG22 ' A' ' 33' ' ' THR . 84.1 p -66.93 -56.52 9.88 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 118.338 0.517 . . . . 0.0 111.148 -174.789 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 38.3 mt -65.19 -31.17 52.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 176.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.89 -52.92 37.64 Favored Glycine 0 CA--C 1.522 0.489 0 CA-C-O 119.751 -0.471 . . . . 0.0 112.191 -179.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.647 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -72.28 -31.1 65.44 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 117.992 0.896 . . . . 0.0 110.824 -179.242 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.74 -46.61 74.87 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 176.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -62.32 -45.23 94.15 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 175.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -57.34 -43.08 83.12 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -178.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -67.16 -41.17 86.45 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 121.38 -0.128 . . . . 0.0 110.902 178.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -64.58 -40.41 95.48 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 119.51 -0.281 . . . . 0.0 111.227 -178.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.3 t -82.78 -18.85 39.14 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 118.192 0.451 . . . . 0.0 111.496 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 56.6 ttp180 . . . . . 0 N--CA 1.455 -0.194 0 O-C-N 122.078 -0.389 . . . . 0.0 110.417 171.78 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.195 0 CA-C-O 119.718 -0.182 . . . . 0.0 110.528 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 26.7 p -47.91 -32.64 6.57 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 -176.204 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.76 -46.9 80.2 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.582 -0.699 . . . . 0.0 110.137 176.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 67.2 m80 -67.24 -28.78 68.33 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.299 0.639 . . . . 0.0 110.202 177.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.22 -45.45 80.64 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 122.434 0.294 . . . . 0.0 110.546 177.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 93.3 mt -62.89 -42.41 96.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 175.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -61.48 -33.69 74.2 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.779 -0.191 . . . . 0.0 111.389 178.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.3 m -73.21 -42.29 62.81 Favored 'General case' 0 C--O 1.227 -0.084 0 C-N-CA 122.332 0.253 . . . . 0.0 111.185 179.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 44.9 mt -60.85 -30.78 70.32 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 173.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.17 -14.65 19.22 Favored Glycine 0 CA--C 1.534 1.237 0 CA-C-O 118.826 -0.986 . . . . 0.0 113.81 178.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -100.59 -6.92 24.6 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 119.061 1.431 . . . . 0.0 111.805 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 35.3 m -121.15 -18.31 5.35 Favored 'Isoleucine or valine' 0 C--N 1.338 0.108 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.7 tp -53.69 -26.03 12.74 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 C-N-CA 122.92 0.488 . . . . 0.0 111.817 179.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.406 ' HG3' ' H ' ' A' ' 107' ' ' GLU . 16.4 pt20 -59.49 -61.42 2.64 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 122.77 0.428 . . . . 0.0 110.614 176.199 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.406 ' H ' ' HG3' ' A' ' 106' ' ' GLN . 12.1 pt-20 -71.13 -28.27 64.17 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.929 -0.482 . . . . 0.0 111.332 -179.063 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.51 -55.67 25.25 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.38 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 59.9 mt -62.95 -58.14 8.36 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 118.44 -0.791 . . . . 0.0 110.428 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 91.1 p -55.27 -43.13 74.43 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 118.857 -1.137 . . . . 0.0 112.133 -172.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -70.69 -41.67 71.7 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 119.237 0.926 . . . . 0.0 111.077 177.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.17 -37.25 71.82 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 119.157 -0.449 . . . . 0.0 111.359 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -80.91 -35.31 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.101 0 C-N-CA 119.572 -0.851 . . . . 0.0 112.135 175.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.09 -25.4 65.31 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 119.813 -0.755 . . . . 0.0 111.125 -178.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.52 -14.3 38.08 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.293 0.637 . . . . 0.0 111.225 177.008 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 46.3 p -71.42 156.49 39.41 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -170.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 68.4 m-20 -96.36 177.89 5.55 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 106.908 -1.515 . . . . 0.0 106.908 168.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -56.26 -45.1 80.19 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.738 0.699 . . . . 0.0 111.149 -177.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -64.99 -41.13 95.68 Favored 'General case' 0 CA--C 1.53 0.173 0 O-C-N 121.974 -0.454 . . . . 0.0 110.481 -179.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 31.6 m170 -69.42 -37.35 77.41 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 119.295 -0.383 . . . . 0.0 110.882 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -41.16 96.83 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 174.551 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -64.4 -39.54 94.06 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.568 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -64.21 -41.08 97.21 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 121.15 -0.22 . . . . 0.0 111.19 176.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.9 mt -69.8 -37.39 73.34 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.087 0 CA-C-N 118.281 0.492 . . . . 0.0 109.719 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 80.5 ttt-85 -64.8 -38.1 89.84 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 177.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 65.6 ttp -66.05 -40.76 91.23 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 55.1 tp -60.4 -44.62 95.51 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 110.53 -0.174 . . . . 0.0 110.53 178.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.9 mt -68.06 -35.59 78.47 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 122.094 0.158 . . . . 0.0 111.028 179.039 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.8 t70 . . . . . 0 N--CA 1.455 -0.199 0 N-CA-C 110.332 -0.248 . . . . 0.0 110.332 178.567 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo . . . . . 0 N--CA 1.454 -0.84 0 N-CA-C 109.806 -0.882 . . . . 0.0 109.806 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 47.5 m -68.01 155.18 40.07 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 174.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 162' ' ' TYR . . . . . 0.416 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 15.8 t80 -139.95 127.42 21.5 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 120.574 0.225 . . . . 0.0 110.938 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.9 t -124.17 124.54 25.88 Favored Pre-proline 0 C--O 1.234 0.276 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.543 177.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.18 -12.66 35.8 Favored 'Trans proline' 0 N--CA 1.449 -1.143 0 C-N-CA 122.386 2.057 . . . . 0.0 109.828 -179.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 22.5 m . . . . . 0 C--N 1.34 0.178 0 C-N-CA 123.536 0.735 . . . . 0.0 111.853 -174.914 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 . . . . . 0 CA--C 1.532 0.274 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -55.41 -15.42 2.62 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.179 0.592 . . . . 0.0 111.714 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 34.3 tp60 -55.27 -41.26 71.99 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.137 0.575 . . . . 0.0 110.362 176.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -63.96 -37.89 89.08 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 118.246 0.475 . . . . 0.0 110.615 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -64.72 -55.38 20.29 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.536 0.607 . . . . 0.0 109.899 179.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 66.5 t -60.72 -53.08 53.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -177.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.53 -35.73 70.66 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.118 0.567 . . . . 0.0 111.627 -178.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 77.5 m -69.12 -44.95 71.36 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-N 118.352 0.524 . . . . 0.0 110.452 177.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 20.7 tp -66.46 -29.16 69.23 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.487 -179.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.4 -45.16 66.52 Favored 'General case' 0 CA--C 1.523 -0.079 0 C-N-CA 123.787 0.835 . . . . 0.0 109.85 177.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 72.8 m -61.44 -29.35 69.89 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 173.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.86 -32.47 61.9 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 120.601 0.238 . . . . 0.0 110.623 175.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt . . . . . 0 N--CA 1.456 -0.126 0 C-N-CA 123.348 0.659 . . . . 0.0 110.57 179.531 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.6 mm . . . . . 0 C--O 1.231 0.108 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 42.9 t -138.98 121.67 16.37 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.72 -20.08 63.64 Favored Glycine 0 CA--C 1.523 0.562 0 CA-C-O 119.229 -0.762 . . . . 0.0 112.208 -176.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.45 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 47.7 t -65.42 -42.34 92.58 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 118.611 1.205 . . . . 0.0 109.853 177.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.4 mmp_? -60.42 -48.16 82.94 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 176.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.5 mt -63.15 -34.33 66.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.201 -177.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 23.0 mmtp -69.1 -39.67 78.85 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 118.83 -0.605 . . . . 0.0 110.777 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.45 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.3 OUTLIER -65.22 -42.58 93.29 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.359 0.982 . . . . 0.0 110.225 175.296 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.5 mt -62.45 -56.91 13.65 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 122.487 -0.133 . . . . 0.0 110.82 -178.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.446 HG21 ' HB2' ' A' ' 71' ' ' SER . 41.6 p -55.29 -42.97 74.34 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 121.986 -0.447 . . . . 0.0 111.593 176.469 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.9 m -55.37 -55.92 26.06 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 119.279 -0.391 . . . . 0.0 111.131 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -79.07 -18.54 53.24 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -173.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.26 -56.0 8.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 119.041 0.837 . . . . 0.0 109.15 167.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 50.0 mt -72.92 -14.58 61.5 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.913 0.885 . . . . 0.0 113.154 -174.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -55.37 -30.33 60.14 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -178.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -153.1 -20.78 0.15 Allowed 'General case' 0 C--N 1.341 0.214 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 -178.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 35.0 mm 45.75 74.15 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-O 121.837 0.827 . . . . 0.0 111.173 -177.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -134.52 6.74 3.53 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.177 0.991 . . . . 0.0 109.835 178.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.474 HG21 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -142.5 108.64 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 124.888 1.275 . . . . 0.0 108.359 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.599 ' CD ' ' H ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -102.13 -82.77 0.47 Allowed 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -178.54 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.599 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 99.2 p -55.86 -24.48 37.09 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 123.504 0.722 . . . . 0.0 112.569 -174.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.583 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -70.86 -56.42 6.33 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 177.812 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.464 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 6.5 mt -57.52 -40.64 75.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 123.179 0.591 . . . . 0.0 110.556 175.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 14.8 mm -69.68 -51.71 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-O 119.275 -0.393 . . . . 0.0 111.481 -178.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.4 m -60.63 -27.13 67.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 118.821 0.737 . . . . 0.0 110.03 177.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.9 tp -70.39 -45.01 66.83 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 118.72 -0.657 . . . . 0.0 111.778 178.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 25.7 pt -74.91 -33.83 31.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 119.581 1.082 . . . . 0.0 111.437 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.2 mt -65.63 -52.19 53.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -65.18 -29.46 70.28 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.071 178.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -59.13 -42.54 90.87 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 173.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.6 m -58.33 -49.36 77.47 Favored 'General case' 0 C--N 1.338 0.093 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 174.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 52.5 tpt85 -56.15 -30.55 62.35 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.803 0.841 . . . . 0.0 112.486 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 80.3 mt -90.59 -14.59 32.15 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -179.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 50.7 m -97.05 159.01 32.38 Favored Pre-proline 0 CA--C 1.531 0.231 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -171.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -75.79 -139.54 0.02 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.707 1 C-N-CA 125.723 4.282 . . . . 0.0 109.063 172.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -56.12 -19.6 13.96 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.002 0.819 . . . . 0.0 112.125 178.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.8 m -59.46 -25.69 64.61 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.755 0.422 . . . . 0.0 109.961 173.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -55.28 -64.64 0.78 Allowed 'General case' 0 C--N 1.341 0.204 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 172.543 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.412 ' HB3' ' HE2' ' A' ' 62' ' ' LYS . 23.3 ttpt -50.44 -75.68 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.871 -179.305 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 33.0 tp -74.27 -43.14 58.14 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 119.102 -1.039 . . . . 0.0 111.639 -168.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.57 -48.32 44.28 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -174.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.9 m -70.66 -38.61 73.8 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 118.504 -1.278 . . . . 0.0 110.041 -178.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.7 mt -58.26 -42.08 85.69 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 118.293 -1.363 . . . . 0.0 110.826 177.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -68.66 -40.03 80.38 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.324 0.966 . . . . 0.0 112.168 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 79.0 mt -66.89 -42.09 88.52 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-N 118.395 0.543 . . . . 0.0 111.15 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.2 mt -66.89 -29.94 47.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -76.75 -37.85 55.2 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-O 119.041 -0.504 . . . . 0.0 111.975 178.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.446 ' HB2' HG21 ' A' ' 33' ' ' THR . 61.2 p -70.78 -52.68 19.09 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 119.286 0.948 . . . . 0.0 110.324 178.297 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 53.1 mt -67.81 -36.21 75.05 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 178.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.9 -46.79 64.45 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 -178.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 28.2 mtt-85 -63.05 -43.51 98.44 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 117.623 0.711 . . . . 0.0 109.942 176.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.33 -40.54 93.82 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.769 -0.196 . . . . 0.0 110.694 -178.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -63.96 -45.62 88.3 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 175.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.8 tp -57.88 -41.62 82.91 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 -177.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -67.94 -41.36 82.66 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 117.725 0.238 . . . . 0.0 110.397 177.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -60.07 -39.72 87.02 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.877 -0.147 . . . . 0.0 111.074 -177.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 9.3 t -87.31 -20.34 26.94 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 117.995 0.362 . . . . 0.0 111.702 178.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 67.2 ttp85 . . . . . 0 CA--C 1.529 0.166 0 CA-C-N 118.371 0.532 . . . . 0.0 110.185 174.047 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.393 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 28.6 p -49.3 -30.31 7.25 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -175.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.4 -46.69 79.03 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 118.787 0.722 . . . . 0.0 110.073 177.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 43.0 t60 -69.52 -27.53 65.26 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 121.038 0.447 . . . . 0.0 110.21 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.09 -42.69 79.97 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.185 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.3 mt -64.77 -41.78 93.14 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.163 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 173.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -59.82 -33.3 71.57 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 110.782 -0.081 . . . . 0.0 110.782 178.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 88.6 m -75.57 -42.72 51.41 Favored 'General case' 0 N--CA 1.457 -0.075 0 CA-C-O 119.526 -0.273 . . . . 0.0 111.026 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 49.6 mt -60.54 -29.02 68.87 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 173.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.4 -15.38 31.28 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-O 119.154 -0.803 . . . . 0.0 113.563 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -98.28 -6.28 31.36 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.961 1.38 . . . . 0.0 111.684 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 31.1 m -123.71 -22.68 2.66 Favored 'Isoleucine or valine' 0 C--O 1.23 0.027 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -178.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.0 tp -55.87 -26.49 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 C-N-CA 122.935 0.494 . . . . 0.0 111.44 -177.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -61.93 -59.08 5.65 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.144 0.578 . . . . 0.0 111.198 178.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -73.75 -29.87 62.47 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 122.168 0.187 . . . . 0.0 110.766 -179.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.0 tt -63.03 -56.64 15.21 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 49.5 mt -61.2 -57.98 10.2 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 118.695 -0.669 . . . . 0.0 110.261 176.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 55.9 p -54.84 -44.26 73.76 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 119.605 -0.838 . . . . 0.0 112.053 -172.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -69.04 -42.46 76.31 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-N 119.13 0.877 . . . . 0.0 110.794 177.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.28 -50.89 70.1 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.85 0.46 . . . . 0.0 111.603 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -35.46 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 O-C-N 121.781 -0.575 . . . . 0.0 111.224 179.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.65 -24.6 64.56 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.05 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.62 -14.21 38.04 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.071 0.548 . . . . 0.0 110.827 178.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.417 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 29.5 p -79.46 157.4 27.51 Favored 'General case' 0 N--CA 1.457 -0.102 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 -171.274 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -90.16 173.42 8.18 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 172.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 85.2 mt-30 -55.56 -45.78 77.26 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.772 0.714 . . . . 0.0 111.679 -176.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -63.99 -39.03 93.21 Favored 'General case' 0 N--CA 1.454 -0.244 0 O-C-N 121.719 -0.613 . . . . 0.0 110.404 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.417 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 31.7 m170 -70.83 -45.43 64.56 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.125 -178.148 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -35.95 71.69 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-N 118.839 0.745 . . . . 0.0 109.984 174.542 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.31 -41.99 88.91 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.237 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.6 mtpp -61.57 -44.26 97.35 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.349 175.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 98.0 mt -65.28 -38.23 82.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 43.7 ttt85 -62.26 -39.34 92.57 Favored 'General case' 0 CA--C 1.521 -0.145 0 C-N-CA 122.693 0.397 . . . . 0.0 109.932 177.286 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 51.1 ttp -66.09 -44.03 85.56 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.547 -0.168 . . . . 0.0 110.547 178.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.3 mp -57.83 -46.34 84.86 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 177.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.9 mt -73.66 -32.7 64.13 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -177.052 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.0 t70 . . . . . 0 N--CA 1.455 -0.195 0 CA-C-N 118.673 0.67 . . . . 0.0 110.029 179.028 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo . . . . . 0 N--CA 1.458 -0.59 0 CA-C-O 120.797 0.249 . . . . 0.0 112.233 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 13.0 t -107.26 173.79 6.17 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.876 0.87 . . . . 0.0 111.713 -178.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -131.92 143.06 49.86 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 124.577 1.151 . . . . 0.0 109.265 176.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 26.7 t -121.25 137.07 26.32 Favored Pre-proline 0 N--CA 1.451 -0.386 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 176.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -66.47 -9.74 25.21 Favored 'Trans proline' 0 N--CA 1.447 -1.253 0 C-N-CA 122.912 2.408 . . . . 0.0 111.205 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 71.7 p . . . . . 0 C--N 1.34 0.166 0 CA-C-O 118.801 -0.619 . . . . 0.0 111.76 -178.251 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 . . . . . 0 N--CA 1.453 -0.311 0 N-CA-C 110.536 -0.172 . . . . 0.0 110.536 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -54.16 -14.49 1.13 Allowed 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.477 0.711 . . . . 0.0 110.58 175.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -54.7 -36.29 64.52 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 123.041 0.537 . . . . 0.0 110.352 174.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -56.76 -48.56 77.57 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-N 119.138 0.881 . . . . 0.0 109.812 176.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -65.3 -50.32 66.15 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 120.408 0.147 . . . . 0.0 111.2 -177.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 62.1 t -64.56 -53.08 46.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 O-C-N 122.368 -0.208 . . . . 0.0 110.488 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.65 -31.54 70.76 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 119.588 -0.244 . . . . 0.0 111.441 -178.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 53.3 m -71.46 -40.97 69.96 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.487 177.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.9 tp -66.37 -33.38 75.59 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -67.4 -42.62 83.0 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.894 0.878 . . . . 0.0 110.079 175.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 66.3 m -63.8 -27.47 69.21 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 174.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -68.99 -39.59 79.26 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 175.199 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt . . . . . 0 C--N 1.341 0.227 0 C-N-CA 122.614 0.366 . . . . 0.0 111.02 175.144 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 17.1 mm . . . . . 0 CA--C 1.53 0.198 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.3 t -145.1 137.78 26.19 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 118.099 0.409 . . . . 0.0 111.067 -178.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -61.89 -37.97 95.24 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-O 119.267 -0.74 . . . . 0.0 112.793 -176.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.434 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 35.6 t -56.2 -44.06 79.08 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 118.438 1.119 . . . . 0.0 111.419 -173.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? -69.42 -44.85 70.55 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 -178.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 91.1 mt -58.52 -38.49 70.84 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.2 mmtp -73.39 -35.65 65.91 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-O 118.605 -0.712 . . . . 0.0 111.849 -178.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.434 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.1 OUTLIER -65.18 -38.47 90.61 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-N 119.516 1.053 . . . . 0.0 110.095 174.646 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.0 mt -64.06 -55.7 20.3 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 119.386 -0.34 . . . . 0.0 110.802 178.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.403 HG22 ' HB2' ' A' ' 71' ' ' SER . 41.3 p -58.01 -42.42 85.18 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 118.622 0.646 . . . . 0.0 111.066 177.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.3 m -55.65 -58.14 9.05 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 119.101 -0.476 . . . . 0.0 111.057 -179.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -69.12 -31.64 70.47 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 118.74 -1.184 . . . . 0.0 111.367 -175.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.483 ' HB1' ' HH ' ' A' ' 76' ' ' TYR . . . -58.54 -59.81 4.78 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.994 177.359 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.8 mp -68.93 -23.24 64.14 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 122.268 0.227 . . . . 0.0 111.525 -177.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -72.38 -18.77 61.71 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 122.205 -0.309 . . . . 0.0 111.26 176.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -148.6 52.53 0.99 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 117.758 0.254 . . . . 0.0 111.648 -175.142 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 35.8 mm -62.84 80.96 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 121.494 0.664 . . . . 0.0 110.425 172.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -153.28 20.21 0.56 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.421 1.489 . . . . 0.0 108.541 175.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.585 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -148.94 34.89 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 C-N-CA 125.343 1.457 . . . . 0.0 109.114 -171.284 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.462 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -49.28 -55.28 13.22 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -176.408 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 86.6 p -75.97 -24.27 55.4 Favored 'General case' 0 CA--C 1.522 -0.106 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -173.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.612 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -86.0 -39.16 17.15 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 119.286 -0.388 . . . . 0.0 110.108 -179.686 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 24.3 mt -59.11 -51.65 70.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.096 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 170.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 11.5 mm -65.55 -47.26 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-O 119.281 -0.39 . . . . 0.0 111.187 -178.122 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 48.3 t -55.82 -38.29 69.82 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.232 176.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.6 tp -68.54 -43.6 76.34 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 118.954 -0.546 . . . . 0.0 112.458 -177.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 38.5 pt -73.09 -37.31 52.77 Favored 'Isoleucine or valine' 0 C--N 1.343 0.286 0 CA-C-N 119.495 1.043 . . . . 0.0 111.993 -179.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.0 mt -64.26 -50.42 76.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -63.72 -31.05 72.1 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.451 178.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -58.98 -45.19 91.18 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 173.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.9 t -67.94 -31.3 70.94 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 111.656 0.243 . . . . 0.0 111.656 177.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 53.0 tpt85 -71.12 -36.29 72.08 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.911 0.884 . . . . 0.0 112.716 -177.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 78.5 mt -93.77 -14.71 25.93 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 -176.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 92.1 m -104.73 155.85 36.85 Favored Pre-proline 0 C--N 1.331 -0.206 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -171.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -66.11 -176.69 0.66 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 1 C-N-CA 125.349 4.033 . . . . 0.0 114.004 -178.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.405 ' HB3' ' HE3' ' A' ' 115' ' ' LYS . 53.0 m-20 -56.44 -44.44 80.45 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 125.654 1.582 . . . . 0.0 114.367 -172.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.4 p -57.45 -30.27 64.88 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 178.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -86.94 -13.4 44.79 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-O 118.472 -0.775 . . . . 0.0 111.62 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -74.19 -37.5 63.91 Favored 'General case' 0 C--N 1.342 0.252 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 169.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.3 mt -65.07 -51.77 59.52 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.145 173.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.38 -39.28 90.21 Favored Glycine 0 C--N 1.337 0.635 0 N-CA-C 110.323 -1.111 . . . . 0.0 110.323 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.5 t -55.71 -59.21 5.18 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 176.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 32.5 mt -49.39 -43.47 44.33 Favored 'General case' 0 C--O 1.228 -0.054 0 CA-C-O 118.837 -0.601 . . . . 0.0 111.625 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -66.96 -34.11 77.06 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 119.24 -0.984 . . . . 0.0 111.471 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 69.3 mt -72.13 -48.63 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 O-C-N 122.003 -0.436 . . . . 0.0 111.19 178.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 1.8 mp -59.46 -37.18 68.56 Favored 'Isoleucine or valine' 0 C--N 1.339 0.119 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -71.33 -39.42 71.37 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 119.414 -0.327 . . . . 0.0 111.285 -177.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.422 ' HB3' ' CE2' ' B' ' 162' ' ' TYR . 89.9 p -69.34 -52.96 22.2 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.527 0.603 . . . . 0.0 111.012 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 35.1 mt -66.47 -36.31 77.0 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 CA-C-N 118.166 0.439 . . . . 0.0 110.205 179.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.91 -44.6 91.49 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.651 -0.579 . . . . 0.0 111.651 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 32.6 ttm105 -67.39 -40.12 85.63 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 117.107 0.453 . . . . 0.0 110.528 178.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.78 -41.29 78.99 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.43 -179.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.483 ' HH ' ' HB1' ' A' ' 36' ' ' ALA . 8.2 m-30 -64.15 -49.2 73.04 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 175.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.45 -46.51 83.54 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -62.49 -44.68 95.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 122.439 -0.163 . . . . 0.0 110.797 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -64.89 -40.1 94.57 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -176.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.7 t -84.61 -20.15 31.86 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -177.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 25.9 mmm180 . . . . . 0 C--N 1.339 0.151 0 CA-C-N 118.775 0.716 . . . . 0.0 111.651 174.483 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.267 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 28.4 p -47.81 -31.55 5.08 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -177.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.43 -44.23 91.84 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.272 -0.892 . . . . 0.0 110.244 176.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -72.26 -25.58 61.67 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 122.612 0.365 . . . . 0.0 110.225 177.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.24 -45.36 84.94 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.14 -43.13 98.71 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -60.57 -33.51 72.81 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.803 -0.181 . . . . 0.0 111.344 178.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.4 m -74.76 -40.75 61.02 Favored 'General case' 0 C--N 1.338 0.072 0 CA-C-O 119.686 -0.197 . . . . 0.0 110.974 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 48.7 mt -61.94 -29.45 70.24 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 173.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.76 -14.54 16.01 Favored Glycine 0 CA--C 1.53 1.027 0 CA-C-O 118.911 -0.939 . . . . 0.0 113.829 178.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -102.2 -6.6 23.0 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.085 1.442 . . . . 0.0 112.002 -179.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 35.4 m -121.29 -16.78 6.13 Favored 'Isoleucine or valine' 0 C--N 1.338 0.079 0 C-N-CA 122.917 0.487 . . . . 0.0 111.904 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -52.79 -27.34 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 C-N-CA 123.039 0.536 . . . . 0.0 111.642 179.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -60.6 -58.45 8.44 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 122.598 0.359 . . . . 0.0 110.965 178.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -74.53 -29.36 61.35 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 122.403 0.281 . . . . 0.0 111.092 -177.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 49.2 tp -63.92 -54.87 27.82 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 179.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.408 ' O ' HG13 ' A' ' 113' ' ' ILE . 87.0 mt -63.0 -63.86 1.08 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.51 -0.757 . . . . 0.0 109.156 176.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 87.5 p -40.49 -49.48 2.9 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -177.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -73.6 -38.74 65.02 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 119.821 1.191 . . . . 0.0 112.109 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.52 -48.14 82.8 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.802 0.728 . . . . 0.0 110.706 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.2 OUTLIER -76.01 -34.62 27.39 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 117.963 0.347 . . . . 0.0 111.774 -179.69 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.72 -27.51 67.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 119.585 -0.846 . . . . 0.0 109.81 179.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.405 ' HE3' ' HB3' ' A' ' 59' ' ' ASP . 3.3 tmtt? -78.43 -26.94 46.44 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.308 0.643 . . . . 0.0 110.986 175.679 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.404 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 53.6 p -69.05 153.17 44.23 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -168.217 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -89.58 175.76 7.15 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 125.045 1.338 . . . . 0.0 108.439 172.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -55.84 -41.96 75.07 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 119.253 0.933 . . . . 0.0 111.838 -178.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -69.25 -38.89 78.66 Favored 'General case' 0 C--O 1.232 0.173 0 O-C-N 121.666 -0.646 . . . . 0.0 110.479 179.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.404 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 46.9 m170 -72.19 -39.19 68.79 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 119.397 -0.335 . . . . 0.0 111.188 -178.314 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.84 -36.41 83.4 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 176.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -62.09 -44.46 96.62 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.43 177.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -63.15 -43.89 97.06 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 117.545 0.157 . . . . 0.0 111.394 177.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.6 mt -68.03 -38.69 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-N 117.781 0.264 . . . . 0.0 110.546 -179.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -68.68 -33.97 74.88 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.3 0.24 . . . . 0.0 110.504 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 64.1 ttp -68.31 -43.87 76.68 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 176.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.6 tt -57.8 -47.46 82.52 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 178.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.4 mt -71.9 -31.23 66.2 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 111.76 0.281 . . . . 0.0 111.76 -179.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 30.6 t70 . . . . . 0 N--CA 1.456 -0.132 0 CA-C-N 118.29 0.496 . . . . 0.0 109.787 177.65 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 160' ' ' PRO . . . . . 0.433 ' HG2' ' H ' ' B' ' 161' ' ' SER . 58.4 Cg_endo . . . . . 0 N--CA 1.454 -0.824 0 N-CA-C 111.357 -0.286 . . . . 0.0 111.357 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 161' ' ' SER . . . . . 0.433 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 38.8 t -177.97 152.08 0.72 Allowed 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.046 0.938 . . . . 0.0 109.351 176.634 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 162' ' ' TYR . . . . . 0.422 ' CE2' ' HB3' ' A' ' 71' ' ' SER . 44.5 t80 -152.25 125.86 8.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.732 0.301 . . . . 0.0 110.933 169.516 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 163' ' ' SER . . . . . 0.437 ' C ' ' H ' ' B' ' 165' ' ' THR . 9.3 t -131.93 148.77 71.18 Favored Pre-proline 0 N--CA 1.453 -0.32 0 C-N-CA 124.607 1.163 . . . . 0.0 109.558 179.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_exo -58.22 -1.46 0.65 Allowed 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 123.607 2.871 . . . . 0.0 112.954 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 165' ' ' THR . . . . . 0.437 ' H ' ' C ' ' B' ' 163' ' ' SER . 28.0 m . . . . . 0 N--CA 1.456 -0.159 0 O-C-N 122.226 -0.297 . . . . 0.0 111.139 -179.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.476 0.836 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 54.0 mm-40 -131.3 178.5 6.67 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.484 0.713 . . . . 0.0 109.848 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -68.12 -6.5 23.36 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.633 0.373 . . . . 0.0 111.32 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -88.57 -3.37 58.82 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.503 0.721 . . . . 0.0 111.035 178.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -109.08 23.22 14.85 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.685 0.794 . . . . 0.0 111.435 -178.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.443 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 12.4 t70 -72.95 -157.15 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.521 0.728 . . . . 0.0 109.907 178.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.443 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 12.4 t80 -55.21 -14.19 1.61 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.167 0.587 . . . . 0.0 110.876 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -52.89 -37.09 60.13 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 124.396 1.078 . . . . 0.0 111.214 175.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -65.18 -43.88 90.27 Favored 'General case' 0 N--CA 1.457 -0.101 0 CA-C-N 119.328 0.967 . . . . 0.0 110.342 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -65.65 -50.52 64.68 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -177.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 99.7 t -63.13 -54.52 32.32 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -178.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.51 -33.62 70.03 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 119.437 -0.316 . . . . 0.0 111.654 -178.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 67.1 m -70.65 -43.98 68.04 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 118.62 0.646 . . . . 0.0 110.495 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.3 tp -65.59 -33.99 77.19 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.208 0.528 . . . . 0.0 110.064 -179.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -66.62 -45.72 78.16 Favored 'General case' 0 CA--C 1.522 -0.101 0 C-N-CA 124.164 0.985 . . . . 0.0 110.063 177.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 74.2 m -65.43 -26.36 67.93 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 110.371 -0.233 . . . . 0.0 110.371 176.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -68.03 -45.06 75.02 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 174.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -66.44 -32.79 74.39 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.768 0.827 . . . . 0.0 111.659 177.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -69.07 -14.38 62.98 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.206 0.602 . . . . 0.0 112.614 -177.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.3 mt -115.62 163.55 15.62 Favored 'General case' 0 N--CA 1.457 -0.087 0 CA-C-O 121.066 0.46 . . . . 0.0 111.571 -175.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -128.73 144.79 51.25 Favored 'General case' 0 C--N 1.337 0.064 0 C-N-CA 123.781 0.833 . . . . 0.0 109.804 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.7 t 59.33 154.88 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.214 1.405 . . . . 0.0 113.117 -175.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.17 131.9 0.4 Allowed Glycine 0 CA--C 1.527 0.836 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 -178.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 18.7 mm -116.26 56.62 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.452 ' HA ' ' H ' ' B' ' 159' ' ' SEP . 70.5 m -51.7 132.06 30.67 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.354 0.661 . . . . 0.0 112.049 -174.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -70.04 -16.0 72.41 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-O 118.909 -0.939 . . . . 0.0 113.366 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.412 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 41.2 t -65.93 -42.79 89.63 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-N 118.974 1.387 . . . . 0.0 110.625 -177.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -68.04 -37.46 81.36 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 62.8 mt -63.59 -41.71 93.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -58.39 -43.28 88.46 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 118.561 -0.733 . . . . 0.0 111.967 176.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.408 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -65.62 -43.54 89.23 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 119.735 1.152 . . . . 0.0 111.102 178.459 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.3 mt -61.44 -57.08 13.65 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.612 0.244 . . . . 0.0 110.413 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 43.3 p -56.69 -41.17 76.9 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.474 0.31 . . . . 0.0 111.748 177.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.9 m -56.02 -56.23 23.29 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 119.143 -0.456 . . . . 0.0 110.698 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -67.27 -33.64 75.75 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 118.971 -1.091 . . . . 0.0 111.548 -175.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.426 ' HB2' ' HH ' ' A' ' 76' ' ' TYR . . . -60.52 -59.76 4.89 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 118.225 0.466 . . . . 0.0 110.817 174.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 53.9 mt -71.62 -14.66 62.13 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.181 0.992 . . . . 0.0 112.889 -173.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -55.82 -34.85 65.75 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -178.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -153.11 -17.9 0.15 Allowed 'General case' 0 C--N 1.34 0.155 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -177.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 31.3 mm 47.75 75.91 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-O 121.829 0.823 . . . . 0.0 111.417 -178.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -132.09 8.19 4.37 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.911 0.884 . . . . 0.0 109.83 177.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.504 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.8 pt -144.54 123.72 6.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 C-N-CA 125.301 1.44 . . . . 0.0 108.145 -178.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.22 -66.72 1.04 Allowed 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 179.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 50.8 m -66.85 -22.47 65.99 Favored 'General case' 0 N--CA 1.46 0.051 0 C-N-CA 122.714 0.406 . . . . 0.0 111.844 -174.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.572 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -75.17 -52.99 9.59 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 123.996 0.918 . . . . 0.0 109.203 179.012 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.464 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 10.8 mt -58.95 -45.81 91.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 C-N-CA 123.041 0.536 . . . . 0.0 110.025 175.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.401 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 12.3 mm -69.59 -46.28 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-O 119.298 -0.382 . . . . 0.0 111.517 -177.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 40.4 t -58.68 -36.59 74.44 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 118.712 0.687 . . . . 0.0 109.697 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.9 tp -67.87 -45.01 75.74 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 118.754 -0.641 . . . . 0.0 112.282 -178.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 28.5 pt -73.41 -37.07 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-N 119.608 1.095 . . . . 0.0 111.893 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 97.4 mt -63.25 -52.65 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -66.91 -25.63 66.47 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.516 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -61.49 -43.68 98.44 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 173.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.505 ' HB2' ' HG ' ' A' ' 65' ' ' SER . 22.3 t -64.51 -42.78 95.59 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 120.747 0.308 . . . . 0.0 110.346 175.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.64 -48.91 76.51 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 124.809 1.244 . . . . 0.0 112.536 -176.042 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 78.4 mt -81.89 -14.59 55.98 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -174.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 78.9 m -108.91 156.17 39.51 Favored Pre-proline 0 CA--C 1.535 0.375 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -169.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_exo -55.77 -179.87 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.351 1 C-N-CA 126.069 4.513 . . . . 0.0 115.409 176.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -55.46 -43.65 75.67 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.574 1.55 . . . . 0.0 114.036 -174.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.9 p -58.7 -28.44 65.79 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 31.8 m80 -92.02 -14.93 28.6 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 118.861 -0.59 . . . . 0.0 111.208 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -69.15 -47.47 64.95 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 169.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.1 tp -66.14 -45.41 81.11 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.383 177.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.94 -43.65 96.65 Favored Glycine 0 C--N 1.336 0.556 0 N-CA-C 111.124 -0.79 . . . . 0.0 111.124 178.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.505 ' HG ' ' HB2' ' A' ' 54' ' ' SER . 21.7 t -67.0 -37.72 84.72 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 117.579 0.689 . . . . 0.0 110.608 179.158 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 28.5 mt -57.89 -39.58 78.21 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.317 0.962 . . . . 0.0 110.579 174.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -71.57 -32.03 67.63 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.251 0.932 . . . . 0.0 111.835 178.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 83.7 mt -70.96 -47.02 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 O-C-N 121.609 -0.682 . . . . 0.0 110.18 176.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 79.7 mt -61.02 -36.05 69.64 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 C-N-CA 124.208 1.003 . . . . 0.0 109.156 176.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -62.9 -50.05 72.39 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 123.729 0.812 . . . . 0.0 110.656 176.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.5 t -70.47 -49.07 52.37 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 118.887 -1.125 . . . . 0.0 111.952 -175.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 46.2 mt -65.33 -37.55 80.4 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.8 -48.97 58.28 Favored Glycine 0 CA--C 1.523 0.583 0 CA-C-O 119.596 -0.558 . . . . 0.0 112.309 -178.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.5 mtp-105 -66.12 -38.53 88.43 Favored 'General case' 0 CA--C 1.522 -0.106 0 CA-C-N 117.845 0.823 . . . . 0.0 110.92 178.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.74 -42.57 81.62 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 121.091 -0.243 . . . . 0.0 110.47 178.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.426 ' HH ' ' HB2' ' A' ' 36' ' ' ALA . 8.0 m-30 -61.39 -47.52 85.42 Favored 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 175.638 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.0 tp -59.09 -44.94 91.97 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.743 0.417 . . . . 0.0 110.813 -176.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -67.62 -41.65 83.63 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.631 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 59.2 tt0 -65.95 -38.96 89.94 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.502 -176.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.3 t -82.93 -23.17 33.61 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 117.928 0.331 . . . . 0.0 111.303 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 28.9 ttp180 -68.42 -32.76 73.04 Favored 'General case' 0 N--CA 1.463 0.177 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 172.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 28.8 t -70.97 -14.47 62.37 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.118 0.567 . . . . 0.0 111.444 176.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -103.61 170.91 7.66 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.748 0.819 . . . . 0.0 109.947 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 39.2 t -145.97 157.63 43.88 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 122.724 0.41 . . . . 0.0 110.749 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -73.96 -7.74 53.52 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.039 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 83.4 p -92.45 1.46 57.23 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.035 0.534 . . . . 0.0 111.09 176.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 40.7 m -136.39 14.53 3.23 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 123.567 0.747 . . . . 0.0 111.034 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.0 t -145.36 159.24 43.35 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 123.157 0.583 . . . . 0.0 110.337 -178.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 48.3 m-80 -142.05 165.77 26.54 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.745 0.818 . . . . 0.0 109.61 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 28.9 tptp 54.85 101.58 0.04 OUTLIER Pre-proline 0 CA--C 1.534 0.347 0 C-N-CA 125.285 1.434 . . . . 0.0 111.934 -177.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -64.6 153.12 79.03 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 122.843 2.362 . . . . 0.0 111.111 -179.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 142.9 -147.05 18.35 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -175.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 53.86 -161.8 0.12 Allowed 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 175.043 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.9 p -50.95 -30.01 13.76 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.088 0.955 . . . . 0.0 113.416 -175.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.98 -46.83 89.14 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 118.753 0.706 . . . . 0.0 109.579 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -74.72 -23.09 58.52 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.987 178.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.401 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -64.29 -45.59 87.33 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 175.356 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.77 -42.25 91.99 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -59.35 -34.97 73.03 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 121.303 -0.159 . . . . 0.0 110.969 178.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.3 m -76.61 -40.77 48.36 Favored 'General case' 0 C--O 1.227 -0.098 0 O-C-N 122.288 -0.258 . . . . 0.0 111.244 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.8 mt -61.41 -29.49 69.97 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 174.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.47 -14.58 28.25 Favored Glycine 0 CA--C 1.529 0.95 0 CA-C-O 119.016 -0.88 . . . . 0.0 113.816 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -100.51 -6.79 24.94 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 118.776 1.288 . . . . 0.0 111.689 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.3 m -123.72 -18.28 4.13 Favored 'Isoleucine or valine' 0 C--N 1.339 0.134 0 N-CA-C 112.5 0.555 . . . . 0.0 112.5 -178.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -54.53 -28.08 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 118.48 0.582 . . . . 0.0 111.548 -177.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -62.29 -51.79 66.29 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.778 0.431 . . . . 0.0 111.215 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -77.94 -28.49 49.62 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 122.093 -0.379 . . . . 0.0 111.008 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.0 mt -65.25 -49.78 68.32 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 178.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 69.2 mt -65.56 -60.14 3.24 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 118.5 -0.762 . . . . 0.0 110.31 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.9 p -53.67 -40.37 65.87 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 119.011 -1.076 . . . . 0.0 112.199 -173.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -72.67 -45.0 61.11 Favored 'General case' 0 C--N 1.342 0.24 0 CA-C-N 119.44 1.018 . . . . 0.0 111.095 178.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.96 -33.98 65.26 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.148 0.579 . . . . 0.0 111.635 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -79.2 -41.97 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 CA-C-N 119.345 0.975 . . . . 0.0 112.019 173.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.54 -27.08 66.66 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.001 0.364 . . . . 0.0 111.746 -177.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.33 -18.41 45.8 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.647 0.779 . . . . 0.0 110.653 177.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.2 m -80.44 164.63 22.91 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -173.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -101.4 -179.41 4.02 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 169.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 15.9 tp60 -51.33 -39.92 58.01 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.639 0.654 . . . . 0.0 111.592 -178.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -69.08 -54.56 14.38 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -177.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -64.87 -35.87 82.52 Favored 'General case' 0 C--N 1.339 0.131 0 O-C-N 122.2 -0.312 . . . . 0.0 110.4 -178.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 11.9 ttpt -56.71 -51.9 67.04 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 175.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.5 -35.29 78.91 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.885 -176.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -63.59 -39.64 94.91 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 122.215 -0.303 . . . . 0.0 111.239 175.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.5 mt -68.88 -37.38 77.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 49.7 tpt85 -60.89 -41.41 95.97 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 122.792 0.437 . . . . 0.0 109.967 175.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 65.9 ttp -68.42 -37.67 80.5 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 122.62 0.368 . . . . 0.0 110.611 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 8.4 tt -59.48 -51.71 68.72 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.4 mt -71.03 -25.87 62.85 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 120.444 -0.502 . . . . 0.0 111.446 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -66.92 -39.46 87.37 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.285 0.493 . . . . 0.0 109.874 175.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.3 mt -70.82 -35.91 62.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 27.3 m0 -59.73 -44.13 93.91 Favored 'General case' 0 C--N 1.34 0.171 0 CA-C-N 118.2 0.455 . . . . 0.0 110.037 174.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -71.62 -33.36 68.91 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 111.501 0.186 . . . . 0.0 111.501 179.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 24.4 ttm180 -72.33 -31.1 65.37 Favored 'General case' 0 N--CA 1.458 -0.054 0 C-N-CA 123.207 0.603 . . . . 0.0 111.565 -178.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 35.6 t -70.49 -21.13 62.8 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.121 0.569 . . . . 0.0 111.412 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 71.56 4.87 58.84 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 111.776 -0.53 . . . . 0.0 111.776 -177.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 40.1 tp -79.54 -8.58 59.26 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.35 0.66 . . . . 0.0 110.755 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -127.87 162.93 25.54 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.703 0.801 . . . . 0.0 109.844 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -135.61 171.65 14.15 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 122.886 0.474 . . . . 0.0 110.721 -176.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -66.19 165.66 13.34 Favored 'General case' 0 N--CA 1.458 -0.068 0 C-N-CA 123.249 0.619 . . . . 0.0 110.832 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 22.1 m 58.35 15.85 3.71 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.139 0.976 . . . . 0.0 113.578 -177.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -132.8 11.19 4.34 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.223 0.609 . . . . 0.0 110.955 176.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -135.4 10.34 3.47 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.958 0.503 . . . . 0.0 111.962 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 36.8 m-20 -64.45 -6.75 7.88 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.855 0.862 . . . . 0.0 111.982 -179.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . 0.55 ' C ' ' H ' ' A' ' 146' ' ' ARG . . . -36.85 -36.71 0.12 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 127.621 2.368 . . . . 0.0 114.106 -179.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.508 HD12 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -65.53 15.82 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 177.252 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.55 ' H ' ' C ' ' A' ' 144' ' ' ALA . 22.6 mmm180 50.86 50.32 19.29 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 123.827 0.851 . . . . 0.0 109.484 -174.132 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 13.4 t 71.03 161.1 0.23 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.33 1.052 . . . . 0.0 112.594 -174.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -51.5 -18.79 1.18 Allowed 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 117.058 2.244 . . . . 0.0 117.058 -166.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 81.1 m -41.23 -64.37 0.56 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 120.158 1.345 . . . . 0.0 112.107 -174.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . 0.436 ' CD1' ' O ' ' A' ' 145' ' ' ILE . 28.3 m-85 -32.01 -85.8 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 127.915 2.486 . . . . 0.0 114.305 -171.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -105.63 -6.33 19.33 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 118.498 0.59 . . . . 0.0 112.423 176.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' MET . . . . . 0.404 ' SD ' ' N ' ' A' ' 152' ' ' MET . 0.9 OUTLIER -99.85 -14.52 18.75 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 118.609 -0.71 . . . . 0.0 112.179 -171.672 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -84.21 -20.79 31.72 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 119.77 1.168 . . . . 0.0 111.765 175.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 2.4 tm? . . . . . 0 C--O 1.249 1.077 0 CA-C-O 117.863 -1.065 . . . . 0.0 110.032 -179.942 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 53.9 p90 . . . . . 0 N--CA 1.473 0.71 0 CA-C-O 120.492 0.187 . . . . 0.0 110.595 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 88.8 p -141.6 169.62 10.89 Favored Pre-proline 0 CA--C 1.532 0.283 0 C-N-CA 123.427 0.691 . . . . 0.0 109.842 -177.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -61.4 1.35 0.72 Allowed 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 124.457 3.438 . . . . 0.0 114.097 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 40.6 p -132.54 151.61 51.86 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 118.471 0.578 . . . . 0.0 110.433 -179.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 159' ' ' SEP . . . . . 0.452 ' H ' ' HA ' ' A' ' 25' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 160' ' ' PRO . . . . . 0.412 ' HD2' ' N ' ' A' ' 27' ' ' SER . 80.7 Cg_endo -69.94 175.13 38.38 Favored 'Cis proline' 0 N--CA 1.451 -0.975 0 N-CA-C 109.742 -0.907 . . . . 0.0 109.742 -10.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 45.5 m -65.74 144.9 56.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -151.23 142.6 23.4 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.634 0.254 . . . . 0.0 111.326 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 163' ' ' SER . . . . . 0.402 ' C ' ' H ' ' B' ' 165' ' ' THR . 36.5 p -144.09 159.71 51.83 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-O 120.996 0.427 . . . . 0.0 111.328 177.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -57.02 -0.91 0.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 124.335 3.357 . . . . 0.0 113.464 174.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 165' ' ' THR . . . . . 0.402 ' H ' ' C ' ' B' ' 163' ' ' SER . 26.9 m -67.79 -39.83 83.99 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.045 0.384 . . . . 0.0 110.877 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -70.77 -12.14 30.54 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 123.648 2.899 . . . . 0.0 112.747 177.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 72.9 p . . . . . 0 C--O 1.251 1.168 0 CA-C-O 116.611 -1.661 . . . . 0.0 111.115 -175.485 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.2 mmm . . . . . 0 N--CA 1.475 0.811 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -88.34 13.29 11.97 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -177.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -126.98 1.74 6.57 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.951 0.5 . . . . 0.0 111.857 -178.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -71.33 137.76 48.72 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.442 0.565 . . . . 0.0 109.9 179.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 52.39 19.01 1.03 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.371 1.068 . . . . 0.0 113.043 -176.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -105.57 -117.68 0.23 Allowed 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -56.97 -17.12 8.53 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.018 0.372 . . . . 0.0 110.469 174.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -55.52 -42.75 74.95 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.109 0.564 . . . . 0.0 110.327 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -56.55 -43.32 79.82 Favored 'General case' 0 C--N 1.337 0.064 0 CA-C-N 118.264 0.484 . . . . 0.0 110.506 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -66.91 -52.68 40.22 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 110.576 -0.157 . . . . 0.0 110.576 -177.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 67.1 t -61.44 -53.49 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 -179.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.6 -34.66 71.37 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.921 0.488 . . . . 0.0 111.906 -177.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 78.4 m -72.03 -41.03 67.97 Favored 'General case' 0 CA--C 1.523 -0.079 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.707 177.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.3 tp -65.36 -33.05 75.04 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -68.42 -44.76 74.31 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.934 0.894 . . . . 0.0 109.941 176.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 72.1 m -64.36 -26.31 68.41 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 175.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.1 -45.82 69.28 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 174.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -63.45 -31.37 72.51 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 122.967 0.507 . . . . 0.0 111.197 177.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -71.46 -14.49 62.16 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.259 0.624 . . . . 0.0 112.461 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 96.7 mt -115.9 162.39 17.41 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.072 0.549 . . . . 0.0 111.05 -176.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -142.47 167.18 22.7 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 123.2 0.6 . . . . 0.0 110.633 -177.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 29.2 m 51.27 34.95 12.47 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.022 0.929 . . . . 0.0 113.423 176.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -166.45 126.84 1.51 Allowed Glycine 0 C--N 1.338 0.641 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 15.8 mm -111.23 50.71 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 C-N-CA 124.172 0.989 . . . . 0.0 108.505 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.4 m -54.88 132.05 45.65 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.045 0.538 . . . . 0.0 111.988 -176.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.14 -19.23 63.6 Favored Glycine 0 C--N 1.338 0.658 0 C-N-CA 124.542 1.067 . . . . 0.0 113.208 -178.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.421 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 63.1 p -67.32 -39.54 85.89 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 118.707 1.253 . . . . 0.0 110.649 -176.037 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -67.55 -40.24 84.97 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 178.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.5 mt -63.72 -39.48 85.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 177.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 47.5 mmtt -63.41 -40.19 96.53 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-O 118.939 -0.553 . . . . 0.0 110.77 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.95 -47.29 75.15 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 118.822 0.737 . . . . 0.0 110.554 175.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.7 mt -59.23 -58.77 7.16 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 122.452 -0.155 . . . . 0.0 110.833 -178.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.4 p -57.39 -49.13 77.17 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 t -62.53 -43.98 97.48 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 119.965 -0.694 . . . . 0.0 111.282 -175.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -77.27 -21.38 53.72 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -178.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.29 -55.81 10.83 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 119.029 0.831 . . . . 0.0 110.019 169.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.5 mt -65.46 -26.14 67.81 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.178 0.991 . . . . 0.0 111.334 -176.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -76.06 -16.81 59.86 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.077 0.551 . . . . 0.0 111.654 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -145.65 48.95 1.24 Allowed 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.206 0.203 . . . . 0.0 111.436 -173.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 43.9 mm -63.07 79.05 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-O 121.468 0.651 . . . . 0.0 110.45 171.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -153.36 18.15 0.55 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.068 1.747 . . . . 0.0 108.538 176.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.567 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.8 OUTLIER -147.09 36.88 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.065 0 C-N-CA 125.542 1.537 . . . . 0.0 108.541 -171.965 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.414 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -51.37 -53.81 32.75 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -175.237 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 85.6 p -75.4 -23.62 57.08 Favored 'General case' 0 CA--C 1.522 -0.107 0 O-C-N 121.577 -0.702 . . . . 0.0 112.369 -173.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.622 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -86.25 -41.61 14.47 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 -179.323 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 45.4 mt -57.37 -50.84 75.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 171.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 13.9 mm -66.85 -50.4 65.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 CA-C-O 119.128 -0.463 . . . . 0.0 112.094 -177.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 87.6 p -58.95 -31.98 69.2 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 118.973 -1.091 . . . . 0.0 110.438 178.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 57.1 tp -68.97 -44.7 72.4 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 118.765 -0.636 . . . . 0.0 112.145 178.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.0 pt -72.01 -34.71 51.49 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 119.682 1.128 . . . . 0.0 112.0 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.4 mt -64.86 -50.83 73.32 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.103 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 177.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -58.43 -41.2 84.48 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.498 177.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -57.95 -40.86 81.57 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 176.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.637 ' HB2' ' HG ' ' A' ' 65' ' ' SER . 9.2 t -64.21 -53.57 47.09 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 121.245 -0.182 . . . . 0.0 111.42 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -72.4 -23.42 61.09 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 113.761 1.022 . . . . 0.0 113.761 -172.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.9 mt -84.03 -15.06 48.96 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.412 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 95.0 m -112.45 158.31 37.66 Favored Pre-proline 0 CA--C 1.533 0.318 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -171.008 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.412 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 74.3 Cg_endo -66.51 -177.47 0.91 Allowed 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 125.09 3.86 . . . . 0.0 113.486 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -55.18 -41.15 71.52 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.114 1.365 . . . . 0.0 114.26 -171.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.4 p -59.74 -32.33 70.46 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 28.9 m170 -88.99 -15.95 32.9 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 119.086 -0.483 . . . . 0.0 111.527 -178.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -68.87 -46.35 68.68 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 170.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 64.3 tp -66.5 -46.66 75.5 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.81 0.338 . . . . 0.0 110.111 177.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.81 -44.07 96.14 Favored Glycine 0 C--N 1.337 0.592 0 N-CA-C 110.7 -0.96 . . . . 0.0 110.7 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.637 ' HG ' ' HB2' ' A' ' 54' ' ' SER . 18.3 t -66.18 -38.53 88.24 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 117.467 0.633 . . . . 0.0 110.367 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 23.3 mt -58.62 -40.12 82.4 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 119.123 0.874 . . . . 0.0 110.717 175.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -69.02 -32.46 71.99 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 119.137 0.881 . . . . 0.0 111.497 178.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 70.8 mt -71.38 -48.21 54.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 O-C-N 121.639 -0.663 . . . . 0.0 110.252 177.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.6 mt -59.56 -36.15 63.32 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.176 0 C-N-CA 124.111 0.964 . . . . 0.0 109.307 176.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -64.33 -52.46 58.34 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.597 0.759 . . . . 0.0 110.54 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.8 t -66.14 -50.56 63.56 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 118.855 -1.138 . . . . 0.0 111.93 -176.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 52.2 mt -65.07 -37.43 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 110.289 -0.263 . . . . 0.0 110.289 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.41 -48.48 57.47 Favored Glycine 0 C--N 1.338 0.658 0 N-CA-C 111.95 -0.46 . . . . 0.0 111.95 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.445 HH22 ' C ' ' B' ' 166' ' ' SEP . 4.8 mtp-105 -67.61 -35.11 78.34 Favored 'General case' 0 C--O 1.23 0.061 0 CA-C-N 117.685 0.742 . . . . 0.0 110.701 179.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.61 -42.77 81.86 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 177.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 -62.43 -46.84 86.71 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 176.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 57.6 tp -58.63 -45.1 89.99 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 123.461 0.476 . . . . 0.0 110.424 -177.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -65.79 -46.56 78.27 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.553 -0.092 . . . . 0.0 110.878 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -69.89 -30.9 68.44 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -174.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.5 t -86.35 -26.58 24.77 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 118.61 0.641 . . . . 0.0 111.37 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -73.39 -31.07 63.69 Favored 'General case' 0 CA--C 1.529 0.152 0 O-C-N 122.206 -0.309 . . . . 0.0 110.326 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 31.2 t -61.97 -14.46 35.24 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.634 0.774 . . . . 0.0 112.365 179.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -71.09 -20.17 62.38 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.949 -0.469 . . . . 0.0 111.013 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 36.7 m 49.45 24.45 1.1 Allowed 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 177.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -147.93 160.17 43.09 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.21 0.459 . . . . 0.0 110.506 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 33.0 t -147.67 161.54 40.96 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 123.368 0.667 . . . . 0.0 109.9 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 93.2 p -149.19 171.36 16.58 Favored 'General case' 0 C--O 1.231 0.113 0 C-N-CA 122.831 0.453 . . . . 0.0 110.95 -178.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 35.7 m -80.24 5.69 13.93 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.931 0.493 . . . . 0.0 111.823 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -75.29 159.4 31.54 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 122.9 0.48 . . . . 0.0 110.29 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -70.22 152.85 95.58 Favored Pre-proline 0 CA--C 1.531 0.241 0 C-N-CA 123.092 0.557 . . . . 0.0 110.604 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -70.16 164.42 34.99 Favored 'Trans proline' 0 N--CA 1.452 -0.945 0 C-N-CA 123.746 2.964 . . . . 0.0 111.302 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -175.6 177.45 47.41 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.609 -0.996 . . . . 0.0 110.609 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 50.62 -151.72 0.2 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.46 0.704 . . . . 0.0 112.58 176.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 26.3 p -50.24 -30.37 11.52 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.98 -41.37 95.49 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.308 -0.87 . . . . 0.0 110.152 176.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 -66.11 -34.72 78.7 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.111 0.481 . . . . 0.0 110.33 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.56 -45.15 91.81 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.964 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 98.3 mt -63.54 -42.92 97.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 175.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -61.03 -33.24 72.98 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 122.379 -0.201 . . . . 0.0 110.852 179.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 86.1 m -75.48 -41.33 55.73 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.467 0.307 . . . . 0.0 111.191 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.5 mt -62.01 -30.29 70.85 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 174.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.08 -14.58 25.51 Favored Glycine 0 CA--C 1.53 1.014 0 CA-C-O 119.174 -0.792 . . . . 0.0 113.668 178.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -101.95 -3.73 27.32 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.846 1.323 . . . . 0.0 112.136 -179.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 26.8 m -125.86 -18.82 3.0 Favored 'Isoleucine or valine' 0 C--N 1.338 0.074 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -178.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.4 tp -50.83 -27.12 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -177.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -64.98 -46.35 81.83 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 118.03 0.377 . . . . 0.0 110.886 178.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -74.23 -40.81 62.16 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -178.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 89.5 mt -60.32 -50.3 74.18 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.422 -177.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 78.0 mt -66.51 -59.62 3.48 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 118.383 -0.818 . . . . 0.0 110.245 177.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 62.2 p -49.45 -42.09 42.05 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 118.951 0.796 . . . . 0.0 111.898 -173.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -70.57 -51.69 26.77 Favored 'General case' 0 C--O 1.226 -0.152 0 CA-C-N 118.638 0.654 . . . . 0.0 110.863 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.06 -32.43 64.08 Favored 'General case' 0 C--O 1.228 -0.078 0 C-N-CA 123.836 0.854 . . . . 0.0 113.044 -178.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -86.94 -36.43 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.151 0 CA-C-N 119.446 1.021 . . . . 0.0 112.35 175.237 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.92 -28.37 66.6 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.395 0.543 . . . . 0.0 111.0 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.0 -18.12 54.18 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.0 0.92 . . . . 0.0 110.843 178.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 14.9 m -79.07 166.4 22.33 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -174.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -107.93 -174.15 2.45 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.307 1.443 . . . . 0.0 107.886 173.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -50.89 -55.22 18.15 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.349 0.66 . . . . 0.0 112.097 -177.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -68.79 -32.74 72.69 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 122.004 -0.435 . . . . 0.0 111.617 -176.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 58.8 m-70 -76.67 -42.04 43.31 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 118.796 -0.621 . . . . 0.0 111.419 -177.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.73 -33.19 75.09 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 119.328 0.967 . . . . 0.0 108.787 176.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.07 -46.21 90.12 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.172 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.509 ' HE3' ' CE1' ' B' ' 155' ' ' TYR . 34.7 mtmm -62.42 -42.33 99.37 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.352 176.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.6 mt -66.19 -35.06 74.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -67.43 -38.31 84.36 Favored 'General case' 0 C--O 1.227 -0.107 0 O-C-N 121.986 -0.446 . . . . 0.0 110.637 178.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 64.6 ttp -66.07 -40.99 91.33 Favored 'General case' 0 N--CA 1.457 -0.116 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 176.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.9 tt -59.24 -45.01 92.31 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 177.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 91.2 mt -71.36 -28.68 64.22 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -67.51 -38.33 84.12 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 118.482 0.583 . . . . 0.0 109.506 176.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 95.6 mt -69.81 -37.7 74.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 176.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 16.6 m0 -64.5 -33.3 75.57 Favored 'General case' 0 C--N 1.341 0.226 0 O-C-N 122.06 -0.4 . . . . 0.0 110.817 175.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -73.48 -36.29 65.78 Favored 'General case' 0 CA--C 1.531 0.218 0 O-C-N 122.374 -0.204 . . . . 0.0 110.825 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -74.71 -33.82 62.47 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 21.3 t -100.22 -14.9 18.29 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 -176.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -70.4 164.26 52.59 Favored Glycine 0 CA--C 1.528 0.847 0 O-C-N 121.953 -0.467 . . . . 0.0 112.457 -176.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 85.3 mt -104.29 0.03 28.8 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.615 0.766 . . . . 0.0 110.862 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.415 ' CG ' ' N ' ' A' ' 138' ' ' GLN . 57.4 t80 -88.82 -177.77 5.59 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.693 0.797 . . . . 0.0 109.877 178.355 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . 0.415 ' N ' ' CG ' ' A' ' 137' ' ' PHE . 85.5 mt-30 -55.82 151.79 10.82 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 122.829 0.452 . . . . 0.0 109.846 177.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -115.32 174.79 5.81 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -170.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 20.3 m 63.28 -2.2 0.47 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 125.586 1.554 . . . . 0.0 114.3 -178.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 26.0 p90 -161.82 156.9 23.29 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 118.465 0.575 . . . . 0.0 110.719 175.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 95.8 mt -136.95 160.15 39.76 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 124.495 1.118 . . . . 0.0 108.747 178.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -99.93 -37.74 8.9 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -176.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . 0.434 ' C ' ' H ' ' A' ' 146' ' ' ARG . . . -47.58 -39.88 17.83 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 124.725 1.21 . . . . 0.0 113.359 -171.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -71.64 29.39 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 123.043 0.537 . . . . 0.0 112.374 174.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.434 ' H ' ' C ' ' A' ' 144' ' ' ALA . 80.7 mtp180 48.51 30.24 2.36 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 123.72 0.808 . . . . 0.0 110.718 -172.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 75.4 m 46.87 22.59 0.2 Allowed 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 -175.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -125.02 -169.84 2.06 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 -172.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 29.0 p -51.68 -14.74 0.37 Allowed 'General case' 0 C--O 1.231 0.103 0 C-N-CA 126.191 1.797 . . . . 0.0 115.417 -169.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -37.39 -69.69 0.11 Allowed 'General case' 0 C--N 1.341 0.208 0 CA-C-N 118.829 0.74 . . . . 0.0 110.576 176.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -111.65 -11.75 13.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 119.101 -0.476 . . . . 0.0 111.218 169.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 31.6 mmt -71.34 -14.14 62.09 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.198 0.908 . . . . 0.0 110.335 175.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 8.1 t70 63.79 -14.28 0.08 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.853 1.661 . . . . 0.0 114.534 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 1.5 pt? . . . . . 0 C--O 1.254 1.296 0 CA-C-O 117.654 -1.165 . . . . 0.0 111.28 173.55 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 155' ' ' TYR . . . . . 0.509 ' CE1' ' HE3' ' A' ' 123' ' ' LYS . 29.0 t80 . . . . . 0 N--CA 1.473 0.68 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 84.2 p -71.86 156.49 90.96 Favored Pre-proline 0 N--CA 1.456 -0.152 0 C-N-CA 122.491 0.316 . . . . 0.0 111.085 -178.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -74.26 -2.95 13.05 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 123.879 3.053 . . . . 0.0 112.088 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 72.1 p 46.93 34.31 2.64 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.285 1.034 . . . . 0.0 112.7 -179.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 160' ' ' PRO . . . . . 0.508 ' HG2' ' H ' ' B' ' 161' ' ' SER . 58.4 Cg_endo -65.62 -62.7 0.03 OUTLIER 'Cis proline' 0 N--CA 1.457 -0.62 0 CA-C-N 119.176 0.741 . . . . 0.0 111.698 -2.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 161' ' ' SER . . . . . 0.508 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 65.9 p -170.47 148.48 3.14 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.18 0.992 . . . . 0.0 108.997 175.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -158.62 137.96 11.62 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 120.677 0.275 . . . . 0.0 111.628 172.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 16.3 t -137.69 144.76 45.93 Favored Pre-proline 0 CA--C 1.529 0.138 0 C-N-CA 123.743 0.817 . . . . 0.0 110.152 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -66.23 -1.46 5.46 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 123.305 2.67 . . . . 0.0 111.712 177.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 39.4 p -75.33 -26.31 58.52 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 119.125 -0.464 . . . . 0.0 111.414 178.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 166' ' ' SEP . . . . . 0.445 ' C ' HH22 ' A' ' 74' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -65.84 170.84 10.77 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 123.2 2.6 . . . . 0.0 111.543 174.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 75.5 m . . . . . 0 C--O 1.251 1.173 0 CA-C-O 116.955 -1.497 . . . . 0.0 111.68 179.708 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.3 ptt? . . . . . 0 N--CA 1.474 0.77 0 CA-C-O 120.27 0.081 . . . . 0.0 110.994 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -148.77 -25.07 0.31 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 122.958 0.503 . . . . 0.0 111.294 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -149.3 16.99 0.93 Allowed 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.146 0.43 . . . . 0.0 111.911 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 58.82 9.17 1.1 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.73 1.212 . . . . 0.0 113.462 -177.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -142.64 15.6 1.98 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.96 0.904 . . . . 0.0 110.423 177.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -77.42 -151.32 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.469 1.108 . . . . 0.0 110.0 176.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -54.98 -16.41 2.73 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.199 0.6 . . . . 0.0 110.776 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -54.53 -39.16 67.4 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 118.944 -0.551 . . . . 0.0 110.289 173.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 -64.82 -42.31 95.08 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-N 118.947 0.794 . . . . 0.0 110.216 178.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -64.89 -50.32 67.0 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 118.087 0.403 . . . . 0.0 110.425 -178.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 93.0 t -63.75 -54.15 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.6 -30.69 67.42 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 122.781 0.432 . . . . 0.0 111.589 -178.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 54.0 m -74.64 -41.91 59.5 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.268 0.485 . . . . 0.0 110.594 177.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.4 tp -67.05 -29.75 69.62 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -71.04 -39.92 71.99 Favored 'General case' 0 CA--C 1.523 -0.09 0 C-N-CA 124.032 0.933 . . . . 0.0 109.868 175.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.6 t -63.78 -28.75 70.09 Favored 'General case' 0 N--CA 1.456 -0.134 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 173.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.52 -32.25 60.42 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 110.002 -0.369 . . . . 0.0 110.002 174.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -67.74 -33.28 74.56 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 122.678 0.391 . . . . 0.0 110.203 176.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -72.26 -14.3 61.74 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.956 0.502 . . . . 0.0 110.835 174.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.2 pp 51.67 170.59 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 128.02 2.528 . . . . 0.0 115.531 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.2 tptm -141.1 26.02 2.05 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.741 1.216 . . . . 0.0 109.499 -179.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 24.3 m 56.13 22.09 5.73 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.482 0.713 . . . . 0.0 112.003 -175.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -164.9 -162.14 15.32 Favored Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 178.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 20.7 mm -125.63 68.06 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 C-N-CA 124.732 1.213 . . . . 0.0 108.641 -173.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.406 ' HB2' HH11 ' A' ' 28' ' ' ARG . 73.8 m -59.35 132.41 53.93 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.112 0.565 . . . . 0.0 112.41 -175.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.73 -23.62 72.44 Favored Glycine 0 C--N 1.337 0.627 0 C-N-CA 124.117 0.865 . . . . 0.0 112.581 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.449 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 36.6 t -65.08 -41.12 95.32 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 118.533 1.167 . . . . 0.0 110.46 -175.372 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.406 HH11 ' HB2' ' A' ' 25' ' ' SER . 81.0 mtt85 -69.57 -38.8 77.54 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 75.9 mt -64.17 -39.42 85.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 176.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp -67.7 -36.86 81.41 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.348 -0.358 . . . . 0.0 111.412 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.446 ' HE3' ' O ' ' A' ' 27' ' ' SER . 0.0 OUTLIER -68.98 -43.93 73.94 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.676 0.671 . . . . 0.0 110.703 175.484 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.4 mt -62.85 -56.47 17.05 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 110.605 -0.146 . . . . 0.0 110.605 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.441 HG23 ' HB2' ' A' ' 71' ' ' SER . 50.8 p -56.3 -49.18 75.04 Favored 'General case' 0 CA--C 1.522 -0.13 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 177.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 t -62.28 -43.86 97.86 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.964 -174.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -68.47 -35.54 77.71 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 118.721 -1.192 . . . . 0.0 111.503 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.86 -58.0 10.57 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.132 0.424 . . . . 0.0 110.226 174.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.83 -16.23 63.23 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -176.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -59.62 -27.25 66.15 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.3 t-80 -152.3 -23.63 0.17 Allowed 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 -176.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 33.5 mm 46.51 74.96 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 123.431 0.693 . . . . 0.0 111.675 -178.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -147.24 20.57 1.22 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.857 0.863 . . . . 0.0 109.8 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.579 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.3 pt -147.45 35.33 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 C-N-CA 124.291 1.036 . . . . 0.0 109.805 -171.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.457 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -50.61 -58.16 6.5 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.205 1.002 . . . . 0.0 113.601 -177.05 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 52.9 m -73.09 -26.8 61.38 Favored 'General case' 0 CA--C 1.52 -0.192 0 O-C-N 121.864 -0.523 . . . . 0.0 112.4 -174.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.619 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.76 -44.12 15.95 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 119.305 -0.378 . . . . 0.0 109.989 -178.741 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 16.7 mt -56.22 -51.93 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.125 0 CA-C-N 118.303 0.502 . . . . 0.0 109.711 171.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 13.4 mm -66.8 -49.45 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -176.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 34.2 t -56.66 -36.72 69.88 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 119.987 -0.685 . . . . 0.0 109.646 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.1 tp -69.71 -42.37 74.12 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 118.444 -0.789 . . . . 0.0 112.63 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 32.1 pt -72.99 -37.64 54.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 120.003 1.274 . . . . 0.0 111.773 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 95.5 mt -63.39 -49.6 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -59.21 -41.72 89.28 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.762 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -55.83 -40.13 72.38 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 176.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -67.9 -52.6 34.47 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -69.0 -23.03 64.05 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -173.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 55.9 mt -81.33 -14.84 56.85 Favored 'General case' 0 C--O 1.231 0.113 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 177.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.524 ' HB3' ' CG ' ' A' ' 61' ' ' HIS . 76.4 m -126.39 157.89 68.91 Favored Pre-proline 0 CA--C 1.539 0.554 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -170.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.438 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 64.0 Cg_endo -74.76 -166.56 0.35 Allowed 'Trans proline' 0 CA--C 1.537 0.665 1 C-N-CA 125.34 4.027 . . . . 0.0 114.648 -176.07 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -38.77 -57.2 1.24 Allowed 'General case' 0 C--O 1.236 0.358 0 C-N-CA 128.167 2.587 . . . . 0.0 115.342 -173.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.3 t -58.92 -31.49 68.7 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.774 0.321 . . . . 0.0 110.46 -175.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.524 ' CG ' ' HB3' ' A' ' 57' ' ' CYS . 16.2 m80 -82.49 -23.9 34.45 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.076 0.551 . . . . 0.0 111.272 -178.219 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -68.31 -44.67 74.89 Favored 'General case' 0 C--N 1.342 0.25 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 172.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 49.2 tp -66.39 -46.2 77.42 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.271 178.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.63 -44.0 97.22 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.153 -1.179 . . . . 0.0 110.153 177.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.3 t -55.82 -50.51 70.32 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.941 0.371 . . . . 0.0 110.064 177.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 37.5 mt -58.58 -39.94 81.74 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 118.692 -0.671 . . . . 0.0 111.645 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -69.2 -29.36 67.32 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.081 0.855 . . . . 0.0 111.789 179.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 64.1 mt -79.1 -39.24 21.18 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 O-C-N 121.797 -0.564 . . . . 0.0 110.588 178.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 75.9 mt -64.81 -35.8 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 175.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.12 -52.79 53.25 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.102 1.361 . . . . 0.0 110.127 177.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.441 ' HB2' HG23 ' A' ' 33' ' ' THR . 81.3 p -66.38 -52.52 45.96 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 120.049 -0.66 . . . . 0.0 112.015 -175.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 37.6 mt -67.86 -34.43 67.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 CA-C-N 117.641 0.2 . . . . 0.0 110.649 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.98 -50.16 59.27 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 111.692 -0.563 . . . . 0.0 111.692 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.7 mtp-105 -68.02 -36.96 80.82 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-N 117.364 0.582 . . . . 0.0 110.866 178.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.95 -40.95 83.14 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 117.623 0.192 . . . . 0.0 110.551 179.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.8 m-30 -64.79 -45.45 86.24 Favored 'General case' 0 CA--C 1.516 -0.332 0 O-C-N 122.147 -0.346 . . . . 0.0 110.093 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 48.4 tp -59.34 -44.7 92.61 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 123.37 0.419 . . . . 0.0 110.209 -177.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -66.3 -43.74 85.42 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 122.259 -0.276 . . . . 0.0 110.315 177.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.1 tp10 -67.03 -27.71 67.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 119.485 -0.293 . . . . 0.0 111.745 -176.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.9 t -94.04 -23.76 17.88 Favored 'General case' 0 CA--C 1.528 0.115 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 69.9 mtm180 -91.61 -33.68 15.01 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-N 119.097 0.862 . . . . 0.0 112.592 176.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 39.5 m -90.29 -10.32 44.61 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -176.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -141.14 158.27 44.14 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.593 0.357 . . . . 0.0 110.221 -178.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 50.3 m -81.59 165.13 21.38 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 122.953 0.501 . . . . 0.0 110.763 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -143.8 162.39 36.18 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.308 0.643 . . . . 0.0 109.788 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 83.8 p -78.74 169.15 18.68 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.225 0.61 . . . . 0.0 111.229 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 52.2 m -137.21 155.05 50.0 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 123.054 0.542 . . . . 0.0 110.227 178.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 50.6 m 57.69 176.17 0.05 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.37 1.068 . . . . 0.0 112.737 -176.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 48.4 t30 55.65 16.01 1.78 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.235 1.014 . . . . 0.0 113.085 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -145.69 150.79 44.53 Favored Pre-proline 0 CA--C 1.53 0.178 0 C-N-CA 123.825 0.85 . . . . 0.0 109.827 179.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -76.39 -14.89 18.06 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 123.424 2.75 . . . . 0.0 110.837 177.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 148.24 -176.13 27.21 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.181 -1.168 . . . . 0.0 110.181 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -152.76 -157.22 0.77 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 122.897 0.479 . . . . 0.0 110.392 176.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.9 p -48.35 -32.58 7.67 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -176.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.82 -46.73 83.8 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.835 0.743 . . . . 0.0 110.074 176.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 66.9 m80 -67.07 -29.79 69.67 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.005 0.522 . . . . 0.0 110.593 178.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.14 -46.6 80.25 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 122.99 0.516 . . . . 0.0 110.462 177.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.8 -42.77 97.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 176.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -61.48 -33.94 74.63 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 122.257 -0.277 . . . . 0.0 111.165 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.1 m -73.36 -42.16 62.56 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.161 -0.337 . . . . 0.0 110.889 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 47.8 mt -60.09 -31.4 69.99 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 174.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.55 -14.53 14.47 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-O 119.019 -0.878 . . . . 0.0 114.23 178.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -101.63 -6.25 24.03 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.957 1.379 . . . . 0.0 112.059 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 30.1 m -121.75 -19.36 4.56 Favored 'Isoleucine or valine' 0 C--N 1.337 0.048 0 C-N-CA 123.099 0.56 . . . . 0.0 111.846 -178.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.9 tp -52.14 -26.99 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 C-N-CA 122.891 0.476 . . . . 0.0 112.055 -178.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -59.44 -57.21 14.0 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 122.896 0.479 . . . . 0.0 111.499 177.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -76.37 -32.81 58.82 Favored 'General case' 0 N--CA 1.457 -0.115 0 O-C-N 122.137 -0.352 . . . . 0.0 111.409 -177.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.4 mt -61.65 -49.48 76.39 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 70.7 mt -65.41 -58.18 6.49 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.343 -0.836 . . . . 0.0 109.989 177.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 98.0 p -50.33 -43.93 54.14 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.093 0.861 . . . . 0.0 111.735 -173.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -68.49 -52.53 31.32 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 118.422 0.555 . . . . 0.0 110.776 177.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.447 ' O ' ' HE3' ' A' ' 115' ' ' LYS . . . -56.19 -33.06 64.96 Favored 'General case' 0 N--CA 1.457 -0.107 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -177.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -87.15 -36.16 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 119.853 1.206 . . . . 0.0 112.374 175.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.44 -25.49 63.22 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 119.771 -0.772 . . . . 0.0 110.747 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.447 ' HE3' ' O ' ' A' ' 112' ' ' ALA . 0.1 OUTLIER -80.2 -20.09 45.52 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.629 0.772 . . . . 0.0 110.536 177.277 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.7 m -77.08 159.18 30.03 Favored 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -171.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -90.62 175.79 6.91 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.831 1.253 . . . . 0.0 107.859 170.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -55.97 -40.76 73.73 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.832 -0.542 . . . . 0.0 112.069 -177.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -69.7 -36.77 76.22 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.958 -0.464 . . . . 0.0 110.654 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -75.3 -42.92 53.63 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 118.734 -0.651 . . . . 0.0 110.843 -178.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.88 -33.66 76.54 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 119.539 1.063 . . . . 0.0 109.78 176.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.1 -46.5 87.04 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.023 177.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -63.89 -37.59 87.97 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.688 177.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 92.7 mt -68.58 -35.55 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -65.44 -40.1 92.86 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 176.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 24.2 ttt -62.41 -43.13 99.55 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 176.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.0 tt -58.04 -44.63 87.52 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 178.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.9 mt -71.45 -32.13 67.97 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -64.66 -43.55 93.24 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.3 mt -66.26 -39.52 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 59.8 t-105 -63.66 -29.21 70.48 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 122.177 0.191 . . . . 0.0 110.743 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -73.17 -42.39 62.82 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 174.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -70.51 -16.24 62.87 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 67.6 m -62.39 -14.67 42.78 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 118.381 0.537 . . . . 0.0 112.068 175.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 75.5 10.74 84.62 Favored Glycine 0 CA--C 1.531 1.049 0 CA-C-O 119.696 -0.502 . . . . 0.0 113.035 176.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 54.0 tp -68.12 -20.48 64.91 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.06 0.93 . . . . 0.0 110.461 178.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -144.67 170.05 16.82 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.174 0.99 . . . . 0.0 108.959 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 54.3 mm-40 -68.73 163.73 23.32 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -62.96 138.56 58.59 Favored 'General case' 0 N--CA 1.455 -0.183 0 O-C-N 122.07 -0.394 . . . . 0.0 110.571 -178.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 23.5 m 54.48 21.65 3.43 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.109 0.964 . . . . 0.0 112.958 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -86.26 -7.14 58.74 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 122.245 -0.285 . . . . 0.0 111.684 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 82.7 mt -68.4 138.35 55.27 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -132.73 -17.34 2.52 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 119.307 -0.378 . . . . 0.0 111.459 -177.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . 0.489 ' C ' ' H ' ' A' ' 146' ' ' ARG . . . -40.67 -40.29 1.26 Allowed 'General case' 0 C--N 1.343 0.29 0 C-N-CA 125.766 1.627 . . . . 0.0 113.439 -174.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -68.77 22.03 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 123.245 0.618 . . . . 0.0 112.387 175.708 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.489 ' H ' ' C ' ' A' ' 144' ' ' ALA . 79.3 mtp180 51.34 24.61 2.18 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 124.684 1.193 . . . . 0.0 110.959 -170.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 9.1 t 49.39 23.76 0.93 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.06 0.544 . . . . 0.0 111.96 -171.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -97.78 170.13 9.2 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.614 0.766 . . . . 0.0 112.773 -173.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 28.6 p -55.09 -14.09 1.45 Allowed 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 124.426 1.091 . . . . 0.0 112.306 -177.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 18.6 m-30 -29.96 -66.21 0.1 Allowed 'General case' 0 C--N 1.34 0.164 0 C-N-CA 125.033 1.333 . . . . 0.0 110.35 175.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -113.18 -13.11 13.03 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.168 167.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 32.3 mmt -73.46 0.14 13.26 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.934 0.788 . . . . 0.0 111.969 179.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -55.45 -20.6 12.99 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.508 0.723 . . . . 0.0 112.066 175.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 95.6 mt . . . . . 0 C--O 1.249 1.063 0 CA-C-O 117.666 -1.159 . . . . 0.0 109.75 179.106 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 54.1 p90 . . . . . 0 N--CA 1.475 0.783 0 CA-C-O 120.568 0.223 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 90.1 p -150.97 166.61 14.69 Favored Pre-proline 0 CA--C 1.532 0.287 0 C-N-CA 123.209 0.604 . . . . 0.0 109.839 -179.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -54.02 149.83 33.5 Favored 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 123.69 2.927 . . . . 0.0 112.794 178.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 43.5 p -139.86 21.02 2.49 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 123.158 0.583 . . . . 0.0 111.752 -177.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 160' ' ' PRO . . . . . 0.565 ' HG2' ' H ' ' B' ' 161' ' ' SER . 63.5 Cg_endo -69.21 -65.16 0.03 OUTLIER 'Cis proline' 0 N--CA 1.456 -0.69 0 CA-C-N 119.572 0.883 . . . . 0.0 110.864 -4.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 161' ' ' SER . . . . . 0.565 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 41.2 t -168.43 145.55 3.96 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 124.186 0.994 . . . . 0.0 108.585 175.109 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -157.75 137.84 12.52 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 117.842 0.292 . . . . 0.0 111.434 174.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 12.2 t -135.37 144.98 51.87 Favored Pre-proline 0 N--CA 1.454 -0.227 0 C-N-CA 123.773 0.829 . . . . 0.0 110.362 -178.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -67.81 -0.09 4.95 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 123.186 2.591 . . . . 0.0 110.707 178.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 37.9 m -71.08 -30.24 66.31 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.582 0.353 . . . . 0.0 110.568 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -74.15 -20.81 18.62 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 123.369 2.713 . . . . 0.0 112.446 178.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 31.0 t . . . . . 0 C--O 1.252 1.222 0 CA-C-O 117.268 -1.348 . . . . 0.0 110.703 -177.424 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.474 0.756 0 N-CA-C 110.56 -0.163 . . . . 0.0 110.56 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -137.44 163.84 30.11 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.243 0.617 . . . . 0.0 109.93 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -147.58 148.74 31.46 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 120.974 0.416 . . . . 0.0 110.588 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -149.11 156.86 42.83 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.969 0.908 . . . . 0.0 108.821 176.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -137.52 24.66 2.91 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -177.188 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.433 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 14.8 t70 -81.3 -151.73 0.09 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 175.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.433 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 16.0 t80 -55.81 -14.77 2.55 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.768 -0.583 . . . . 0.0 111.189 177.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.5 tp60 -55.3 -40.18 70.79 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.265 0.626 . . . . 0.0 110.836 177.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -64.44 -38.64 91.72 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.754 0.706 . . . . 0.0 111.004 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -64.46 -55.13 22.86 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.501 0.591 . . . . 0.0 109.897 178.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.8 t -60.04 -55.37 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 -178.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.12 -33.28 67.19 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 123.248 0.619 . . . . 0.0 112.026 -178.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 53.5 m -70.22 -45.17 67.11 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.847 0.749 . . . . 0.0 110.415 177.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.8 tp -65.6 -33.06 75.04 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.216 0.531 . . . . 0.0 109.741 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -66.72 -45.92 77.15 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 123.916 0.886 . . . . 0.0 110.325 178.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 73.1 m -63.23 -29.45 70.79 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 174.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.79 -29.62 64.66 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.545 0.338 . . . . 0.0 110.264 176.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -77.7 -43.54 30.79 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.894 0.478 . . . . 0.0 111.635 176.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -76.1 -26.61 56.61 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 112.956 0.725 . . . . 0.0 112.956 -173.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.1 mt -141.61 160.0 41.07 Favored 'General case' 0 N--CA 1.458 -0.057 0 C-N-CA 122.868 0.467 . . . . 0.0 110.756 -177.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -104.44 158.58 16.37 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 123.194 0.597 . . . . 0.0 109.793 177.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 92.3 p -146.56 11.18 1.11 Allowed 'General case' 0 CA--C 1.527 0.083 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.81 30.96 62.91 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 110.354 -1.099 . . . . 0.0 110.354 -176.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.4 mm 58.29 42.99 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 C-N-CA 124.123 0.969 . . . . 0.0 110.389 -175.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.0 t -57.53 136.56 56.74 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 120.974 0.416 . . . . 0.0 110.844 -177.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.59 -24.12 72.4 Favored Glycine 0 CA--C 1.526 0.731 0 CA-C-O 118.999 -0.889 . . . . 0.0 113.911 -172.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.412 ' O ' ' HE3' ' A' ' 31' ' ' LYS . 81.0 p -63.36 -35.89 81.9 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 118.958 1.379 . . . . 0.0 111.217 -175.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -65.52 -44.54 86.65 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 178.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 48.7 mt -61.5 -40.59 86.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -63.68 -38.5 91.36 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 119.241 -0.409 . . . . 0.0 111.415 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.412 ' HE3' ' O ' ' A' ' 27' ' ' SER . 0.0 OUTLIER -64.28 -47.32 79.96 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 118.627 0.649 . . . . 0.0 109.85 175.194 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 92.8 mt -60.28 -56.82 16.89 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 122.395 -0.191 . . . . 0.0 110.973 -178.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 75.9 p -58.28 -48.06 81.65 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 t -63.27 -42.48 99.13 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.247 -0.581 . . . . 0.0 111.453 -175.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -75.56 -22.94 56.57 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.99 -55.6 13.77 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 119.043 0.838 . . . . 0.0 109.166 167.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 61.8 mt -69.78 -15.72 63.17 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.21 1.004 . . . . 0.0 113.05 -175.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -57.07 -29.49 63.49 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -178.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.5 t-160 -150.91 -24.65 0.22 Allowed 'General case' 0 N--CA 1.461 0.122 0 N-CA-C 113.994 1.109 . . . . 0.0 113.994 -176.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 40.3 mm 45.73 73.92 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-O 122.06 0.933 . . . . 0.0 111.351 -179.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -138.02 8.63 2.75 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.23 1.012 . . . . 0.0 109.83 178.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.493 HG21 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -142.72 109.61 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 125.142 1.377 . . . . 0.0 107.913 -178.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.433 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -104.92 -67.96 0.88 Allowed 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -177.342 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.422 ' H ' ' HG2' ' A' ' 43' ' ' GLU . 81.6 p -68.29 -23.16 64.71 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 122.98 0.512 . . . . 0.0 111.894 -173.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.571 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -73.36 -54.8 7.45 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.799 0.84 . . . . 0.0 109.299 178.377 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.459 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 8.6 mt -57.25 -45.79 84.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 C-N-CA 122.836 0.454 . . . . 0.0 110.143 175.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 14.6 mm -69.5 -47.98 69.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 CA-C-O 119.143 -0.456 . . . . 0.0 111.988 -177.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 95.5 p -63.02 -30.65 71.76 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-N 119.294 0.952 . . . . 0.0 110.227 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 46.4 tp -68.66 -45.72 71.0 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 119.15 -0.452 . . . . 0.0 111.772 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.5 pt -73.08 -36.77 51.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 119.192 0.905 . . . . 0.0 111.677 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 93.7 mt -62.03 -53.33 49.23 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.124 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -62.67 -31.47 72.37 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.517 179.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -61.14 -41.42 96.72 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.4 ' HB2' ' HG ' ' A' ' 65' ' ' SER . 26.1 t -69.36 -35.99 76.4 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.935 175.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 50.9 tpt85 -66.53 -41.82 88.15 Favored 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -174.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 71.7 mt -96.06 -14.51 22.86 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 113.952 1.093 . . . . 0.0 113.952 -172.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 82.0 m -101.61 162.48 20.31 Favored Pre-proline 0 CA--C 1.536 0.432 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -170.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_exo -55.68 177.49 0.13 Allowed 'Trans proline' 0 N--CA 1.461 -0.431 1 C-N-CA 125.637 4.225 . . . . 0.0 115.188 179.261 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -56.88 -46.2 82.03 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.28 1.032 . . . . 0.0 113.293 -175.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 73.1 m -60.87 -26.88 67.72 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 5.5 m80 -81.77 -23.74 36.43 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 119.243 -0.408 . . . . 0.0 110.803 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -73.82 -44.77 54.77 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.877 0.762 . . . . 0.0 109.23 175.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.99 -50.09 65.51 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 177.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.59 -41.85 93.8 Favored Glycine 0 C--N 1.337 0.619 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.4 ' HG ' ' HB2' ' A' ' 54' ' ' SER . 20.8 t -67.55 -37.76 83.16 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.713 0.756 . . . . 0.0 110.538 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 32.1 mt -59.79 -36.12 76.07 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 119.522 1.056 . . . . 0.0 110.756 175.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -73.08 -32.76 65.2 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 119.485 -0.886 . . . . 0.0 111.644 176.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 79.0 mt -67.04 -48.03 80.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 118.819 0.736 . . . . 0.0 109.915 175.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 72.1 mt -61.12 -35.9 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 C-N-CA 124.226 1.01 . . . . 0.0 109.431 178.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -66.91 -45.49 77.77 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 118.88 -0.581 . . . . 0.0 110.418 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.5 t -63.86 -54.52 33.63 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 118.794 0.724 . . . . 0.0 111.336 -178.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 55.5 mt -63.16 -33.77 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.22 -51.95 34.96 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-O 119.545 -0.586 . . . . 0.0 112.437 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.636 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -70.51 -31.83 69.08 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 118.056 0.928 . . . . 0.0 110.625 -178.525 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.71 -46.75 71.33 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -61.29 -46.95 88.21 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 176.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 66.4 tp -56.91 -45.63 82.53 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.587 0.355 . . . . 0.0 110.483 -177.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -66.61 -48.28 70.0 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.761 179.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.9 mm-40 -61.87 -27.77 69.03 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -175.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.2 t -97.79 -24.84 15.27 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 36.9 ptt180 -79.13 -24.68 43.18 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 119.346 0.976 . . . . 0.0 111.408 177.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.3 m -68.35 -14.05 62.72 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 175.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -80.27 153.48 28.45 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 120.823 0.344 . . . . 0.0 110.85 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 49.3 m -139.0 23.5 2.59 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.844 0.858 . . . . 0.0 110.353 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.8 p30 -130.7 -174.86 3.48 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.765 0.826 . . . . 0.0 110.383 -176.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 80.7 p -71.25 -2.81 17.33 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -177.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 36.1 m -77.79 0.45 23.7 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.418 0.554 . . . . 0.0 111.747 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 77.8 p -130.71 18.26 5.19 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 123.588 0.755 . . . . 0.0 110.421 177.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -127.33 26.04 6.06 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.725 0.81 . . . . 0.0 110.507 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -129.91 155.56 80.37 Favored Pre-proline 0 C--O 1.231 0.091 0 C-N-CA 124.139 0.976 . . . . 0.0 109.805 -178.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.27 166.4 27.11 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 123.472 2.781 . . . . 0.0 110.864 177.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 82.45 178.03 52.18 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.084 -178.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 53.87 -169.87 0.05 Allowed 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 125.514 1.526 . . . . 0.0 114.901 179.249 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.5 p -50.06 -31.54 13.33 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 -173.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.08 -47.52 82.54 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.872 0.76 . . . . 0.0 109.981 176.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -67.69 -31.29 71.15 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.3 0.572 . . . . 0.0 110.4 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.37 -45.93 82.16 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.366 -178.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.6 mt -64.72 -42.73 95.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 174.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -59.75 -32.81 70.91 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 122.546 -0.096 . . . . 0.0 111.034 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.9 m -76.39 -41.39 48.07 Favored 'General case' 0 C--O 1.227 -0.08 0 C-N-CA 122.421 0.288 . . . . 0.0 111.162 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 58.4 mt -61.79 -29.26 70.02 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-N 118.867 0.758 . . . . 0.0 109.166 174.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.99 -14.38 31.11 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-O 119.199 -0.779 . . . . 0.0 113.562 178.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -101.84 -3.81 27.36 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 118.806 1.303 . . . . 0.0 112.136 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.4 m -125.86 -17.97 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.1 tp -48.96 -30.5 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 C-N-CA 123.171 0.588 . . . . 0.0 112.458 -178.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -64.23 -45.42 88.26 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.24 0.473 . . . . 0.0 110.713 178.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -74.07 -38.95 63.78 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.282 0.633 . . . . 0.0 110.082 -178.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.0 mt -62.92 -53.04 60.2 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.24 -178.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 81.0 mt -63.82 -59.11 4.96 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.71 -0.662 . . . . 0.0 109.463 177.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.417 ' HB2' ' CZ ' ' A' ' 150' ' ' PHE . 77.7 p -48.82 -45.53 40.63 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 119.008 0.822 . . . . 0.0 112.457 -174.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 89.5 m-20 -69.13 -44.76 71.72 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 118.852 0.751 . . . . 0.0 110.764 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.05 -44.88 94.39 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 118.306 0.503 . . . . 0.0 111.434 -177.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.73 -33.44 31.24 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.13 0 CA-C-N 118.661 0.664 . . . . 0.0 112.138 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.21 -26.94 65.97 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.572 176.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.75 -17.65 57.34 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 125.963 1.705 . . . . 0.0 110.842 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 37.6 m -83.48 155.89 23.15 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -172.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 -103.32 -175.94 2.94 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 169.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 22.2 tm0? -55.54 -41.2 72.87 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 119.398 0.999 . . . . 0.0 110.982 -178.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.81 -45.85 87.77 Favored 'General case' 0 C--O 1.233 0.206 0 O-C-N 121.583 -0.698 . . . . 0.0 110.891 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 46.6 m170 -73.29 -37.6 66.19 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 118.783 -0.627 . . . . 0.0 111.737 -176.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.72 -34.03 76.95 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 119.278 0.945 . . . . 0.0 109.0 176.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -66.04 -41.69 90.54 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -65.39 -42.63 92.42 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 176.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.4 -35.87 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 80.1 ttt-85 -67.77 -34.34 76.61 Favored 'General case' 0 N--CA 1.453 -0.316 0 O-C-N 122.31 -0.244 . . . . 0.0 110.708 177.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.2 ttt -66.1 -44.37 84.53 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 176.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 6.4 tt -56.29 -48.9 75.7 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 79.0 mt -73.03 -26.54 61.34 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -178.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -68.42 -36.56 79.26 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 175.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 84.8 mt -69.23 -42.62 81.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.112 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 175.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 28.3 m0 -62.68 -30.64 71.54 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 121.12 -0.232 . . . . 0.0 110.579 177.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -75.44 -40.27 57.79 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 122.115 -0.365 . . . . 0.0 111.378 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 47.1 mtm105 -78.84 -14.08 59.44 Favored 'General case' 0 C--O 1.231 0.098 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 55.7 p -57.68 -18.79 22.71 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 118.394 0.543 . . . . 0.0 111.836 176.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 71.78 9.81 70.87 Favored Glycine 0 CA--C 1.53 0.995 0 CA-C-O 119.435 -0.647 . . . . 0.0 112.528 177.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 58.5 tp -56.72 121.36 9.6 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 118.024 0.912 . . . . 0.0 110.646 -177.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 52.01 11.35 0.15 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.348 1.459 . . . . 0.0 114.058 -178.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 48.85 28.79 2.04 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.391 1.077 . . . . 0.0 113.687 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -75.69 -27.98 58.46 Favored 'General case' 0 C--N 1.34 0.18 0 O-C-N 121.879 -0.513 . . . . 0.0 111.223 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 21.7 m 51.18 18.24 0.57 Allowed 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 177.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -149.58 154.57 38.9 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.236 0.471 . . . . 0.0 110.986 179.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 65.3 tp -153.24 124.25 7.42 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 175.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 53.2 p-10 -77.34 -15.42 59.41 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -175.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -54.84 -32.03 60.11 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.305 0.642 . . . . 0.0 111.703 -173.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.515 HD11 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -116.72 -29.37 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.14 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 171.81 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 95.0 mtt-85 -67.98 -14.09 62.69 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 118.013 0.37 . . . . 0.0 111.491 -177.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 35.6 t -69.21 -23.82 63.94 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 118.746 -0.645 . . . . 0.0 112.167 178.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.562 ' HG2' ' H ' ' A' ' 149' ' ' CYS . 40.6 tttt -155.12 178.52 10.11 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 123.085 1.422 . . . . 0.0 114.729 -176.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . 0.562 ' H ' ' HG2' ' A' ' 148' ' ' LYS . 69.9 m -55.41 -8.54 0.35 Allowed 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 125.785 1.634 . . . . 0.0 112.359 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . 0.417 ' CZ ' ' HB2' ' A' ' 110' ' ' SER . 22.0 m-85 -33.03 -71.41 0.06 Allowed 'General case' 0 CA--C 1.519 -0.229 0 C-N-CA 125.014 1.325 . . . . 0.0 109.408 176.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -113.47 -8.99 13.36 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.111 167.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' MET . . . . . 0.406 ' C ' ' H ' ' A' ' 154' ' ' LEU . 34.4 mmt -73.84 -16.6 61.13 Favored 'General case' 0 C--N 1.345 0.401 0 CA-C-N 120.131 1.332 . . . . 0.0 111.713 176.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 2.3 p30 50.03 -2.07 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 127.136 2.174 . . . . 0.0 116.137 -178.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.406 ' H ' ' C ' ' A' ' 152' ' ' MET . 62.1 tp . . . . . 0 C--O 1.25 1.092 0 CA-C-O 117.18 -1.39 . . . . 0.0 110.173 179.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 39.2 t80 . . . . . 0 N--CA 1.475 0.776 0 CA-C-O 120.498 0.189 . . . . 0.0 110.568 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 62.9 p -144.85 153.75 54.44 Favored Pre-proline 0 CA--C 1.529 0.164 0 C-N-CA 123.537 0.735 . . . . 0.0 110.054 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -70.67 160.05 50.7 Favored 'Trans proline' 0 N--CA 1.453 -0.898 0 C-N-CA 123.941 3.094 . . . . 0.0 111.407 -178.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 64.5 p -135.71 165.0 26.58 Favored 'General case' 0 C--O 1.231 0.115 0 C-N-CA 123.46 0.704 . . . . 0.0 109.85 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_endo -76.27 -179.88 28.68 Favored 'Cis proline' 0 N--CA 1.457 -0.675 0 CA-C-N 118.857 0.628 . . . . 0.0 110.743 -5.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 38.9 t -68.02 152.47 45.47 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 174.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 162' ' ' TYR . . . . . 0.464 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 17.8 t80 -143.81 132.13 22.03 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 29.2 t -127.59 144.36 50.77 Favored Pre-proline 0 N--CA 1.452 -0.365 0 C-N-CA 123.348 0.659 . . . . 0.0 110.619 177.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -65.54 -7.01 14.91 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 122.888 2.392 . . . . 0.0 111.564 175.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 80.6 p -91.95 22.79 4.05 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.043 0.537 . . . . 0.0 111.975 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -61.14 168.4 7.65 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.306 2.004 . . . . 0.0 111.02 170.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 44.8 m . . . . . 0 C--O 1.252 1.185 0 CA-C-O 117.977 -1.011 . . . . 0.0 111.546 -179.067 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt . . . . . 0 N--CA 1.476 0.85 0 CA-C-O 120.537 0.208 . . . . 0.0 110.641 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -139.08 154.38 48.16 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.114 0.566 . . . . 0.0 110.025 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -153.24 147.68 25.98 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.07 0.548 . . . . 0.0 110.114 179.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -150.67 147.29 27.2 Favored 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 175.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -139.08 26.82 2.41 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 123.131 0.572 . . . . 0.0 110.793 -179.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.447 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 16.4 t70 -85.02 -145.06 0.09 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 177.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.447 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 18.1 t80 -55.54 -16.03 3.47 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.351 0.66 . . . . 0.0 111.636 179.205 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -56.04 -43.43 77.84 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.737 0.415 . . . . 0.0 111.018 177.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -63.4 -36.87 85.17 Favored 'General case' 0 C--O 1.227 -0.118 0 CA-C-N 118.321 0.509 . . . . 0.0 110.542 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -65.85 -54.44 26.77 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 117.812 0.278 . . . . 0.0 110.366 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 63.9 t -60.63 -53.73 44.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.03 -32.81 68.33 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 123.453 0.701 . . . . 0.0 112.162 -177.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 88.1 m -73.71 -40.88 63.27 Favored 'General case' 0 C--N 1.338 0.101 0 CA-C-N 118.557 0.617 . . . . 0.0 110.469 176.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.1 tp -66.7 -30.55 70.81 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.957 0.408 . . . . 0.0 110.061 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -72.65 -40.38 66.4 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.03 0.932 . . . . 0.0 109.691 176.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.0 t -62.12 -30.4 71.0 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 174.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.64 -41.53 68.7 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 122.917 0.487 . . . . 0.0 109.89 175.316 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -65.05 -28.92 69.81 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 123.821 0.848 . . . . 0.0 111.269 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -69.13 -14.47 63.01 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.758 0.423 . . . . 0.0 112.056 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.2 mt -101.13 167.76 10.02 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.238 0.615 . . . . 0.0 110.521 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -132.74 -0.64 3.47 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.24 0.616 . . . . 0.0 111.519 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 32.2 t -153.59 159.72 42.23 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.195 0.598 . . . . 0.0 109.475 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.29 137.16 2.12 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -178.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.8 mm -118.37 50.65 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.107 0 C-N-CA 124.5 1.12 . . . . 0.0 108.079 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.545 ' HA ' ' H ' ' B' ' 159' ' ' SEP . 70.2 m -49.9 124.55 10.11 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.025 0.53 . . . . 0.0 111.951 -174.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.86 -19.41 63.19 Favored Glycine 0 CA--C 1.525 0.659 0 CA-C-O 119.584 -0.565 . . . . 0.0 112.301 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.428 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 42.0 t -66.31 -39.2 89.14 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.173 0.987 . . . . 0.0 110.169 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.6 mmp_? -60.09 -45.66 92.19 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 58.3 mt -65.65 -34.51 70.84 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.924 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.7 tmtt? -63.02 -43.75 97.85 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 122.084 -0.385 . . . . 0.0 110.466 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.4 OUTLIER -65.26 -43.73 90.38 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 118.152 0.433 . . . . 0.0 110.705 176.251 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.5 mt -62.17 -57.93 9.65 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 121.261 -0.176 . . . . 0.0 110.875 -178.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.436 HG21 ' HB2' ' A' ' 71' ' ' SER . 51.5 p -56.29 -48.98 75.55 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 178.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.3 t -63.44 -44.86 93.32 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 120.021 -0.672 . . . . 0.0 111.6 -174.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -76.78 -21.33 55.31 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.07 -56.66 9.09 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 167.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 46.9 mt -68.97 -17.51 63.94 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.524 1.13 . . . . 0.0 113.075 -175.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -59.9 -26.14 65.66 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -178.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -149.04 -28.46 0.28 Allowed 'General case' 0 C--N 1.34 0.154 0 N-CA-C 113.84 1.052 . . . . 0.0 113.84 -175.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 37.9 mm 44.87 74.76 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-O 121.923 0.868 . . . . 0.0 111.605 -179.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -147.98 22.41 1.1 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.354 1.062 . . . . 0.0 109.234 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.548 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -148.63 38.83 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.116 0 C-N-CA 124.765 1.226 . . . . 0.0 109.251 -171.176 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.563 ' CD ' ' H ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -52.95 -57.13 11.35 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -174.508 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.563 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 88.4 p -72.67 -26.35 61.6 Favored 'General case' 0 CA--C 1.521 -0.144 0 O-C-N 121.489 -0.757 . . . . 0.0 112.37 -173.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.643 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.18 -44.35 16.53 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 119.189 -0.434 . . . . 0.0 109.932 -179.074 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 38.0 mt -55.48 -50.85 63.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 171.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 15.9 mm -66.92 -51.81 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -176.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 73.8 m -57.68 -33.59 68.52 Favored 'General case' 0 N--CA 1.458 -0.058 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.324 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.1 tp -69.4 -45.41 69.3 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 118.582 -0.723 . . . . 0.0 112.083 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 38.1 pt -71.35 -34.42 53.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 119.63 1.105 . . . . 0.0 111.699 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 97.7 mt -63.05 -55.49 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -64.51 -27.12 68.75 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.308 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -62.78 -45.56 92.1 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 175.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.461 ' HB2' ' HG ' ' A' ' 65' ' ' SER . 27.7 t -61.2 -43.37 98.99 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.903 0.382 . . . . 0.0 110.154 175.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 14.7 tpp180 -59.31 -44.86 92.51 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.801 0.84 . . . . 0.0 112.698 -176.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 70.2 mt -89.66 -15.04 33.54 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 -173.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 72.5 m -100.5 165.28 14.67 Favored Pre-proline 0 CA--C 1.537 0.461 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -172.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.68 177.31 0.24 Allowed 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 125.298 3.998 . . . . 0.0 115.036 -178.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -58.78 -41.47 86.74 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.853 0.861 . . . . 0.0 111.875 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.9 m -60.09 -21.3 61.33 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 177.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -93.55 -20.13 20.54 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 118.848 -0.596 . . . . 0.0 111.141 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.8 mptt -64.49 -46.63 82.15 Favored 'General case' 0 C--N 1.342 0.239 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 167.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -65.15 -52.46 55.01 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.47 -42.51 93.91 Favored Glycine 0 C--N 1.338 0.641 0 N-CA-C 111.581 -0.608 . . . . 0.0 111.581 -179.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.461 ' HG ' ' HB2' ' A' ' 54' ' ' SER . 19.9 t -68.83 -34.81 76.11 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 117.735 0.767 . . . . 0.0 110.493 179.59 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.4 mt -62.57 -32.45 73.43 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 119.47 1.032 . . . . 0.0 110.818 174.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -73.81 -31.47 63.26 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.845 0.748 . . . . 0.0 111.417 175.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 80.7 mt -72.58 -40.43 62.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 118.622 0.646 . . . . 0.0 110.769 175.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.7 mt -66.63 -35.05 73.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -67.17 -45.47 76.89 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 119.023 -0.513 . . . . 0.0 110.82 176.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.436 ' HB2' HG21 ' A' ' 33' ' ' THR . 79.3 p -66.03 -57.14 8.42 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 118.534 0.606 . . . . 0.0 110.832 -176.275 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 59.3 mt -64.19 -32.07 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.76 -55.87 17.69 Favored Glycine 0 CA--C 1.527 0.796 0 CA-C-O 119.813 -0.437 . . . . 0.0 112.52 178.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.622 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -66.6 -30.8 71.17 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-N 117.964 0.882 . . . . 0.0 110.561 -178.929 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.03 -44.93 71.72 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 122.574 -0.078 . . . . 0.0 110.828 176.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -64.05 -48.24 77.02 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 177.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 57.5 tp -58.26 -47.52 83.33 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 122.834 0.454 . . . . 0.0 110.08 -176.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -64.12 -43.15 96.18 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.407 -0.183 . . . . 0.0 110.599 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -65.18 -34.58 78.71 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -175.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.5 t -94.6 -18.63 21.2 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -177.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -100.42 -24.18 14.56 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 119.027 0.83 . . . . 0.0 112.802 178.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 11.8 t -91.35 -14.05 31.42 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 118.383 0.538 . . . . 0.0 112.196 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -141.07 161.75 37.12 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.549 0.34 . . . . 0.0 110.095 -177.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 92.5 p -147.22 173.24 12.72 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.386 0.674 . . . . 0.0 110.475 -178.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -130.16 27.46 5.1 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 122.852 0.461 . . . . 0.0 110.648 -179.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 36.3 m 55.55 27.19 10.01 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.756 0.822 . . . . 0.0 112.707 -178.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 71.0 m -135.66 160.89 37.09 Favored 'General case' 0 C--O 1.23 0.073 0 C-N-CA 123.505 0.722 . . . . 0.0 110.43 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 79.5 p -150.32 173.28 14.17 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.435 0.694 . . . . 0.0 110.508 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 37.4 t30 58.98 -177.79 0.08 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.452 1.101 . . . . 0.0 111.772 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt 50.15 55.17 16.65 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 124.435 1.094 . . . . 0.0 112.161 -179.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.02 156.81 64.14 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 123.369 2.712 . . . . 0.0 110.689 -179.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 176.27 28.73 0.04 OUTLIER Glycine 0 CA--C 1.525 0.692 0 N-CA-C 111.659 -0.576 . . . . 0.0 111.659 -178.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.4 -155.14 0.59 Allowed 'General case' 0 C--N 1.34 0.189 0 CA-C-N 117.205 0.503 . . . . 0.0 110.868 -175.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.6 p -47.37 -31.74 4.27 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -176.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.27 -45.61 87.34 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.807 0.73 . . . . 0.0 109.943 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 46.1 t60 -66.87 -29.62 69.57 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 123.482 0.713 . . . . 0.0 109.927 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.17 -43.82 77.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 123.045 0.538 . . . . 0.0 110.548 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.17 -43.58 98.91 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.069 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 174.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -59.53 -33.83 71.87 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.682 -0.236 . . . . 0.0 111.13 178.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.1 m -73.72 -42.05 61.72 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 122.302 -0.249 . . . . 0.0 111.218 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 48.7 mt -60.39 -30.21 69.44 Favored 'General case' 0 C--N 1.339 0.126 0 O-C-N 121.418 -0.802 . . . . 0.0 109.274 173.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.43 -14.91 22.15 Favored Glycine 0 CA--C 1.531 1.076 0 CA-C-O 119.112 -0.827 . . . . 0.0 113.918 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -100.82 -6.92 24.15 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.016 1.408 . . . . 0.0 112.074 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.1 m -123.42 -17.91 4.42 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -177.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.0 tp -55.22 -26.08 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 CA-C-N 118.246 0.476 . . . . 0.0 111.527 -177.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -61.54 -53.32 57.86 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.379 0.672 . . . . 0.0 111.65 176.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -75.55 -34.48 60.73 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 122.002 -0.436 . . . . 0.0 110.912 -178.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 88.9 mt -62.38 -46.94 86.37 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 55.9 mt -71.31 -53.95 12.49 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 118.532 -0.747 . . . . 0.0 111.19 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 69.2 p -55.06 -35.76 64.86 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 119.033 0.833 . . . . 0.0 111.118 -176.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -70.1 -48.62 56.87 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-N 118.798 0.726 . . . . 0.0 110.269 173.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.96 -34.39 65.64 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.984 0.914 . . . . 0.0 113.369 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -84.5 -38.08 13.27 Favored 'Isoleucine or valine' 0 C--N 1.343 0.288 0 C-N-CA 117.482 -1.687 . . . . 0.0 112.667 170.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.27 -22.42 66.94 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.881 0.764 . . . . 0.0 110.85 -178.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.04 -17.11 30.02 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.064 0.946 . . . . 0.0 110.995 178.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 53.1 p -85.41 167.57 15.4 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -172.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -102.5 177.17 4.94 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 168.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.3 -33.27 63.13 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 118.546 0.612 . . . . 0.0 112.32 -176.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -70.63 -49.93 42.36 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 122.03 -0.419 . . . . 0.0 111.312 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 6.2 m170 -67.56 -34.07 76.31 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-O 119.052 -0.499 . . . . 0.0 110.41 179.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.5 ttpt -55.67 -51.94 65.55 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 118.736 0.698 . . . . 0.0 109.204 171.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -58.94 -38.96 80.22 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 120.674 -0.411 . . . . 0.0 110.864 -176.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.8 mtpp -63.06 -41.59 99.5 Favored 'General case' 0 N--CA 1.455 -0.187 0 O-C-N 122.338 -0.226 . . . . 0.0 110.955 175.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 97.9 mt -67.65 -36.45 76.13 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 O-C-N 121.863 -0.523 . . . . 0.0 109.595 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -66.26 -32.58 74.08 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 176.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.4 ttt -65.67 -42.68 91.04 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 175.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 89.2 mt -58.99 -43.32 91.46 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.119 175.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.1 mt -65.62 -36.1 82.73 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 117.676 0.216 . . . . 0.0 111.315 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -66.22 -39.74 89.81 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 118.05 0.386 . . . . 0.0 110.51 178.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.4 mt -67.15 -42.76 88.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 N-CA-C 110.321 -0.252 . . . . 0.0 110.321 177.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 48.4 m0 -67.7 -31.27 71.11 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 117.938 0.336 . . . . 0.0 110.872 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -73.38 -36.44 66.06 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 117.516 0.144 . . . . 0.0 110.94 176.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 51.1 tpt85 -70.67 -31.53 68.47 Favored 'General case' 0 CA--C 1.528 0.12 0 O-C-N 122.325 -0.235 . . . . 0.0 111.03 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 69.1 m -82.06 -8.55 59.67 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.966 0.506 . . . . 0.0 111.446 176.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -67.34 164.09 45.08 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 111.762 -0.535 . . . . 0.0 111.762 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 91.2 mt -117.57 9.72 13.25 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.432 0.693 . . . . 0.0 111.133 -178.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 18.4 t80 60.48 147.5 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.918 1.687 . . . . 0.0 113.433 -178.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 52.66 11.45 0.19 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.646 1.178 . . . . 0.0 113.756 -177.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm -139.22 11.12 2.58 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.591 0.756 . . . . 0.0 111.075 -177.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 50.1 m -140.16 166.78 23.75 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 123.552 0.741 . . . . 0.0 110.584 -178.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -136.26 155.31 50.28 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 123.189 0.596 . . . . 0.0 110.221 -179.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 11.2 tp -145.47 3.42 1.0 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.475 -178.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -65.43 -15.87 63.06 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.814 0.846 . . . . 0.0 112.6 -177.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . 0.518 ' C ' ' H ' ' A' ' 146' ' ' ARG . . . -37.83 -40.27 0.43 Allowed 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 126.135 1.774 . . . . 0.0 114.735 -172.504 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -69.39 21.41 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 118.424 0.556 . . . . 0.0 112.077 176.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.518 ' H ' ' C ' ' A' ' 144' ' ' ALA . 34.2 mmt180 53.06 19.77 1.51 Allowed 'General case' 0 C--N 1.339 0.121 0 C-N-CA 124.888 1.275 . . . . 0.0 111.183 -169.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 17.7 t 51.54 19.47 0.85 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.642 0.777 . . . . 0.0 112.974 -170.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -85.35 168.62 14.49 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 122.19 0.995 . . . . 0.0 113.102 -176.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 73.0 m -55.34 -14.78 2.02 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 114.47 -1.241 . . . . 0.0 111.389 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 17.1 m-30 -28.86 -60.86 0.13 Allowed 'General case' 0 C--N 1.343 0.286 0 C-N-CA 126.039 1.736 . . . . 0.0 110.31 176.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -128.88 -9.54 4.92 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 123.73 0.644 . . . . 0.0 110.929 169.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' MET . . . . . 0.454 ' C ' ' H ' ' A' ' 154' ' ' LEU . 31.4 mmt -74.07 -15.6 61.06 Favored 'General case' 0 C--N 1.341 0.212 0 CA-C-N 119.176 0.898 . . . . 0.0 111.027 177.396 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 33.1 t70 56.38 -8.68 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.045 1.738 . . . . 0.0 114.886 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.454 ' H ' ' C ' ' A' ' 152' ' ' MET . 96.1 mt . . . . . 0 C--O 1.252 1.194 0 CA-C-O 116.98 -1.486 . . . . 0.0 110.542 -178.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 87.1 t80 . . . . . 0 N--CA 1.477 0.878 0 CA-C-O 120.478 0.18 . . . . 0.0 110.654 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 63.7 p -149.27 151.93 34.88 Favored Pre-proline 0 CA--C 1.532 0.251 0 C-N-CA 123.423 0.689 . . . . 0.0 109.707 178.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -77.28 -11.47 17.51 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 123.418 2.745 . . . . 0.0 112.261 -178.123 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 48.3 p -144.07 145.83 32.42 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 118.209 0.459 . . . . 0.0 111.056 -177.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 159' ' ' SEP . . . . . 0.545 ' H ' ' HA ' ' A' ' 25' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -73.2 -179.07 23.71 Favored 'Cis proline' 0 N--CA 1.451 -1.001 0 N-CA-C 110.119 -0.762 . . . . 0.0 110.119 -8.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 36.5 t -69.12 156.83 38.02 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 176.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 162' ' ' TYR . . . . . 0.418 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 13.0 t80 -145.99 131.89 19.14 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.575 0.35 . . . . 0.0 110.988 -179.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 31.2 t -119.65 128.83 25.69 Favored Pre-proline 0 N--CA 1.452 -0.329 0 C-N-CA 122.95 0.5 . . . . 0.0 110.153 175.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.15 -16.25 48.41 Favored 'Trans proline' 0 N--CA 1.449 -1.091 0 C-N-CA 122.64 2.227 . . . . 0.0 109.696 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 2.1 m -69.39 -9.14 52.17 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.972 0.909 . . . . 0.0 112.47 -175.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -55.17 154.79 21.54 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 123.222 2.615 . . . . 0.0 111.94 170.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 C--O 1.25 1.125 0 CA-C-O 117.347 -1.311 . . . . 0.0 111.406 -177.193 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.475 0.781 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.1 pm0 -140.59 6.3 2.06 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 122.673 0.389 . . . . 0.0 112.007 -178.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 -94.02 151.34 19.59 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -144.48 158.76 43.6 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.522 0.329 . . . . 0.0 110.873 -178.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -142.33 20.94 2.06 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.623 0.769 . . . . 0.0 111.384 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.418 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 15.2 t70 -83.51 -144.34 0.07 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.054 0.941 . . . . 0.0 109.61 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.418 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 14.9 t80 -55.18 -14.38 1.67 Allowed 'General case' 0 C--N 1.339 0.111 0 C-N-CA 123.483 0.713 . . . . 0.0 111.507 178.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -54.56 -42.88 71.5 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.264 0.626 . . . . 0.0 110.481 177.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 56.1 m-20 -55.91 -46.35 78.42 Favored 'General case' 0 C--O 1.227 -0.104 0 CA-C-N 118.285 0.493 . . . . 0.0 110.51 177.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -65.98 -50.03 65.74 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 117.777 0.262 . . . . 0.0 110.591 -176.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.8 t -63.72 -54.6 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 -178.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.89 -32.72 67.99 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.069 0.548 . . . . 0.0 111.897 -178.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 80.0 m -73.02 -41.46 64.21 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 118.312 0.505 . . . . 0.0 110.525 177.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.2 tp -66.12 -32.7 74.31 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.086 0.47 . . . . 0.0 110.097 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -68.58 -43.49 76.41 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.967 0.907 . . . . 0.0 109.616 175.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 65.4 m -64.39 -26.36 68.43 Favored 'General case' 0 C--O 1.227 -0.105 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 175.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.425 ' CE2' HD12 ' A' ' 68' ' ' ILE . 0.1 OUTLIER -71.81 -40.55 69.06 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 175.574 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -64.93 -32.63 74.44 Favored 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 176.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -76.31 -14.55 60.1 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.863 0.465 . . . . 0.0 111.762 176.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 57.5 tp -92.18 150.48 20.89 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.011 0.524 . . . . 0.0 110.482 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -150.13 163.4 38.3 Favored 'General case' 0 CA--C 1.523 -0.082 0 C-N-CA 123.388 0.675 . . . . 0.0 110.22 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 29.9 m 52.28 29.44 6.71 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.377 0.671 . . . . 0.0 112.782 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -177.97 135.76 2.8 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.452 -1.059 . . . . 0.0 110.452 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 19.7 mm -111.71 58.35 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.109 0 C-N-CA 124.659 1.184 . . . . 0.0 107.982 178.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.451 ' HA ' ' H ' ' B' ' 159' ' ' SEP . 75.0 m -50.56 127.99 19.18 Favored 'General case' 0 CA--C 1.522 -0.099 0 C-N-CA 122.954 0.502 . . . . 0.0 111.641 -174.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.55 -20.11 67.59 Favored Glycine 0 CA--C 1.526 0.758 0 CA-C-O 119.098 -0.834 . . . . 0.0 112.546 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.427 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 40.3 t -66.05 -37.19 85.23 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 118.801 1.3 . . . . 0.0 110.059 -178.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.5 mmp_? -61.99 -49.0 77.83 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 176.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.6 mt -61.5 -38.53 80.33 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.883 -179.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -65.76 -38.96 90.51 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 118.954 -0.546 . . . . 0.0 111.291 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.427 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.1 OUTLIER -66.61 -41.38 88.51 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 119.279 0.945 . . . . 0.0 110.238 175.52 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.2 mt -62.0 -57.47 11.55 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 119.55 -0.262 . . . . 0.0 111.042 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.435 HG22 ' HB2' ' A' ' 71' ' ' SER . 66.6 p -56.85 -42.46 79.74 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 118.228 0.467 . . . . 0.0 111.707 177.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.7 m -55.44 -56.27 22.1 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 119.234 -0.413 . . . . 0.0 110.873 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -69.35 -32.72 71.97 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 118.524 -1.27 . . . . 0.0 111.815 -175.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.29 -58.4 8.78 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 174.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.7 mt -71.36 -15.81 62.4 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.711 0.804 . . . . 0.0 112.697 -174.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -61.09 -28.42 69.07 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 25.0 t60 -150.76 -24.37 0.22 Allowed 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -175.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 30.3 mm 46.65 74.67 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-O 121.645 0.736 . . . . 0.0 111.522 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -147.62 21.16 1.17 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.898 0.879 . . . . 0.0 109.918 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.552 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.01 37.76 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.087 0 C-N-CA 124.331 1.052 . . . . 0.0 109.365 -171.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.422 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -53.2 -54.19 39.67 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -174.676 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 81.0 p -75.22 -28.42 59.92 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -173.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.657 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -79.44 -45.41 19.5 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -179.247 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 24.4 mt -56.11 -51.76 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 172.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 11.7 mm -66.17 -50.83 65.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-O 119.02 -0.514 . . . . 0.0 112.124 -176.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 63.6 m -58.03 -33.55 69.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 119.198 0.908 . . . . 0.0 110.558 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 54.1 tp -70.06 -43.36 71.37 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 36.5 pt -73.24 -35.48 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-N 119.588 1.086 . . . . 0.0 111.927 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.02 -52.37 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 178.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -62.39 -30.53 71.27 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.286 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -61.37 -42.51 98.82 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 175.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.488 ' HB2' ' HG ' ' A' ' 65' ' ' SER . 32.1 t -68.39 -35.73 78.1 Favored 'General case' 0 C--N 1.338 0.098 0 O-C-N 122.097 -0.377 . . . . 0.0 110.701 175.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -64.82 -42.24 95.12 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.925 0.89 . . . . 0.0 113.056 -174.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 79.6 mt -91.24 -14.31 31.19 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -174.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 71.1 m -106.1 155.53 38.32 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -170.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.69 -174.95 0.79 Allowed 'Trans proline' 0 N--CA 1.459 -0.52 1 C-N-CA 125.788 4.325 . . . . 0.0 113.823 -179.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -53.77 -45.1 70.54 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 125.732 1.613 . . . . 0.0 114.738 -170.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 73.3 m -61.21 -27.33 68.36 Favored 'General case' 0 CA--C 1.523 -0.06 0 CA-C-N 118.484 0.584 . . . . 0.0 110.152 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 24.0 m170 -91.58 -16.99 26.29 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.263 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -66.09 -47.57 73.79 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 169.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 58.4 tp -66.86 -48.64 68.17 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.449 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.11 -46.45 92.67 Favored Glycine 0 C--N 1.338 0.643 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.488 ' HG ' ' HB2' ' A' ' 54' ' ' SER . 11.8 t -62.65 -45.22 93.85 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 117.495 0.647 . . . . 0.0 110.069 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 25.2 mt -54.22 -41.18 68.37 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 119.162 0.892 . . . . 0.0 110.774 176.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -68.31 -27.0 65.91 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.028 0.831 . . . . 0.0 111.263 178.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.425 HD12 ' CE2' ' A' ' 17' ' ' PHE . 72.0 mt -75.12 -44.4 43.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 CA-C-N 118.247 0.476 . . . . 0.0 111.23 174.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 1.6 mp -60.33 -34.69 58.49 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 175.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.444 ' CG ' HH22 ' A' ' 74' ' ' ARG . 38.3 t70 -71.53 -45.4 62.47 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.744 1.218 . . . . 0.0 111.584 -178.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.435 ' HB2' HG22 ' A' ' 33' ' ' THR . 65.8 p -67.29 -56.04 11.42 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 119.009 0.822 . . . . 0.0 110.478 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 49.2 mt -63.37 -32.27 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.6 -55.68 21.44 Favored Glycine 0 CA--C 1.525 0.677 0 CA-C-O 119.65 -0.528 . . . . 0.0 112.02 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.457 ' HD3' ' HD3' ' B' ' 167' ' ' PRO . 5.1 ptp85 -67.14 -32.85 74.24 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 118.086 0.943 . . . . 0.0 110.658 -178.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.87 -44.7 69.26 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 121.514 -0.074 . . . . 0.0 110.803 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.2 m-30 -62.45 -47.93 81.86 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 176.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -59.17 -47.76 84.12 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 123.344 0.402 . . . . 0.0 110.144 -176.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -62.27 -47.74 83.01 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 120.515 0.198 . . . . 0.0 110.651 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -66.11 -38.04 87.23 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 121.039 -0.264 . . . . 0.0 111.591 -175.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 6.2 t -82.61 -19.42 38.41 Favored 'General case' 0 C--O 1.226 -0.138 0 CA-C-N 118.108 0.413 . . . . 0.0 111.592 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 79.8 ttt-85 -85.12 -27.15 26.43 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-N 117.978 0.354 . . . . 0.0 111.351 174.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 68.2 m -71.61 -14.77 62.17 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -178.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -147.61 158.36 43.97 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.668 0.667 . . . . 0.0 110.557 -178.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 53.4 m -143.14 159.61 41.96 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.18 0.592 . . . . 0.0 110.921 -178.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 54.3 t-20 -149.83 149.06 29.93 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.1 m -138.79 15.54 2.69 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 123.284 0.634 . . . . 0.0 111.577 -176.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 29.8 t -132.58 160.81 35.53 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 122.569 0.348 . . . . 0.0 111.161 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 43.5 m 58.6 161.83 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.77 1.628 . . . . 0.0 113.744 -177.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -80.44 148.0 30.71 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -156.17 156.16 29.98 Favored Pre-proline 0 CA--C 1.531 0.231 0 C-N-CA 122.602 0.361 . . . . 0.0 111.254 -176.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -71.47 171.99 15.12 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 123.796 2.997 . . . . 0.0 110.487 174.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -73.24 -30.81 62.23 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 111.759 -0.536 . . . . 0.0 111.759 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 47.57 -158.78 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.646 1.178 . . . . 0.0 114.07 176.668 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.6 p -52.52 -28.88 22.44 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.162 0.985 . . . . 0.0 113.546 -176.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.11 -46.17 88.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.819 0.736 . . . . 0.0 109.758 176.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 9.4 m170 -73.38 -24.28 60.29 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.506 178.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.67 -46.45 85.5 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 175.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.1 mt -64.46 -44.24 96.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.171 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 176.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -58.17 -36.39 72.98 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 122.516 -0.115 . . . . 0.0 111.042 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.3 m -74.04 -41.03 62.41 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-O 119.626 -0.226 . . . . 0.0 111.482 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.4 mt -60.36 -30.21 69.41 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.824 0.738 . . . . 0.0 109.348 174.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.0 -15.44 21.13 Favored Glycine 0 CA--C 1.528 0.861 0 CA-C-O 119.222 -0.765 . . . . 0.0 113.967 179.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -101.3 -6.02 24.68 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.01 1.405 . . . . 0.0 112.28 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 35.0 m -123.02 -16.72 5.14 Favored 'Isoleucine or valine' 0 C--N 1.339 0.135 0 C-N-CA 122.941 0.496 . . . . 0.0 112.005 -178.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -52.2 -26.34 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 122.884 0.474 . . . . 0.0 111.58 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.2 pt20 -63.89 -48.03 78.25 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.037 0.535 . . . . 0.0 111.57 178.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -79.39 -31.39 42.78 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 118.107 0.412 . . . . 0.0 110.721 -178.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.0 mp -61.67 -53.3 57.93 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.496 HD13 ' CB ' ' A' ' 144' ' ' ALA . 85.5 mt -66.07 -56.72 10.13 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 118.621 -0.704 . . . . 0.0 110.389 178.18 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 80.9 p -54.02 -40.57 67.15 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 119.238 0.926 . . . . 0.0 112.229 -174.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -71.04 -47.04 60.82 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 119.465 1.029 . . . . 0.0 110.357 176.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.22 -37.92 72.95 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 118.949 -0.548 . . . . 0.0 111.904 -177.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -82.92 -33.93 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 119.058 0.845 . . . . 0.0 111.925 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.84 -28.22 67.37 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 119.789 -0.764 . . . . 0.0 111.028 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.21 -14.76 45.82 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.466 0.707 . . . . 0.0 111.053 177.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 32.4 p -74.39 159.57 32.16 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 -171.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.1 t-20 -96.25 174.39 6.91 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 169.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -55.42 -43.58 75.45 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.231 0.923 . . . . 0.0 111.507 -176.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -66.01 -40.78 91.38 Favored 'General case' 0 CA--C 1.527 0.093 0 O-C-N 121.856 -0.528 . . . . 0.0 110.529 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -69.94 -38.77 76.28 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.376 -0.345 . . . . 0.0 110.996 -178.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -39.3 90.14 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 174.295 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -66.06 -38.35 88.1 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.563 -178.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -64.33 -42.79 96.11 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 121.071 -0.251 . . . . 0.0 111.013 175.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.7 mt -67.17 -34.81 71.8 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -66.54 -36.06 81.76 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 122.75 0.42 . . . . 0.0 110.454 176.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.3 ttt -65.56 -42.13 92.16 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 109.668 -0.494 . . . . 0.0 109.668 176.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.2 tt -58.05 -49.9 75.28 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 176.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.79 -30.29 69.69 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 122.264 -0.273 . . . . 0.0 111.715 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -67.01 -37.83 84.88 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 118.144 0.429 . . . . 0.0 110.058 177.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 95.6 mt -69.13 -39.97 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 176.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 20.0 m0 -63.52 -30.6 71.7 Favored 'General case' 0 CA--C 1.531 0.226 0 O-C-N 122.181 -0.324 . . . . 0.0 110.624 176.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -75.62 -36.07 60.33 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 117.876 0.307 . . . . 0.0 111.11 176.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 93.5 mtt-85 -71.96 -22.79 61.4 Favored 'General case' 0 C--N 1.337 0.065 0 O-C-N 122.165 -0.334 . . . . 0.0 111.076 176.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 23.0 t -61.44 -22.63 65.21 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.131 0.172 . . . . 0.0 111.145 176.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 160.86 152.48 6.61 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.855 -0.498 . . . . 0.0 111.855 177.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -97.47 -3.75 39.37 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.93 0.492 . . . . 0.0 110.308 178.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -143.06 164.69 29.42 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.671 0.788 . . . . 0.0 109.443 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 54.5 -162.61 0.13 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.315 0.646 . . . . 0.0 110.918 -177.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 95.5 mttt 55.05 25.19 6.72 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.616 0.766 . . . . 0.0 112.443 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 50.3 m 58.52 171.82 0.06 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.795 1.238 . . . . 0.0 113.37 -177.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 27.9 p90 -81.02 161.19 24.33 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.112 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -140.65 15.62 2.34 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 123.418 0.687 . . . . 0.0 111.475 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -62.35 -14.75 43.07 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 -177.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . 0.529 ' C ' ' H ' ' A' ' 146' ' ' ARG . . . 10.47 -76.34 0.0 OUTLIER 'General case' 0 C--N 1.342 0.28 0 C-N-CA 128.401 2.681 . . . . 0.0 115.566 177.075 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -65.9 18.39 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 C-N-CA 125.534 1.534 . . . . 0.0 112.588 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.529 ' H ' ' C ' ' A' ' 144' ' ' ALA . 23.0 mmt85 51.67 25.21 2.72 Favored 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 124.805 1.242 . . . . 0.0 110.903 -171.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 10.8 t 54.24 22.56 3.71 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.806 0.842 . . . . 0.0 113.172 -174.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -85.01 -175.91 5.97 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 122.35 1.071 . . . . 0.0 113.124 -177.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 85.2 m -52.43 -17.12 1.07 Allowed 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.774 1.23 . . . . 0.0 113.997 -173.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -33.06 -68.44 0.1 Allowed 'General case' 0 C--N 1.339 0.125 0 C-N-CA 124.414 1.085 . . . . 0.0 110.377 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -112.24 -14.56 13.34 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 118.948 -0.549 . . . . 0.0 111.218 167.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' MET . . . . . 0.418 ' SD ' ' N ' ' A' ' 152' ' ' MET . 0.6 OUTLIER -84.49 1.54 45.16 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -175.605 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -56.55 -27.0 56.58 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 119.073 0.851 . . . . 0.0 110.816 173.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 59.4 tp . . . . . 0 C--O 1.252 1.209 0 CA-C-O 117.444 -1.265 . . . . 0.0 109.015 177.203 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 51.8 p90 . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 120.386 0.136 . . . . 0.0 110.684 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 70.6 p -143.82 156.03 59.28 Favored Pre-proline 0 CA--C 1.532 0.278 0 C-N-CA 123.195 0.598 . . . . 0.0 110.567 -179.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_endo -70.31 159.04 54.37 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 123.622 2.881 . . . . 0.0 111.413 179.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 61.4 p -142.51 157.06 45.14 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.453 0.701 . . . . 0.0 110.186 -178.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 159' ' ' SEP . . . . . 0.451 ' H ' ' HA ' ' A' ' 25' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 160' ' ' PRO . . . . . 0.404 ' HD2' ' N ' ' A' ' 27' ' ' SER . 85.3 Cg_endo -72.28 -175.35 13.58 Favored 'Cis proline' 0 N--CA 1.456 -0.68 0 N-CA-C 109.509 -0.997 . . . . 0.0 109.509 -11.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 67.9 p -72.83 157.29 37.77 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.675 0.274 . . . . 0.0 111.12 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 162' ' ' TYR . . . . . 0.411 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 4.2 t80 -144.25 129.62 18.87 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 123.338 0.655 . . . . 0.0 109.771 178.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 28.8 t -125.65 138.16 31.37 Favored Pre-proline 0 N--CA 1.454 -0.246 0 C-N-CA 123.144 0.577 . . . . 0.0 111.512 -177.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -67.83 -1.59 7.11 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 123.556 2.837 . . . . 0.0 111.44 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 57.2 p -76.13 -12.78 60.17 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.673 -0.68 . . . . 0.0 112.145 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . 0.457 ' HD3' ' HD3' ' A' ' 74' ' ' ARG . 52.2 Cg_endo -62.69 168.17 10.55 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 124.035 3.157 . . . . 0.0 111.792 171.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 40.5 m . . . . . 0 C--O 1.25 1.086 0 CA-C-O 117.712 -1.137 . . . . 0.0 111.413 179.154 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.2 mtp . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 110.476 -0.194 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -143.29 151.57 40.67 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.451 0.701 . . . . 0.0 109.396 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -79.71 162.5 25.16 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 122.514 0.326 . . . . 0.0 111.166 -178.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -86.08 161.33 18.96 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 122.721 0.409 . . . . 0.0 110.181 178.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 52.29 25.16 3.23 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.946 0.899 . . . . 0.0 112.466 -175.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.464 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 27.2 t70 -80.82 -153.57 0.09 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.554 0.742 . . . . 0.0 109.182 176.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.464 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 19.9 t80 -55.79 -14.44 2.34 Favored 'General case' 0 CA--C 1.532 0.28 0 O-C-N 121.721 -0.612 . . . . 0.0 111.484 178.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.8 tp60 -54.25 -40.23 67.57 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.678 0.791 . . . . 0.0 110.877 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -63.42 -39.48 94.6 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 118.779 0.718 . . . . 0.0 110.703 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.1 t80 -64.6 -54.3 34.18 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 118.464 0.575 . . . . 0.0 109.795 179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.6 t -59.57 -55.67 22.32 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.145 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 -178.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.1 -33.17 67.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.507 0.723 . . . . 0.0 112.197 -178.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 60.2 m -70.73 -44.97 65.74 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.705 0.684 . . . . 0.0 110.33 176.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.7 tp -65.36 -33.72 76.63 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.235 0.54 . . . . 0.0 110.071 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -66.34 -46.87 75.31 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.49 0.716 . . . . 0.0 109.757 177.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 61.6 m -63.86 -26.52 68.65 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -69.54 -45.7 68.17 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 177.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 15.7 pttm -77.9 -25.4 48.44 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -177.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -72.15 -16.48 61.98 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.2 mt -141.87 169.04 18.33 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.132 0.573 . . . . 0.0 110.687 -176.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -84.54 154.33 22.72 Favored 'General case' 0 N--CA 1.457 -0.117 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 174.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 47.9 t -152.3 150.87 30.23 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 120.879 0.371 . . . . 0.0 111.088 -178.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -85.72 31.7 3.87 Favored Glycine 0 CA--C 1.529 0.91 0 N-CA-C 110.679 -0.968 . . . . 0.0 110.679 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.5 mm 58.89 37.29 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 124.134 0.973 . . . . 0.0 110.408 -173.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.4 t -57.12 136.21 56.38 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.963 0.411 . . . . 0.0 111.146 -177.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -71.95 -22.18 78.84 Favored Glycine 0 CA--C 1.524 0.643 0 CA-C-O 119.072 -0.849 . . . . 0.0 114.601 -170.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 79.7 p -64.39 -38.7 91.96 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 119.384 1.592 . . . . 0.0 111.635 -174.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.6 mpt_? -65.69 -40.74 92.66 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 42.4 mt -64.89 -36.07 76.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 178.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.3 mmtt -65.35 -39.87 92.89 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.606 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.36 -48.57 77.39 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 118.746 0.703 . . . . 0.0 110.382 174.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.1 mt -59.66 -59.16 5.88 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 122.293 -0.255 . . . . 0.0 110.872 -178.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.408 HG22 ' HG ' ' A' ' 71' ' ' SER . 59.4 p -55.67 -47.62 76.4 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.8 t -63.9 -43.04 97.2 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.528 -176.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -74.56 -22.78 58.81 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.695 0.68 . . . . 0.0 112.811 -178.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.5 -56.46 9.45 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.895 0.77 . . . . 0.0 109.545 167.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 65.6 mt -69.88 -14.89 62.95 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.931 0.892 . . . . 0.0 113.076 -175.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -55.81 -30.59 61.61 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -178.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.9 t-80 -151.9 -23.61 0.19 Allowed 'General case' 0 C--N 1.34 0.174 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -176.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 41.1 mm 46.18 73.51 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 121.941 0.877 . . . . 0.0 111.446 -178.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -136.63 9.33 3.11 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.272 1.029 . . . . 0.0 109.207 177.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.512 HG23 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -142.97 111.77 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 C-N-CA 125.125 1.37 . . . . 0.0 107.692 -177.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.421 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -108.13 -64.05 1.26 Allowed 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.686 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 74.0 p -68.75 -24.15 64.41 Favored 'General case' 0 CA--C 1.521 -0.15 0 C-N-CA 123.096 0.558 . . . . 0.0 111.909 -173.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.576 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -74.82 -53.72 8.61 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.995 0.918 . . . . 0.0 109.143 179.715 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.449 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 10.1 mt -57.22 -47.08 84.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 C-N-CA 123.129 0.572 . . . . 0.0 110.165 175.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.407 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 12.7 mm -69.47 -46.95 74.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-O 119.067 -0.492 . . . . 0.0 111.652 -176.688 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.0 m -61.31 -33.4 73.52 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 119.318 -0.953 . . . . 0.0 109.891 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.6 tp -68.07 -44.97 75.1 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 119.183 -0.437 . . . . 0.0 112.037 -178.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.5 pt -73.51 -35.69 45.86 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-N 119.207 0.912 . . . . 0.0 111.871 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.0 mt -64.29 -49.34 81.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -58.32 -40.8 83.01 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.777 177.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -57.68 -42.46 83.65 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 175.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.0 t -65.41 -47.05 77.61 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -75.48 -24.74 56.96 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -174.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 53.6 mt -81.53 -15.44 54.85 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 178.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 74.4 m -120.78 153.77 57.12 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -171.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -74.23 -169.54 0.6 Allowed 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 125.178 3.919 . . . . 0.0 114.26 -175.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -35.02 -59.99 0.48 Allowed 'General case' 0 C--O 1.236 0.345 0 C-N-CA 128.258 2.623 . . . . 0.0 115.787 -172.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.8 p -59.79 -26.29 65.61 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 122.309 -0.245 . . . . 0.0 110.987 -175.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 52.5 m-70 -89.6 -18.87 25.73 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 119.625 -0.226 . . . . 0.0 110.946 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -66.04 -49.1 68.9 Favored 'General case' 0 C--N 1.343 0.322 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 171.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.5 mt -67.27 -44.6 78.91 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.502 178.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.71 -50.88 61.67 Favored Glycine 0 C--N 1.335 0.504 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 9.9 t -65.75 -36.88 84.83 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 118.749 -0.644 . . . . 0.0 110.963 -178.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 36.2 mt -60.99 -39.11 88.38 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 119.655 1.116 . . . . 0.0 111.635 176.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -72.21 -31.67 66.07 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.349 0.977 . . . . 0.0 111.094 177.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 64.3 mt -71.91 -47.63 54.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 O-C-N 121.895 -0.503 . . . . 0.0 110.529 177.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.4 mt -59.84 -37.19 70.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.179 0 C-N-CA 124.258 1.023 . . . . 0.0 109.213 176.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -66.19 -47.48 73.79 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 118.987 -0.53 . . . . 0.0 110.868 178.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.408 ' HG ' HG22 ' A' ' 33' ' ' THR . 7.8 t -64.52 -53.73 43.4 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 118.615 0.643 . . . . 0.0 111.129 -176.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 57.2 mt -63.27 -34.2 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 179.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.06 -51.35 39.78 Favored Glycine 0 CA--C 1.526 0.734 0 CA-C-O 119.823 -0.432 . . . . 0.0 112.492 -178.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.622 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -71.17 -31.46 67.68 Favored 'General case' 0 C--N 1.338 0.085 0 CA-C-N 117.996 0.898 . . . . 0.0 111.008 -178.894 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.87 -43.84 74.51 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 176.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.0 m-30 -62.38 -45.89 91.12 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 175.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.11 -46.57 87.99 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 123.358 0.411 . . . . 0.0 110.287 -176.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -64.18 -45.17 89.56 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.598 0.237 . . . . 0.0 110.565 178.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -62.75 -39.51 94.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -175.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.6 t -84.33 -28.08 27.31 Favored 'General case' 0 C--O 1.232 0.148 0 O-C-N 122.093 -0.38 . . . . 0.0 111.8 -177.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -78.13 -19.9 53.17 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-N 118.412 0.551 . . . . 0.0 111.523 175.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 73.9 m -69.02 -14.44 63.04 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 117.853 0.297 . . . . 0.0 111.235 174.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -106.26 162.34 13.75 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.131 0.572 . . . . 0.0 110.232 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 48.8 m -67.99 158.8 32.02 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.906 0.483 . . . . 0.0 110.808 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -71.59 148.84 46.23 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 86.1 p -155.06 170.35 21.98 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 123.37 0.668 . . . . 0.0 110.24 -179.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.3 m -136.99 154.71 50.34 Favored 'General case' 0 N--CA 1.458 -0.068 0 C-N-CA 122.826 0.45 . . . . 0.0 110.722 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.4 m -144.61 159.32 42.99 Favored 'General case' 0 N--CA 1.458 -0.051 0 C-N-CA 123.289 0.636 . . . . 0.0 110.15 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 68.2 m-20 -87.68 -9.52 53.91 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 119.579 -0.248 . . . . 0.0 111.417 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -143.32 153.1 58.97 Favored Pre-proline 0 CA--C 1.531 0.229 0 C-N-CA 123.507 0.723 . . . . 0.0 109.99 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -59.74 157.81 31.21 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 123.892 3.061 . . . . 0.0 112.504 176.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 175.48 148.57 6.88 Favored Glycine 0 CA--C 1.528 0.856 0 CA-C-O 121.119 0.288 . . . . 0.0 112.831 176.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 52.55 -175.82 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 176.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.0 p -50.22 -32.85 17.63 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.475 1.51 . . . . 0.0 114.813 -172.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.54 -47.0 87.54 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.225 0.921 . . . . 0.0 109.799 177.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 55.3 m-70 -78.15 -17.37 56.93 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.235 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.407 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -66.75 -44.67 80.87 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 173.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.6 mt -63.61 -44.35 98.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -57.78 -35.28 70.58 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.981 -0.099 . . . . 0.0 111.154 178.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.9 m -74.39 -41.77 60.39 Favored 'General case' 0 C--N 1.339 0.15 0 O-C-N 122.291 -0.256 . . . . 0.0 111.309 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 52.1 mt -60.28 -30.15 69.28 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 174.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.44 -14.63 28.31 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-O 119.08 -0.844 . . . . 0.0 113.641 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -100.81 -4.76 27.32 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.95 1.375 . . . . 0.0 112.075 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 34.5 m -124.48 -21.8 2.68 Favored 'Isoleucine or valine' 0 C--N 1.338 0.086 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -178.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.0 tp -52.83 -26.67 11.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 123.277 0.631 . . . . 0.0 112.294 -175.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.2 pt20 -62.85 -45.2 93.7 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 122.942 0.497 . . . . 0.0 111.255 177.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -74.01 -39.2 63.77 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.091 0.472 . . . . 0.0 110.132 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 68.8 mt -62.05 -50.49 71.77 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.459 -177.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 66.2 mt -65.63 -56.79 10.32 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.286 176.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 87.5 p -50.66 -41.65 55.65 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 119.181 0.9 . . . . 0.0 111.893 -174.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -70.74 -50.79 32.36 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 118.791 0.723 . . . . 0.0 111.148 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.463 ' O ' ' HE3' ' A' ' 115' ' ' LYS . . . -56.24 -32.4 64.42 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.599 0.76 . . . . 0.0 112.855 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -84.85 -38.35 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 CA-C-N 119.673 1.124 . . . . 0.0 111.788 174.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.25 -26.44 65.68 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 121.956 -0.465 . . . . 0.0 111.186 -179.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.463 ' HE3' ' O ' ' A' ' 112' ' ' ALA . 0.2 OUTLIER -80.73 -21.01 41.54 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.13 0.572 . . . . 0.0 110.075 177.414 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.412 ' HG ' ' HE3' ' A' ' 115' ' ' LYS . 11.3 m -80.93 169.86 17.0 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 122.063 0.935 . . . . 0.0 113.494 -173.307 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -105.78 -176.89 3.21 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 114.124 -1.398 . . . . 0.0 107.262 169.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . 0.428 ' O ' ' HE2' ' A' ' 121' ' ' LYS . 50.4 mm-40 -55.97 -35.91 67.25 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.789 -0.569 . . . . 0.0 112.031 -177.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -71.36 -49.6 40.61 Favored 'General case' 0 N--CA 1.456 -0.173 0 O-C-N 121.932 -0.48 . . . . 0.0 111.475 -177.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 49.4 m-70 -69.39 -34.6 74.75 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 122.191 -0.318 . . . . 0.0 110.679 -179.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' A' ' 118' ' ' GLN . 4.7 ttpt -56.67 -48.35 77.8 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 108.301 -0.999 . . . . 0.0 108.301 171.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -59.56 -39.73 85.0 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.919 -176.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -60.72 -44.37 96.69 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.28 175.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.8 mt -68.35 -34.26 64.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-O 120.757 0.313 . . . . 0.0 110.164 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 69.6 ttt-85 -69.66 -35.33 75.08 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.077 0.551 . . . . 0.0 109.908 178.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 62.8 ttp -68.37 -38.8 81.73 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 176.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.6 tt -58.95 -45.75 89.7 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 81.6 mt -66.31 -34.27 77.61 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 177.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -67.34 -33.41 75.2 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 118.205 0.457 . . . . 0.0 110.446 178.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 97.9 mt -74.8 -34.53 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 25.0 m0 -67.99 -30.8 70.16 Favored 'General case' 0 N--CA 1.456 -0.156 0 O-C-N 121.832 -0.543 . . . . 0.0 110.004 174.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -72.26 -36.42 69.02 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 175.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -63.03 -36.55 83.93 Favored 'General case' 0 C--N 1.342 0.246 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 174.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 49.4 m -75.32 -7.77 54.87 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.495 0.718 . . . . 0.0 111.884 178.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -67.55 164.62 45.1 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.929 -0.468 . . . . 0.0 111.929 -178.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 96.2 mt -134.59 178.54 6.92 Favored 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 124.179 0.992 . . . . 0.0 109.497 -178.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -64.21 -16.85 62.84 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.576 0.351 . . . . 0.0 111.243 178.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -81.38 -3.44 52.77 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.142 0.577 . . . . 0.0 111.2 177.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 59.7 mttp 60.12 166.33 0.07 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.815 1.646 . . . . 0.0 113.673 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 50.4 m -145.94 162.24 38.25 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.822 0.849 . . . . 0.0 109.9 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -88.2 130.33 35.09 Favored 'General case' 0 N--CA 1.457 -0.101 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 179.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 95.5 mt -142.3 3.12 1.52 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.541 0.736 . . . . 0.0 111.258 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 -70.92 -4.24 23.49 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -177.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . 0.516 ' C ' ' H ' ' A' ' 146' ' ' ARG . . . -37.47 -37.94 0.22 Allowed 'General case' 0 C--N 1.34 0.184 0 C-N-CA 126.467 1.907 . . . . 0.0 114.249 -177.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -70.11 25.02 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 122.866 0.466 . . . . 0.0 111.825 175.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.516 ' H ' ' C ' ' A' ' 144' ' ' ALA . 75.8 mtp180 51.94 18.78 0.85 Allowed 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 125.205 1.402 . . . . 0.0 111.287 -171.011 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 11.1 t 51.77 24.83 2.62 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.563 0.745 . . . . 0.0 112.508 -171.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -112.17 -176.54 2.95 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 122.257 1.027 . . . . 0.0 113.505 -174.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . 0.424 ' O ' ' C ' ' A' ' 150' ' ' PHE . 50.0 t -41.25 -38.2 1.1 Allowed 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 126.173 1.789 . . . . 0.0 113.389 -174.014 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . 0.424 ' C ' ' O ' ' A' ' 149' ' ' CYS . 95.4 m-85 -16.65 -74.56 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.782 1.633 . . . . 0.0 111.034 -179.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -122.04 -2.58 9.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 118.812 -0.613 . . . . 0.0 111.949 166.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 23.9 mmt -81.89 2.52 30.08 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 119.633 1.106 . . . . 0.0 112.059 178.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -55.39 -17.18 4.49 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.602 0.637 . . . . 0.0 112.457 176.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 2.2 pt? . . . . . 0 C--O 1.25 1.093 0 CA-C-O 117.283 -1.341 . . . . 0.0 110.49 178.158 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 91.8 t80 . . . . . 0 N--CA 1.476 0.835 0 N-CA-C 110.542 -0.17 . . . . 0.0 110.542 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 62.3 m -145.46 149.86 42.18 Favored Pre-proline 0 C--O 1.233 0.191 0 C-N-CA 123.501 0.72 . . . . 0.0 109.665 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -74.23 167.24 27.64 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 123.628 2.885 . . . . 0.0 110.642 177.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 70.2 p -97.21 163.92 12.71 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 122.767 0.427 . . . . 0.0 109.905 178.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -74.64 177.72 37.38 Favored 'Cis proline' 0 N--CA 1.458 -0.579 0 CA-C-N 118.879 0.635 . . . . 0.0 110.494 -5.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 50.1 m -63.74 147.32 51.99 Favored 'General case' 0 C--O 1.231 0.096 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 175.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 162' ' ' TYR . . . . . 0.464 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 17.2 t80 -145.93 131.12 18.42 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 178.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 29.4 t -135.44 135.45 22.37 Favored Pre-proline 0 C--O 1.234 0.265 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.878 176.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -56.58 -17.34 21.89 Favored 'Trans proline' 0 N--CA 1.451 -1.009 0 C-N-CA 123.23 2.62 . . . . 0.0 112.443 175.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 73.3 p -69.95 -6.54 33.77 Favored 'General case' 0 C--N 1.341 0.227 0 N-CA-C 113.196 0.814 . . . . 0.0 113.196 -174.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -57.7 156.88 25.49 Favored 'Trans proline' 0 N--CA 1.453 -0.875 0 C-N-CA 123.409 2.74 . . . . 0.0 111.252 169.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 32.9 m . . . . . 0 C--O 1.251 1.147 0 CA-C-O 117.601 -1.19 . . . . 0.0 111.118 -179.261 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.7 ttm . . . . . 0 N--CA 1.475 0.776 0 CA-C-O 119.822 -0.132 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -82.93 149.08 27.26 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.739 0.304 . . . . 0.0 110.299 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -145.1 10.65 1.32 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.028 0.531 . . . . 0.0 111.067 178.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -85.23 163.2 18.82 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 122.863 0.465 . . . . 0.0 111.217 -177.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -79.94 41.69 0.52 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.062 0.945 . . . . 0.0 111.206 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.478 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 17.3 t70 -76.47 -159.76 0.13 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.939 0.895 . . . . 0.0 109.608 178.214 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.478 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 13.3 t80 -55.62 -14.82 2.36 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.335 0.654 . . . . 0.0 111.036 178.288 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -55.33 -34.56 64.31 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.505 1.122 . . . . 0.0 111.304 176.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 40.8 m-20 -66.38 -44.2 83.79 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 119.2 0.909 . . . . 0.0 109.927 178.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -64.44 -50.23 68.38 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 -178.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 88.1 t -62.53 -57.71 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 -179.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.42 -32.32 64.75 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -177.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 78.9 m -72.43 -44.03 62.99 Favored 'General case' 0 C--N 1.338 0.079 0 O-C-N 121.798 -0.564 . . . . 0.0 110.78 176.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.0 tp -65.62 -31.59 72.71 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -69.73 -43.1 73.01 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 124.001 0.921 . . . . 0.0 109.546 176.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.8 t -60.07 -31.47 70.04 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -36.91 68.63 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.231 0.212 . . . . 0.0 110.592 175.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -68.73 -29.01 67.34 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 123.808 0.843 . . . . 0.0 111.18 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -66.51 -14.24 62.02 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.13 0.572 . . . . 0.0 111.854 178.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.2 mt -108.61 160.08 16.22 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 123.069 0.548 . . . . 0.0 111.097 -178.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -128.82 -1.15 5.36 Favored 'General case' 0 N--CA 1.457 -0.079 0 C-N-CA 123.309 0.644 . . . . 0.0 111.501 178.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 55.2 m -146.19 151.94 38.43 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 123.941 0.897 . . . . 0.0 109.574 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.28 136.45 1.97 Allowed Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 17.4 mm -117.64 56.23 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 C-N-CA 123.952 0.901 . . . . 0.0 108.608 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.433 ' HG ' ' P ' ' B' ' 159' ' ' SEP . 50.4 m -54.21 123.38 12.62 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-O 121.063 0.459 . . . . 0.0 111.481 -175.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -69.77 -14.98 70.82 Favored Glycine 0 CA--C 1.525 0.675 0 CA-C-O 119.13 -0.817 . . . . 0.0 113.288 -177.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.404 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 43.1 t -64.02 -43.63 95.04 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 118.914 1.357 . . . . 0.0 109.816 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 83.6 mtt85 -65.32 -41.42 94.01 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 53.1 mt -59.01 -41.46 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.103 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 176.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.3 tmtt? -60.79 -44.72 96.45 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.772 0.429 . . . . 0.0 111.256 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.404 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.3 OUTLIER -63.66 -40.99 98.23 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 118.72 0.691 . . . . 0.0 110.925 177.909 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 92.2 mt -63.66 -53.4 51.93 Favored 'General case' 0 C--O 1.233 0.202 0 O-C-N 122.534 -0.104 . . . . 0.0 110.782 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 48.4 p -60.94 -39.65 90.27 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.1 m -55.5 -57.7 10.8 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 122.876 0.47 . . . . 0.0 110.572 178.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -67.95 -35.09 77.81 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 118.908 -1.117 . . . . 0.0 111.942 -175.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.95 -58.3 9.27 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.422 0.556 . . . . 0.0 110.336 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 53.0 mt -72.21 -15.74 61.94 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.847 0.859 . . . . 0.0 112.913 -174.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -61.94 -24.69 67.14 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -150.85 -26.69 0.22 Allowed 'General case' 0 C--N 1.338 0.102 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -175.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 34.9 mm 44.97 73.59 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-O 121.768 0.794 . . . . 0.0 111.283 -178.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -137.53 9.26 2.89 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.114 0.966 . . . . 0.0 110.137 178.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.503 HG23 ' HE2' ' A' ' 45' ' ' LYS . 1.5 pt -143.64 119.62 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 C-N-CA 125.205 1.402 . . . . 0.0 107.837 -178.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.92 -66.89 1.04 Allowed 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -179.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 79.4 p -67.84 -23.19 65.13 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 122.851 0.46 . . . . 0.0 111.774 -173.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.578 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -75.46 -52.63 10.25 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.263 1.025 . . . . 0.0 109.399 179.475 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.461 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 7.4 mt -59.72 -44.33 93.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 C-N-CA 123.02 0.528 . . . . 0.0 110.352 176.207 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 12.3 mm -71.33 -47.63 58.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 O-C-N 122.258 -0.276 . . . . 0.0 111.681 -177.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.3 t -57.68 -35.02 70.03 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 176.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.4 tp -68.26 -45.67 72.51 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 118.442 -0.789 . . . . 0.0 112.184 -179.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 26.3 pt -73.01 -35.77 49.39 Favored 'Isoleucine or valine' 0 C--N 1.342 0.258 0 CA-C-N 120.03 1.286 . . . . 0.0 112.149 -179.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 95.8 mt -66.15 -50.73 66.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-O 121.431 0.634 . . . . 0.0 109.336 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -60.77 -40.38 92.3 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.317 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -55.67 -43.08 76.0 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 175.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.1 p -62.49 -51.5 67.2 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 119.442 -0.314 . . . . 0.0 110.96 -177.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.42 -20.45 66.37 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 118.585 0.63 . . . . 0.0 112.314 -177.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 69.8 mt -79.27 -14.74 58.84 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 173.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 59.6 m -95.17 163.49 21.67 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -173.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -74.04 -137.81 0.02 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.62 1 C-N-CA 125.606 4.204 . . . . 0.0 109.25 170.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -55.54 -26.89 45.75 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 119.361 0.982 . . . . 0.0 111.966 178.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 25.5 m -58.51 -21.27 51.48 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.962 0.505 . . . . 0.0 110.564 175.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -55.21 -72.36 0.07 Allowed 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 174.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -59.11 -60.37 3.97 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -175.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 35.1 tp -73.58 -47.47 40.26 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 119.619 -0.832 . . . . 0.0 112.203 -170.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.55 -41.78 93.91 Favored Glycine 0 C--N 1.335 0.479 0 N-CA-C 110.586 -1.005 . . . . 0.0 110.586 -175.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.4 t -68.2 -44.03 76.75 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 117.76 0.78 . . . . 0.0 110.4 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 49.6 mt -55.48 -42.04 73.83 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 119.704 -0.799 . . . . 0.0 111.178 178.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -71.12 -40.93 71.13 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.327 0.967 . . . . 0.0 112.372 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 89.1 mt -65.56 -45.9 91.19 Favored 'Isoleucine or valine' 0 C--N 1.341 0.228 0 CA-C-N 118.868 0.758 . . . . 0.0 109.847 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.0 mt -59.64 -36.63 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 C-N-CA 123.368 0.667 . . . . 0.0 109.432 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -66.44 -46.52 76.2 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 119.144 -0.455 . . . . 0.0 111.019 -179.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.6 m -67.63 -51.23 52.61 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 118.955 0.798 . . . . 0.0 111.443 -178.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 39.4 mt -66.94 -39.1 82.73 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 C-N-CA 120.56 -0.456 . . . . 0.0 109.999 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.48 -39.73 86.92 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 111.926 -0.47 . . . . 0.0 111.926 -179.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 42.9 ttm-85 -67.75 -42.25 82.1 Favored 'General case' 0 CA--C 1.523 -0.08 0 CA-C-N 117.52 0.66 . . . . 0.0 110.016 178.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.86 -41.47 82.84 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.324 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -63.7 -45.54 89.55 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 175.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 55.8 tp -59.38 -43.64 92.87 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 123.205 0.316 . . . . 0.0 110.184 -177.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -64.26 -46.63 82.89 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 120.776 0.322 . . . . 0.0 110.25 176.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -58.4 -41.84 85.83 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.543 -176.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 15.0 t -87.34 -20.48 26.7 Favored 'General case' 0 CA--C 1.528 0.101 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 51.2 tpt85 -71.06 -30.9 67.17 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 118.503 0.592 . . . . 0.0 110.131 175.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.4 m -72.06 -14.65 61.92 Favored 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 176.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -79.13 142.11 36.69 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 118.413 0.551 . . . . 0.0 109.87 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 43.5 m 50.13 17.39 0.31 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.878 0.871 . . . . 0.0 112.829 -178.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 53.57 10.22 0.22 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.981 1.312 . . . . 0.0 113.337 -176.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 9.3 t -158.04 8.53 0.15 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.151 0.432 . . . . 0.0 111.558 -177.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 19.1 t 60.19 170.75 0.09 Allowed 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.465 1.106 . . . . 0.0 112.026 -172.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 81.0 p -145.15 0.68 0.93 Allowed 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 122.891 0.476 . . . . 0.0 111.755 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 46.6 t30 48.3 37.9 9.35 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.804 0.842 . . . . 0.0 111.875 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.467 ' HB3' ' HZ3' ' A' ' 90' ' ' LYS . 0.7 OUTLIER -61.79 153.61 71.04 Favored Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 122.676 0.39 . . . . 0.0 110.937 -179.592 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -70.08 156.31 62.82 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 123.311 2.674 . . . . 0.0 110.458 177.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 73.01 168.77 13.38 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-O 121.239 0.355 . . . . 0.0 112.252 -178.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 53.3 -167.03 0.07 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.1 1.36 . . . . 0.0 114.36 178.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.5 p -50.65 -31.73 17.03 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.585 1.154 . . . . 0.0 114.114 -173.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.52 -45.36 90.97 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 118.752 0.706 . . . . 0.0 110.006 177.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -68.18 -32.32 72.48 Favored 'General case' 0 CA--C 1.52 -0.204 0 C-N-CA 122.904 0.482 . . . . 0.0 110.215 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.79 -43.99 91.42 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.395 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.71 -42.08 91.81 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 175.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -59.15 -35.0 72.74 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 122.493 -0.129 . . . . 0.0 110.961 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 62.2 m -76.81 -43.05 38.11 Favored 'General case' 0 CA--C 1.524 -0.049 0 CA-C-O 119.689 -0.196 . . . . 0.0 111.413 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.1 mt -60.96 -27.78 68.51 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.553 -0.717 . . . . 0.0 109.137 174.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.1 -15.35 36.2 Favored Glycine 0 CA--C 1.528 0.889 0 CA-C-O 119.228 -0.762 . . . . 0.0 113.458 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -97.82 -5.33 34.97 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.664 1.232 . . . . 0.0 111.652 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.9 m -123.45 -26.81 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.338 0.102 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.5 tp -55.78 -27.46 22.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 CA-C-N 118.123 0.42 . . . . 0.0 111.588 -178.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.441 ' HA ' ' HB1' ' A' ' 144' ' ' ALA . 22.1 pt20 -60.84 -47.5 86.05 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.262 0.625 . . . . 0.0 110.606 178.416 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -75.19 -38.71 60.7 Favored 'General case' 0 CA--C 1.522 -0.116 0 C-N-CA 123.022 0.529 . . . . 0.0 110.502 -179.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 89.0 mt -59.41 -49.67 76.9 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.409 -178.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.457 HD13 ' CB ' ' A' ' 144' ' ' ALA . 58.6 mt -67.73 -51.87 44.17 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-O 118.458 -0.782 . . . . 0.0 110.462 177.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 91.2 p -53.52 -49.05 68.4 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 119.227 -0.989 . . . . 0.0 111.313 -176.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -69.65 -35.11 74.88 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 121.882 -0.511 . . . . 0.0 111.467 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.87 -48.26 81.3 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 118.225 0.466 . . . . 0.0 111.17 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.88 -33.21 29.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.743 -177.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.03 -27.56 65.77 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 119.522 -0.871 . . . . 0.0 110.646 178.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 4.5 ttpt -80.69 -23.81 39.3 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.205 1.002 . . . . 0.0 110.583 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.9 m -78.04 158.72 29.11 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -170.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -100.12 -179.87 4.27 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 170.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -36.59 68.08 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.547 1.067 . . . . 0.0 112.858 -175.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -69.66 -42.78 73.74 Favored 'General case' 0 N--CA 1.456 -0.166 0 O-C-N 121.618 -0.676 . . . . 0.0 110.698 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 60.6 m80 -73.57 -37.67 65.45 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 119.573 -0.251 . . . . 0.0 111.136 -177.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.422 ' HD2' ' C ' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -64.92 -37.2 86.84 Favored 'General case' 0 C--N 1.34 0.184 0 N-CA-C 108.469 -0.938 . . . . 0.0 108.469 176.321 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -62.3 -43.62 98.4 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 178.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -62.35 -38.92 91.38 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 122.119 -0.363 . . . . 0.0 111.424 176.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.6 -43.32 80.46 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 118.526 0.603 . . . . 0.0 111.13 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -70.68 -26.18 63.32 Favored 'General case' 0 C--O 1.225 -0.236 0 O-C-N 121.329 -0.857 . . . . 0.0 110.645 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.1 ttt -68.58 -41.04 80.23 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 174.108 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 33.2 tp -57.19 -49.3 76.42 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.121 0.568 . . . . 0.0 109.609 176.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 85.7 mt -72.92 -31.89 64.94 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -178.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -64.99 -43.92 90.98 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 118.274 0.488 . . . . 0.0 109.813 177.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.8 mt -65.86 -39.68 85.41 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 177.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 91.8 t90 -60.65 -33.14 72.37 Favored 'General case' 0 N--CA 1.454 -0.242 0 O-C-N 122.309 -0.244 . . . . 0.0 110.932 176.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -79.54 -34.26 41.21 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.404 0.282 . . . . 0.0 111.724 178.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 13.3 mmp_? -74.81 -20.3 59.84 Favored 'General case' 0 C--N 1.339 0.144 0 CA-C-N 118.0 0.364 . . . . 0.0 111.217 177.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 69.8 m -59.12 -28.73 66.81 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 117.677 0.217 . . . . 0.0 111.317 176.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 65.08 11.93 53.25 Favored Glycine 0 CA--C 1.529 0.906 0 CA-C-O 119.457 -0.635 . . . . 0.0 113.688 175.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 95.5 mt -74.94 -17.95 60.47 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 118.555 1.178 . . . . 0.0 111.694 -177.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -155.66 147.51 23.23 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 122.707 0.403 . . . . 0.0 110.354 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -161.32 163.5 30.75 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.098 0.559 . . . . 0.0 110.749 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt 59.82 170.98 0.08 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.727 1.211 . . . . 0.0 113.121 178.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 23.3 m 54.81 25.94 7.18 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.552 1.141 . . . . 0.0 113.164 178.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -150.83 155.66 39.66 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.9 0.48 . . . . 0.0 110.33 -178.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 96.8 mt -127.13 136.21 51.79 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 176.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 42.9 t-20 -64.34 125.47 24.71 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 111.622 0.23 . . . . 0.0 111.622 -173.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . 0.457 ' CB ' HD13 ' A' ' 109' ' ' LEU . . . -26.07 -46.64 0.02 OUTLIER 'General case' 0 C--N 1.342 0.257 0 C-N-CA 129.077 2.951 . . . . 0.0 115.133 -178.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -73.55 21.41 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 179.368 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? 52.34 27.63 5.01 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 123.412 0.685 . . . . 0.0 110.216 -170.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 75.7 m 45.71 30.98 0.9 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.514 0.726 . . . . 0.0 112.931 -172.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.622 ' HG3' ' H ' ' A' ' 149' ' ' CYS . 17.9 tptm -98.34 -174.54 2.86 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.881 0.848 . . . . 0.0 113.066 -172.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . 0.622 ' H ' ' HG3' ' A' ' 148' ' ' LYS . 83.4 m -47.91 -20.57 0.33 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 126.246 1.818 . . . . 0.0 114.289 -173.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -34.74 -69.55 0.09 Allowed 'General case' 0 CA--C 1.521 -0.156 0 C-N-CA 124.723 1.209 . . . . 0.0 111.669 177.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -107.46 -14.79 14.77 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 123.568 0.543 . . . . 0.0 111.154 170.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' MET . . . . . 0.422 ' SD ' ' N ' ' A' ' 152' ' ' MET . 0.4 OUTLIER -83.24 -10.49 58.53 Favored 'General case' 0 C--N 1.342 0.243 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -174.981 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -66.19 -37.34 85.38 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 119.252 0.933 . . . . 0.0 112.136 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 2.3 tm? . . . . . 0 C--O 1.252 1.198 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 -179.945 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 58.5 t80 . . . . . 0 N--CA 1.477 0.895 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 78.2 p -69.11 152.19 96.83 Favored Pre-proline 0 CA--C 1.532 0.272 0 O-C-N 122.103 -0.373 . . . . 0.0 110.918 -179.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -78.66 5.12 5.82 Favored 'Trans proline' 0 N--CA 1.453 -0.858 0 C-N-CA 124.179 3.253 . . . . 0.0 112.289 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 63.3 p -98.8 155.88 17.14 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.984 0.514 . . . . 0.0 111.128 -177.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 159' ' ' SEP . . . . . 0.433 ' P ' ' HG ' ' A' ' 25' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -76.51 -176.52 18.75 Favored 'Cis proline' 0 N--CA 1.456 -0.734 0 CA-C-N 119.332 0.797 . . . . 0.0 110.646 -7.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 32.5 t -81.89 164.0 21.86 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 122.521 0.328 . . . . 0.0 110.519 176.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -131.5 127.18 36.76 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.841 0.456 . . . . 0.0 110.713 177.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 21.8 t -104.07 131.14 22.22 Favored Pre-proline 0 N--CA 1.453 -0.295 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 174.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -57.48 -10.45 6.8 Favored 'Trans proline' 0 N--CA 1.448 -1.183 0 C-N-CA 122.854 2.369 . . . . 0.0 112.943 176.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 52.4 p -67.15 -22.29 65.77 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 118.865 0.757 . . . . 0.0 112.21 -177.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -76.5 -14.21 18.07 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.181 2.587 . . . . 0.0 112.378 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 47.7 t . . . . . 0 C--O 1.251 1.179 0 CA-C-O 117.574 -1.203 . . . . 0.0 110.286 -175.939 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.7 tpt . . . . . 0 N--CA 1.475 0.808 0 CA-C-O 119.518 -0.277 . . . . 0.0 111.643 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -95.41 15.27 20.0 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -175.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -133.68 3.8 3.56 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 122.265 -0.272 . . . . 0.0 111.433 -178.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -149.74 172.85 14.43 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 122.045 -0.409 . . . . 0.0 110.424 -178.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -76.27 47.08 0.44 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.417 1.087 . . . . 0.0 112.004 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -75.97 -160.86 0.15 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.542 0.737 . . . . 0.0 109.852 176.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -54.79 -14.35 1.37 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.525 0.73 . . . . 0.0 111.053 177.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -53.63 -34.6 59.12 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.367 0.667 . . . . 0.0 110.506 175.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 34.4 m-20 -64.47 -48.5 75.01 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 118.962 0.801 . . . . 0.0 110.16 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -63.1 -49.06 75.93 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 110.466 -0.198 . . . . 0.0 110.466 -177.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 86.2 t -63.45 -57.75 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.22 -29.54 67.58 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 119.395 -0.336 . . . . 0.0 111.802 -177.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 61.9 m -71.53 -46.04 60.69 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.35 0.523 . . . . 0.0 110.48 176.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.5 tp -65.89 -33.84 76.76 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.077 0.465 . . . . 0.0 110.167 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -68.42 -43.27 77.53 Favored 'General case' 0 CA--C 1.522 -0.108 0 C-N-CA 123.93 0.892 . . . . 0.0 109.648 178.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.6 t -62.88 -31.75 72.86 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 174.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.83 -32.86 70.04 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 177.214 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -72.83 -37.73 67.37 Favored 'General case' 0 C--O 1.23 0.06 0 C-N-CA 123.019 0.528 . . . . 0.0 111.655 176.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -73.98 -16.92 61.06 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -175.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 90.0 mt -93.34 159.29 15.33 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.081 0.467 . . . . 0.0 111.465 -178.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -122.84 7.74 9.35 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.104 0.961 . . . . 0.0 109.92 178.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 77.4 p -76.17 -168.98 1.03 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.117 0.967 . . . . 0.0 110.024 178.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -75.94 -145.28 1.53 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 111.551 -0.62 . . . . 0.0 111.551 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 21.3 mm -107.13 76.94 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 C-N-CA 123.322 0.649 . . . . 0.0 110.072 -173.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.413 ' HG ' ' P ' ' B' ' 159' ' ' SEP . 28.7 t -64.24 124.52 21.92 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 120.882 0.372 . . . . 0.0 110.139 -179.387 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.401 ' C ' ' HD2' ' B' ' 160' ' ' PRO . . . -68.79 -25.79 74.96 Favored Glycine 0 CA--C 1.524 0.604 0 CA-C-O 119.603 -0.554 . . . . 0.0 112.534 -176.132 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 83.1 p -64.22 -33.96 77.0 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 118.549 1.174 . . . . 0.0 111.079 -175.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -69.98 -39.19 76.09 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 54.7 mt -63.98 -38.08 81.47 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.07 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 176.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -60.8 -45.24 95.17 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 118.92 -0.562 . . . . 0.0 110.654 176.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.95 -40.34 97.38 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 119.256 0.934 . . . . 0.0 111.396 178.05 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 99.4 mt -64.52 -58.56 6.05 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 119.709 -0.186 . . . . 0.0 111.044 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.424 HG23 ' HB2' ' A' ' 71' ' ' SER . 44.2 p -54.18 -41.36 68.47 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-N 118.0 0.363 . . . . 0.0 111.693 175.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.0 m -55.53 -60.18 3.79 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 119.227 -0.416 . . . . 0.0 111.104 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -67.15 -32.69 73.98 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 119.134 -1.026 . . . . 0.0 111.711 -174.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.425 ' HB3' ' HH ' ' A' ' 76' ' ' TYR . . . -59.38 -58.14 9.91 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 122.029 -0.42 . . . . 0.0 110.109 174.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.0 mt -70.45 -17.02 62.99 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.637 0.775 . . . . 0.0 112.47 -175.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -66.9 -21.76 65.98 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -178.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.4 t60 -148.17 -30.03 0.3 Allowed 'General case' 0 C--N 1.34 0.169 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -175.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 33.4 mm 43.86 73.95 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 121.583 0.706 . . . . 0.0 111.436 -178.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -149.49 21.12 0.93 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.705 0.802 . . . . 0.0 109.754 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.585 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.24 36.85 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 C-N-CA 124.539 1.135 . . . . 0.0 109.183 -172.109 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.449 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -50.95 -56.12 13.92 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -175.899 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 79.2 p -75.29 -25.78 58.22 Favored 'General case' 0 CA--C 1.522 -0.129 0 N-CA-C 112.33 0.492 . . . . 0.0 112.33 -173.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.642 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -83.07 -42.3 17.6 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -179.3 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 21.0 mt -57.61 -52.77 53.21 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.123 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 171.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 13.3 mm -65.81 -47.05 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 CA-C-O 119.494 -0.288 . . . . 0.0 111.514 -176.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.6 t -56.21 -40.1 73.52 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 120.034 -0.667 . . . . 0.0 109.859 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.7 tp -68.3 -41.72 80.53 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 118.834 -0.603 . . . . 0.0 112.543 -176.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.7 pt -74.67 -36.4 40.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 CA-C-N 119.688 1.131 . . . . 0.0 111.946 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.0 mt -63.97 -48.59 85.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 177.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -59.47 -43.72 93.17 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.778 177.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -55.73 -40.1 72.02 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 177.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.7 t -65.34 -55.41 18.36 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -69.15 -21.17 64.02 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -173.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 50.2 mt -81.55 -14.8 56.41 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 179.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 78.8 m -125.04 163.73 35.9 Favored Pre-proline 0 CA--C 1.539 0.546 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 -169.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -59.11 174.26 1.0 Allowed 'Trans proline' 0 C--N 1.348 0.549 1 C-N-CA 126.041 4.494 . . . . 0.0 114.645 -179.231 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.573 ' HB3' ' HE2' ' A' ' 115' ' ' LYS . 4.6 p-10 -59.42 -30.18 68.29 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -174.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 25.3 t -63.53 -36.88 85.25 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -78.49 -28.13 46.3 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.034 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -63.05 -45.31 92.83 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-N 119.013 0.824 . . . . 0.0 109.104 173.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.7 tp -63.32 -48.27 78.73 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.76 -41.86 96.14 Favored Glycine 0 C--N 1.336 0.579 0 N-CA-C 111.111 -0.796 . . . . 0.0 111.111 178.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.2 m -63.63 -43.97 95.26 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 117.043 0.422 . . . . 0.0 110.443 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 81.6 mt -62.34 -37.02 84.04 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 118.086 0.403 . . . . 0.0 110.749 179.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -70.81 -33.28 70.54 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.64 0.654 . . . . 0.0 111.344 177.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 69.9 mt -71.3 -41.38 74.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 176.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 66.8 mt -65.25 -33.72 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 123.516 0.726 . . . . 0.0 109.412 177.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -75.18 -42.48 55.74 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 119.606 -0.235 . . . . 0.0 111.361 -178.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.424 ' HB2' HG23 ' A' ' 33' ' ' THR . 10.9 p -68.42 -49.77 57.53 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-N 118.592 0.633 . . . . 0.0 110.731 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 54.8 mt -67.4 -42.67 87.6 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.096 0 CA-C-N 117.725 0.239 . . . . 0.0 110.466 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.22 -39.66 94.54 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 -178.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.431 ' CD ' ' HD3' ' B' ' 167' ' ' PRO . 33.0 ttm-85 -70.1 -40.02 75.19 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.181 0.592 . . . . 0.0 110.314 179.261 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.92 -40.38 83.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 178.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.425 ' HH ' ' HB3' ' A' ' 36' ' ' ALA . 8.1 m-30 -62.36 -49.43 75.59 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 175.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.6 tp -57.61 -48.39 79.54 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.017 0.527 . . . . 0.0 110.25 -176.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -64.51 -43.86 92.74 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.808 -0.178 . . . . 0.0 110.811 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -67.9 -39.25 83.65 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 121.127 -0.229 . . . . 0.0 111.506 -175.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.1 t -80.17 -24.28 40.45 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.872 -178.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -82.03 -24.19 35.48 Favored 'General case' 0 C--N 1.341 0.212 0 CA-C-N 118.438 0.563 . . . . 0.0 111.621 172.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.0 t -75.68 -18.1 59.74 Favored 'General case' 0 CA--C 1.528 0.135 0 CA-C-N 117.948 0.34 . . . . 0.0 111.725 177.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -86.76 147.29 25.91 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 49.4 m -140.54 5.02 2.0 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.562 0.745 . . . . 0.0 111.389 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -95.47 163.87 13.05 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.05 0.54 . . . . 0.0 109.938 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 78.9 p -72.35 151.38 42.74 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.984 0.421 . . . . 0.0 110.933 -179.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.9 t -158.33 169.79 23.69 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.091 0.556 . . . . 0.0 109.592 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.6 t -71.25 158.92 35.55 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 120.987 0.422 . . . . 0.0 110.351 178.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -129.61 6.49 5.19 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.271 0.628 . . . . 0.0 111.273 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -74.46 -45.18 5.8 Favored Pre-proline 0 CA--C 1.532 0.288 0 CA-C-O 118.353 -0.832 . . . . 0.0 112.534 -178.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -80.02 -16.01 11.44 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.259 1.973 . . . . 0.0 111.439 178.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 75.66 -33.69 1.2 Allowed Glycine 0 CA--C 1.529 0.949 0 C-N-CA 124.167 0.889 . . . . 0.0 112.249 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 49.39 -158.92 0.07 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.71 1.204 . . . . 0.0 113.767 176.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.2 p -53.0 -30.17 33.65 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.034 0.934 . . . . 0.0 113.434 -175.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.74 -46.32 90.13 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 118.97 0.804 . . . . 0.0 109.859 175.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -73.78 -23.04 59.65 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.897 178.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.75 -45.89 84.5 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 175.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.6 mt -64.45 -43.0 96.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 176.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -60.18 -34.12 73.15 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 121.309 -0.156 . . . . 0.0 111.33 178.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.6 m -74.92 -41.29 59.96 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-O 119.517 -0.278 . . . . 0.0 111.342 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.2 mt -61.39 -30.5 70.59 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 174.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.68 -14.92 31.38 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 119.277 -0.735 . . . . 0.0 113.637 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.78 -6.92 24.23 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.701 1.25 . . . . 0.0 111.959 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.3 m -121.18 -20.29 4.36 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -178.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.5 tp -51.42 -27.66 7.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 C-N-CA 123.027 0.531 . . . . 0.0 112.099 -177.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.405 ' HA ' ' CB ' ' A' ' 144' ' ' ALA . 18.3 pt20 -64.1 -56.22 16.42 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 122.765 0.426 . . . . 0.0 110.81 177.42 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -66.31 -40.32 89.9 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 73.5 mt -58.59 -55.68 31.94 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 119.05 -0.5 . . . . 0.0 110.946 -177.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.3 mt -69.45 -51.8 32.78 Favored 'General case' 0 N--CA 1.457 -0.08 0 CA-C-N 118.581 0.628 . . . . 0.0 111.565 -177.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 80.4 p -55.06 -49.82 70.66 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 120.116 -0.634 . . . . 0.0 111.706 -178.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -69.69 -45.76 67.58 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 118.897 0.772 . . . . 0.0 111.513 -178.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -51.91 -55.88 17.51 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 118.11 0.414 . . . . 0.0 110.955 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 25.7 mt -69.19 -37.28 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 O-C-N 122.955 0.159 . . . . 0.0 110.821 -178.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.61 -21.46 61.84 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.143 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.573 ' HE2' ' HB3' ' A' ' 59' ' ' ASP . 0.1 OUTLIER -98.39 -15.17 19.79 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.649 0.38 . . . . 0.0 111.929 -175.736 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 87.8 p -84.34 167.99 16.03 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -174.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . 0.515 HD22 ' CD2' ' A' ' 120' ' ' HIS . 11.6 p30 -86.72 174.42 8.85 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 49.9 mm-40 -55.89 -40.31 72.81 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.558 0.617 . . . . 0.0 112.04 -175.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -71.42 -42.6 68.08 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.514 0.597 . . . . 0.0 111.001 -179.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.515 ' CD2' HD22 ' A' ' 117' ' ' ASN . 11.4 m-70 -71.17 -42.42 69.1 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.149 -0.345 . . . . 0.0 110.543 -178.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.4 ttpt -51.36 -49.88 60.6 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 169.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -61.12 -37.82 84.14 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 120.93 -0.308 . . . . 0.0 111.33 -175.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -63.03 -43.33 98.99 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 122.365 -0.209 . . . . 0.0 111.483 175.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 69.4 mt -69.59 -34.24 60.58 Favored 'Isoleucine or valine' 0 C--N 1.338 0.096 0 C-N-CA 119.869 -0.733 . . . . 0.0 109.05 178.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -35.75 81.95 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 177.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 19.9 ttt -66.27 -43.72 85.6 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 123.132 0.573 . . . . 0.0 110.316 175.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.41 -41.29 84.62 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 176.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 75.9 mt -70.43 -31.23 68.33 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 178.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -67.47 -39.47 85.29 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 117.941 0.337 . . . . 0.0 110.135 178.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.66 -42.28 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 177.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 61.3 t90 -61.83 -36.96 82.71 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.494 0.318 . . . . 0.0 110.868 177.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -75.08 -37.28 61.61 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 122.695 0.398 . . . . 0.0 111.305 178.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -67.3 -40.07 86.0 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 122.203 0.201 . . . . 0.0 111.104 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 64.9 m -73.63 -16.58 61.22 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 111.37 0.137 . . . . 0.0 111.37 178.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -88.15 -4.82 77.42 Favored Glycine 0 CA--C 1.527 0.833 0 CA-C-O 119.667 -0.518 . . . . 0.0 112.036 178.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 73.4 mt 56.44 179.49 0.04 OUTLIER 'General case' 0 C--N 1.343 0.325 0 C-N-CA 124.38 1.072 . . . . 0.0 112.194 -176.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 54.4 -164.17 0.11 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.792 0.837 . . . . 0.0 111.739 -178.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.9 13.83 9.89 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.193 0.597 . . . . 0.0 111.963 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -107.07 146.69 30.9 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.206 0.602 . . . . 0.0 110.213 -178.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 81.6 p -88.21 167.62 13.44 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 122.993 0.517 . . . . 0.0 111.321 -179.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -127.9 10.26 6.46 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.975 0.51 . . . . 0.0 111.405 -179.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.519 ' HG ' ' H ' ' A' ' 144' ' ' ALA . 55.8 tp -148.16 137.54 22.15 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 122.847 0.459 . . . . 0.0 109.977 -178.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -80.93 -14.48 57.95 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -176.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . 0.519 ' H ' ' HG ' ' A' ' 142' ' ' LEU . . . -53.26 -45.22 68.72 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.123 0.969 . . . . 0.0 111.986 -171.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.617 HD12 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -103.21 -10.7 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 C-N-CA 122.387 0.275 . . . . 0.0 111.713 174.479 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -58.61 -31.95 68.54 Favored 'General case' 0 C--N 1.339 0.132 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 174.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 47.3 t -69.77 118.63 12.88 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 169.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 152' ' ' MET . 99.2 mttt -56.06 -20.66 17.91 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 123.773 0.829 . . . . 0.0 113.102 -172.084 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 72.1 m -43.57 -29.29 0.46 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.608 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . 0.501 ' CE1' ' HG2' ' A' ' 152' ' ' MET . 6.4 p90 -49.98 -126.67 0.0 OUTLIER 'General case' 0 C--N 1.344 0.353 0 C-N-CA 126.301 1.84 . . . . 0.0 114.279 -176.039 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . 0.456 ' N ' ' CG ' ' A' ' 150' ' ' PHE . . . -66.96 -0.06 2.86 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 120.408 -1.432 . . . . 0.0 110.851 172.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' MET . . . . . 0.501 ' HG2' ' CE1' ' A' ' 150' ' ' PHE . 12.8 mmt -106.14 -13.74 15.35 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 119.59 1.087 . . . . 0.0 111.751 -177.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 28.6 t70 50.81 13.97 0.16 Allowed 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 172.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 54.7 tp . . . . . 0 C--O 1.251 1.146 0 CA-C-O 117.766 -1.111 . . . . 0.0 110.713 -178.678 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 55.0 p90 . . . . . 0 N--CA 1.473 0.708 0 N-CA-C 110.585 -0.154 . . . . 0.0 110.585 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 53.0 m -130.34 156.76 78.98 Favored Pre-proline 0 CA--C 1.531 0.214 0 C-N-CA 123.377 0.671 . . . . 0.0 110.442 -178.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -69.05 164.83 32.31 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 123.754 2.969 . . . . 0.0 111.213 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 82.2 p -136.75 177.57 7.75 Favored 'General case' 0 N--CA 1.457 -0.082 0 C-N-CA 123.324 0.65 . . . . 0.0 110.81 -177.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 159' ' ' SEP . . . . . 0.421 ' C ' ' H ' ' B' ' 161' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 160' ' ' PRO . . . . . 0.401 ' HD2' ' C ' ' A' ' 26' ' ' GLY . 44.5 Cg_endo -79.35 13.05 18.83 Favored 'Cis proline' 0 N--CA 1.455 -0.764 0 CA-C-N 118.786 0.602 . . . . 0.0 110.854 -10.459 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 161' ' ' SER . . . . . 0.421 ' H ' ' C ' ' B' ' 159' ' ' SEP . 18.8 t 62.82 171.56 0.14 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.901 1.28 . . . . 0.0 112.108 -171.445 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -144.52 148.53 34.58 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.753 0.821 . . . . 0.0 110.306 -178.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 16.1 t -124.44 130.51 24.29 Favored Pre-proline 0 N--CA 1.45 -0.43 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.72 -10.8 4.19 Favored 'Trans proline' 0 N--CA 1.452 -0.952 0 C-N-CA 123.292 2.661 . . . . 0.0 113.054 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 67.2 p -72.63 -19.32 61.47 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -177.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . 0.431 ' HD3' ' CD ' ' A' ' 74' ' ' ARG . 98.7 Cg_endo -71.21 176.22 8.16 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 123.608 2.872 . . . . 0.0 111.666 178.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 74.1 m . . . . . 0 C--O 1.252 1.199 0 CA-C-O 117.775 -1.107 . . . . 0.0 111.172 176.808 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.836 0 CA-C-O 120.26 0.076 . . . . 0.0 110.934 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -139.03 164.62 29.29 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.029 0.532 . . . . 0.0 110.262 179.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -101.58 155.59 18.0 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 122.863 0.465 . . . . 0.0 110.894 -177.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 60.61 144.59 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.202 1.801 . . . . 0.0 114.297 -178.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -147.95 31.24 0.86 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.173 0.989 . . . . 0.0 109.588 179.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -75.75 -152.69 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.83 0.852 . . . . 0.0 110.282 179.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -54.28 -15.06 1.37 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.928 0.891 . . . . 0.0 111.957 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.4 tp60 -55.64 -41.8 74.1 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.191 0.596 . . . . 0.0 111.13 177.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -65.47 -38.75 90.72 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 118.637 0.653 . . . . 0.0 110.521 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -64.44 -55.13 22.96 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 120.726 0.298 . . . . 0.0 110.235 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 96.6 t -59.16 -54.65 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.52 -32.1 68.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.938 0.495 . . . . 0.0 112.08 -177.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 58.9 m -72.56 -44.44 62.08 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 118.45 0.568 . . . . 0.0 110.707 177.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.9 tp -67.72 -33.38 74.76 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.424 0.631 . . . . 0.0 109.854 -179.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -65.15 -45.45 84.9 Favored 'General case' 0 CA--C 1.521 -0.159 0 C-N-CA 123.842 0.857 . . . . 0.0 109.216 176.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.3 t -61.6 -32.13 72.23 Favored 'General case' 0 N--CA 1.457 -0.079 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 175.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -61.58 -49.92 74.7 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 176.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -67.71 -36.56 80.85 Favored 'General case' 0 C--N 1.339 0.129 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -77.14 -37.38 54.11 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -175.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 34.4 tp -82.75 -17.64 43.53 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 117.672 0.214 . . . . 0.0 111.399 -176.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm 52.72 29.19 7.1 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.412 0.685 . . . . 0.0 112.145 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 69.3 p -74.67 179.59 4.67 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.658 0.783 . . . . 0.0 111.227 -179.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -76.57 -141.53 1.2 Allowed Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.5 mm -106.08 36.43 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 123.073 0.549 . . . . 0.0 110.71 -174.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.415 ' HG ' ' P ' ' B' ' 159' ' ' SEP . 75.6 m -54.95 128.51 33.78 Favored 'General case' 0 C--N 1.339 0.134 0 O-C-N 121.959 -0.463 . . . . 0.0 110.241 -179.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.81 -15.27 62.03 Favored Glycine 0 C--N 1.337 0.584 0 CA-C-O 119.166 -0.796 . . . . 0.0 113.761 -174.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.1 p -62.38 -40.08 95.27 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 119.155 1.478 . . . . 0.0 110.823 -177.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -68.16 -42.72 79.64 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 56.1 mt -63.77 -36.04 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.3 mmtt -66.5 -42.21 87.73 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 118.743 -0.646 . . . . 0.0 110.864 179.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.13 -41.77 94.51 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.213 0.915 . . . . 0.0 111.039 175.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.2 mt -61.81 -57.28 12.47 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 122.563 -0.086 . . . . 0.0 110.929 -179.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.464 HG21 ' HB2' ' A' ' 71' ' ' SER . 41.3 p -55.67 -43.97 76.85 Favored 'General case' 0 CA--C 1.523 -0.071 0 O-C-N 122.152 -0.343 . . . . 0.0 111.641 177.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 m -55.38 -58.8 6.23 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 122.396 0.278 . . . . 0.0 110.799 -178.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -78.59 -14.62 59.24 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -172.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.42 -58.51 3.65 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 166.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.4 mt -65.62 -20.69 66.41 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.901 0.88 . . . . 0.0 112.284 -176.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -72.59 -14.89 61.72 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -133.71 -46.11 0.81 Allowed 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 119.011 0.823 . . . . 0.0 112.964 -176.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 39.8 mm 40.27 66.32 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 122.304 1.05 . . . . 0.0 111.529 -174.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -150.34 21.62 0.84 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.663 1.185 . . . . 0.0 108.655 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.574 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -148.8 35.52 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 C-N-CA 125.069 1.347 . . . . 0.0 109.063 -170.562 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.45 -52.81 43.17 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -175.044 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 83.5 p -76.57 -24.06 53.54 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -173.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.61 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -86.2 -41.76 14.39 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -179.584 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 48.8 mt -56.27 -52.77 47.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 118.259 0.481 . . . . 0.0 109.817 170.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 14.8 mm -67.09 -48.12 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.139 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.582 -177.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 48.4 t -55.76 -37.64 68.8 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 120.001 -0.68 . . . . 0.0 109.722 178.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.4 tp -69.31 -43.12 74.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.551 -0.738 . . . . 0.0 112.613 -177.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 31.3 pt -72.41 -35.53 52.05 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 120.047 1.294 . . . . 0.0 111.781 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 94.9 mt -64.24 -49.66 80.13 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-O 121.593 0.711 . . . . 0.0 109.257 178.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -57.92 -41.97 83.83 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.474 177.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -56.45 -41.07 75.88 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 176.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.4 t -66.22 -48.42 70.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 112.135 0.421 . . . . 0.0 112.135 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -73.21 -23.97 60.45 Favored 'General case' 0 C--O 1.231 0.081 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -175.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 51.4 mt -80.49 -15.1 57.55 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 178.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.403 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 73.4 m -119.87 157.36 52.74 Favored Pre-proline 0 CA--C 1.536 0.434 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -171.416 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.403 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 90.5 Cg_endo -72.62 -170.79 0.64 Allowed 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 125.045 3.83 . . . . 0.0 113.642 -176.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -50.67 -44.98 57.83 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.42 1.888 . . . . 0.0 114.462 -170.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.0 p -60.12 -31.4 70.03 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 65.1 m-70 -86.32 -14.7 42.84 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 118.921 -0.561 . . . . 0.0 111.136 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -69.85 -43.47 71.87 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 171.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 57.2 tp -66.44 -49.12 67.76 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.3 -38.32 93.15 Favored Glycine 0 C--N 1.336 0.552 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 178.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.1 t -60.94 -51.07 70.82 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 177.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 49.5 mt -58.59 -34.58 71.27 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.736 -0.65 . . . . 0.0 111.605 179.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -72.41 -33.53 67.21 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.389 0.995 . . . . 0.0 111.783 177.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 75.9 mt -75.69 -40.42 40.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 118.607 0.639 . . . . 0.0 110.378 178.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 84.6 mt -63.63 -36.68 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 174.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -67.8 -43.68 79.1 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.998 -0.525 . . . . 0.0 111.057 178.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.464 ' HB2' HG21 ' A' ' 33' ' ' THR . 89.3 p -67.17 -57.13 7.33 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 118.627 0.649 . . . . 0.0 111.289 -177.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 54.1 mt -64.88 -30.5 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 178.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.09 -54.67 19.81 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-O 119.851 -0.416 . . . . 0.0 112.541 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.614 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -66.49 -34.13 77.24 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 118.162 0.981 . . . . 0.0 110.754 -179.678 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.79 -45.96 76.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 110.318 -0.253 . . . . 0.0 110.318 177.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -63.71 -46.76 83.96 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 177.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 60.5 tp -55.93 -45.38 78.78 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 122.802 0.441 . . . . 0.0 110.507 -177.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -67.41 -46.94 71.7 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 120.775 -0.37 . . . . 0.0 110.811 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -64.68 -24.95 67.74 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -175.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.3 t -99.09 -27.77 13.68 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 118.798 0.726 . . . . 0.0 112.237 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 -84.2 -18.83 35.3 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.948 -0.47 . . . . 0.0 111.882 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 88.3 p -62.1 -18.88 62.16 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 118.223 0.465 . . . . 0.0 111.994 177.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 45.9 t30 52.28 25.02 3.13 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.228 1.011 . . . . 0.0 112.643 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 90.4 p -87.8 -3.11 58.97 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 122.677 0.391 . . . . 0.0 111.788 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -147.87 155.34 41.52 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.2 0.6 . . . . 0.0 109.403 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.0 t -99.56 -5.63 28.8 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.214 0.606 . . . . 0.0 111.173 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.4 t 56.88 -173.75 0.07 Allowed 'General case' 0 C--N 1.341 0.222 0 C-N-CA 124.287 1.035 . . . . 0.0 112.18 -177.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 53.8 m -71.81 163.71 27.32 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.216 0.606 . . . . 0.0 110.913 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -103.4 13.03 34.54 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -174.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.619 ' H ' ' HD2' ' A' ' 91' ' ' PRO . 88.8 tttt -133.22 -52.36 0.03 OUTLIER Pre-proline 0 CA--C 1.533 0.298 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -179.044 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.619 ' HD2' ' H ' ' A' ' 90' ' ' LYS . 95.8 Cg_endo -75.53 159.73 39.12 Favored 'Trans proline' 0 N--CA 1.452 -0.918 0 C-N-CA 122.137 1.891 . . . . 0.0 110.745 178.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.408 ' HA3' ' CG ' ' A' ' 96' ' ' HIS . . . -83.27 -20.79 59.89 Favored Glycine 0 CA--C 1.529 0.93 0 N-CA-C 111.551 -0.619 . . . . 0.0 111.551 178.109 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 49.68 -160.67 0.06 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.665 1.186 . . . . 0.0 114.093 177.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.6 p -53.58 -28.46 32.14 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.153 0.981 . . . . 0.0 113.549 -174.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.74 -46.16 86.61 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 118.921 0.782 . . . . 0.0 109.952 176.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.408 ' CG ' ' HA3' ' A' ' 92' ' ' GLY . 3.2 m80 -73.96 -22.32 59.68 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.462 178.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.79 -46.57 78.18 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 175.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 94.9 mt -63.05 -41.69 93.8 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 175.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -63.51 -33.87 76.53 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 179.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.6 m -73.12 -39.7 65.55 Favored 'General case' 0 C--O 1.227 -0.126 0 O-C-N 122.342 -0.224 . . . . 0.0 110.654 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.1 mt -62.34 -31.58 72.24 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 173.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.46 -15.4 24.36 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-O 119.0 -0.889 . . . . 0.0 113.463 179.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -100.29 -4.74 28.68 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 119.263 1.531 . . . . 0.0 111.856 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 28.7 m -124.52 -20.55 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 122.823 0.449 . . . . 0.0 112.024 -179.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.8 tp -54.4 -23.4 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 C-N-CA 123.358 0.663 . . . . 0.0 112.222 -176.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -59.4 -54.01 51.56 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.623 0.369 . . . . 0.0 111.602 178.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -78.34 -29.16 47.42 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 121.124 -0.23 . . . . 0.0 110.795 -177.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.2 mt -63.16 -52.16 63.54 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 64.3 mt -64.79 -59.81 3.8 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 118.478 -0.773 . . . . 0.0 110.369 176.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 90.7 p -52.77 -42.32 64.89 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 118.97 -1.092 . . . . 0.0 111.857 -172.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -69.44 -47.49 63.88 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 119.16 0.891 . . . . 0.0 111.175 178.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.84 -34.58 65.53 Favored 'General case' 0 N--CA 1.458 -0.068 0 C-N-CA 123.503 0.721 . . . . 0.0 112.323 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -81.92 -39.75 16.92 Favored 'Isoleucine or valine' 0 C--N 1.337 0.041 0 CA-C-N 119.471 1.032 . . . . 0.0 112.048 175.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.64 -25.95 64.17 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.344 -178.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.94 -17.39 47.22 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.256 0.623 . . . . 0.0 110.731 178.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 13.3 m -80.88 160.85 24.62 Favored 'General case' 0 N--CA 1.457 -0.079 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -174.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -96.27 -179.2 4.57 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 170.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -55.47 -43.5 75.56 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.931 0.787 . . . . 0.0 111.828 -177.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -68.6 -41.39 79.66 Favored 'General case' 0 N--CA 1.453 -0.285 0 O-C-N 121.555 -0.715 . . . . 0.0 111.05 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -72.15 -38.27 69.24 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 122.158 -0.339 . . . . 0.0 111.176 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.73 -34.94 78.95 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -63.14 -42.51 99.48 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 178.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -61.59 -42.71 99.26 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 110.556 -0.165 . . . . 0.0 110.556 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.0 mt -65.89 -37.74 80.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 39.4 ttt180 -63.35 -33.26 75.13 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 176.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 62.4 ttp -67.79 -41.45 83.19 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 176.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 88.3 mt -58.76 -45.7 89.14 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.197 176.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.3 mt -67.33 -35.25 79.03 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 111.571 0.212 . . . . 0.0 111.571 -179.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -66.01 -37.43 85.91 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 117.999 0.363 . . . . 0.0 110.176 178.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 89.4 mt -70.27 -38.83 75.69 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 177.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 44.4 m0 -66.86 -29.97 70.01 Favored 'General case' 0 C--N 1.338 0.099 0 CA-C-N 117.874 0.307 . . . . 0.0 110.43 177.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -77.27 -34.34 55.73 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 117.757 0.253 . . . . 0.0 110.891 176.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 22.8 tpp180 -70.73 -38.33 73.56 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 122.618 0.367 . . . . 0.0 111.372 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 90.8 p -86.4 -13.53 46.04 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.43 0.292 . . . . 0.0 111.747 179.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 72.58 -174.08 45.93 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 -178.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.484 ' HG ' ' H ' ' A' ' 138' ' ' GLN . 35.2 tp -143.19 150.64 39.64 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 53.2 t80 -82.36 -0.48 46.07 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.075 0.55 . . . . 0.0 110.853 -178.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . 0.484 ' H ' ' HG ' ' A' ' 136' ' ' LEU . 75.8 mt-30 -139.04 168.34 20.06 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.229 1.011 . . . . 0.0 109.063 -178.048 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -134.83 177.02 8.12 Favored 'General case' 0 C--N 1.338 0.087 0 C-N-CA 122.798 0.439 . . . . 0.0 111.484 -174.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 19.9 m 60.41 23.9 13.47 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.295 1.038 . . . . 0.0 113.603 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -125.3 7.81 7.8 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.107 0.563 . . . . 0.0 111.27 178.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 83.4 mt -94.3 -7.53 41.64 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.467 0.544 . . . . 0.0 112.467 -175.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 67.0 m-20 -80.08 -6.18 57.2 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 122.815 0.446 . . . . 0.0 111.403 178.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . 0.495 ' C ' ' H ' ' A' ' 146' ' ' ARG . . . -38.3 -37.38 0.28 Allowed 'General case' 0 C--N 1.343 0.314 0 C-N-CA 127.858 2.463 . . . . 0.0 114.253 -173.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.589 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -67.92 15.93 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-O 119.214 -0.422 . . . . 0.0 112.093 178.207 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.495 ' H ' ' C ' ' A' ' 144' ' ' ALA . 99.6 mtt180 50.66 47.55 24.16 Favored 'General case' 0 C--N 1.34 0.153 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 -173.333 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 12.6 t 69.16 168.65 0.29 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.242 1.017 . . . . 0.0 112.625 -174.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -55.21 -14.62 1.81 Allowed 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 116.369 1.988 . . . . 0.0 116.369 -167.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 44.3 t -49.28 -47.33 46.92 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.101 1.318 . . . . 0.0 111.422 -174.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . 0.408 ' CD1' ' O ' ' A' ' 145' ' ' ILE . 18.7 m-85 -53.83 -85.71 0.01 OUTLIER 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 126.057 1.743 . . . . 0.0 114.398 -172.136 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -82.93 -14.33 54.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 119.402 -0.333 . . . . 0.0 111.835 -178.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 35.9 mtm -111.36 -12.02 14.08 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 114.892 1.441 . . . . 0.0 114.892 -168.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -112.18 -11.83 13.71 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 120.029 1.286 . . . . 0.0 111.881 174.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 95.4 mt . . . . . 0 C--O 1.251 1.158 0 CA-C-O 117.225 -1.369 . . . . 0.0 111.109 -178.499 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 . . . . . 0 N--CA 1.474 0.765 0 CA-C-O 120.313 0.101 . . . . 0.0 111.068 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 60.3 p -148.11 155.25 43.5 Favored Pre-proline 0 CA--C 1.529 0.165 0 C-N-CA 122.739 0.416 . . . . 0.0 110.19 179.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -74.52 164.44 33.88 Favored 'Trans proline' 0 N--CA 1.453 -0.899 0 C-N-CA 123.695 2.93 . . . . 0.0 111.229 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 36.6 p 59.43 151.82 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 126.441 1.897 . . . . 0.0 114.143 -177.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 159' ' ' SEP . . . . . 0.415 ' P ' ' HG ' ' A' ' 25' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -77.24 -178.74 25.01 Favored 'Cis proline' 0 N--CA 1.456 -0.72 0 CA-C-N 119.061 0.7 . . . . 0.0 110.37 -5.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 36.6 m -76.6 163.71 26.61 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 120.819 0.343 . . . . 0.0 110.898 176.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 162' ' ' TYR . . . . . 0.464 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 7.9 t80 -143.22 138.22 29.51 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.116 0.566 . . . . 0.0 110.307 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 35.9 t -124.88 142.31 40.63 Favored Pre-proline 0 N--CA 1.454 -0.267 0 C-N-CA 122.976 0.51 . . . . 0.0 111.46 177.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -66.87 -5.93 14.54 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 123.388 2.725 . . . . 0.0 111.523 175.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 66.9 p -96.6 25.36 5.19 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.826 0.45 . . . . 0.0 111.642 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -61.41 162.98 18.86 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 121.885 1.723 . . . . 0.0 110.605 170.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 32.0 t . . . . . 0 C--O 1.252 1.209 0 CA-C-O 117.522 -1.228 . . . . 0.0 110.857 -178.34 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.2 ttm . . . . . 0 N--CA 1.477 0.919 0 CA-C-O 119.567 -0.254 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.7 mm100 53.76 22.73 3.33 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 178.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -142.66 164.62 29.63 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 123.466 0.707 . . . . 0.0 110.364 -179.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -137.39 15.5 2.98 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.48 0.712 . . . . 0.0 111.126 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -123.9 34.79 4.98 Favored 'General case' 0 CA--C 1.527 0.095 0 C-N-CA 123.971 0.908 . . . . 0.0 110.503 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.463 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 12.9 t70 -73.79 -158.13 0.06 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.685 0.794 . . . . 0.0 110.385 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.463 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 13.5 t80 -55.58 -14.29 2.03 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.498 0.719 . . . . 0.0 111.142 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -51.4 -43.94 62.08 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.173 0.989 . . . . 0.0 110.609 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 44.7 m-20 -62.05 -44.2 97.2 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 118.042 0.383 . . . . 0.0 110.806 -179.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -64.88 -51.27 62.87 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 117.795 0.271 . . . . 0.0 110.566 -177.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.7 t -62.54 -55.09 26.08 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.05 -31.5 65.25 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.15 0.58 . . . . 0.0 111.802 -178.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 54.4 m -73.49 -43.0 61.14 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 118.387 0.54 . . . . 0.0 110.68 177.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.6 tp -66.72 -30.46 70.7 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -70.63 -43.83 68.44 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.167 0.987 . . . . 0.0 109.652 175.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -62.93 -26.77 68.97 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 175.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.49 -41.75 62.71 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 174.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -64.93 -28.0 69.23 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 123.087 0.555 . . . . 0.0 111.222 178.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -69.2 -14.59 63.06 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 178.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.1 mt -92.06 166.27 12.76 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 121.188 0.518 . . . . 0.0 111.158 -178.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -133.62 -1.2 3.12 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.216 176.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 34.6 t -157.7 157.57 33.76 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.693 0.797 . . . . 0.0 109.466 177.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.02 138.73 3.29 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.487 -0.645 . . . . 0.0 111.487 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.1 mm -119.07 45.12 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 124.534 1.134 . . . . 0.0 108.293 179.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.568 ' HA ' ' H ' ' B' ' 159' ' ' SEP . 70.3 m -49.89 127.25 15.9 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.401 0.68 . . . . 0.0 112.103 -174.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.56 -15.08 63.47 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-O 119.012 -0.882 . . . . 0.0 113.705 -176.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.416 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 46.5 t -62.46 -42.86 99.77 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 118.966 1.383 . . . . 0.0 110.301 -178.586 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -66.99 -40.87 87.48 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 46.0 mt -60.98 -37.58 77.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 176.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -60.74 -49.23 78.34 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.042 0.537 . . . . 0.0 110.783 177.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.416 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.5 OUTLIER -61.25 -43.51 98.76 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 118.366 0.53 . . . . 0.0 110.971 179.036 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.67 -61.92 2.09 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 122.356 -0.215 . . . . 0.0 110.635 -179.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 64.1 p -55.94 -46.02 78.65 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.3 t -63.32 -44.06 96.01 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.742 -176.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -68.19 -36.22 79.24 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 118.816 -1.153 . . . . 0.0 111.209 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.427 ' HB1' ' HH ' ' A' ' 76' ' ' TYR . . . -58.42 -56.29 24.08 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 174.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.9 mt -70.32 -17.89 63.08 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.477 0.711 . . . . 0.0 112.586 -175.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -63.76 -24.46 67.77 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -150.24 -26.15 0.24 Allowed 'General case' 0 C--N 1.342 0.253 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -176.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 32.6 mm 45.42 74.68 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 123.307 0.643 . . . . 0.0 111.484 -178.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -148.49 21.63 1.04 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.661 0.784 . . . . 0.0 109.964 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.572 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.13 36.69 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.134 0 C-N-CA 124.439 1.095 . . . . 0.0 109.566 -171.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.417 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -51.11 -55.27 18.58 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 -175.701 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 80.7 p -75.76 -25.76 56.79 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -173.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.622 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -83.03 -44.23 15.44 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.342 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 22.2 mt -56.23 -53.82 35.08 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 CA-C-N 118.178 0.445 . . . . 0.0 109.973 172.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.9 mm -65.33 -48.32 83.72 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.161 0 CA-C-O 119.209 -0.424 . . . . 0.0 111.523 -175.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 44.4 t -56.22 -40.43 74.05 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.167 178.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.2 tp -68.45 -41.46 80.21 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.4 pt -74.52 -35.0 37.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 CA-C-N 119.325 0.966 . . . . 0.0 111.906 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 97.4 mt -63.77 -50.68 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 177.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -58.14 -43.52 87.35 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.761 178.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.0 t80 -56.23 -41.65 76.05 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 176.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.7 t -64.69 -53.84 41.07 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -70.9 -23.7 62.34 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -173.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 51.2 mt -82.92 -15.95 49.34 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 76.3 m -118.55 159.15 45.07 Favored Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 -169.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -59.16 -171.5 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 1 C-N-CA 126.544 4.83 . . . . 0.0 116.582 -179.375 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -47.37 -58.79 3.75 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 126.719 2.008 . . . . 0.0 114.725 -175.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.2 p -58.81 -22.78 59.33 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.391 0.139 . . . . 0.0 110.668 -177.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 42.0 m-70 -88.84 -27.58 20.97 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 118.72 -0.657 . . . . 0.0 110.985 -178.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -66.52 -46.53 75.86 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 119.568 1.077 . . . . 0.0 108.215 172.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.0 tp -65.67 -48.89 70.55 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.853 0.359 . . . . 0.0 110.126 178.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.01 -40.19 95.2 Favored Glycine 0 C--N 1.336 0.553 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.4 m -65.68 -43.38 89.45 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 117.676 0.738 . . . . 0.0 110.564 178.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 72.1 mt -59.62 -35.46 74.4 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.866 0.757 . . . . 0.0 110.877 177.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -73.73 -35.34 65.06 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.516 0.598 . . . . 0.0 111.345 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 73.7 mt -70.09 -48.01 64.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 O-C-N 121.528 -0.732 . . . . 0.0 109.831 177.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 77.8 mt -59.1 -38.39 73.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 C-N-CA 124.283 1.033 . . . . 0.0 109.18 178.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -66.52 -46.81 74.94 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 118.676 -0.678 . . . . 0.0 111.084 177.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.0 t -62.37 -52.72 62.5 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 118.988 0.813 . . . . 0.0 110.887 -175.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 43.4 mt -63.8 -34.76 70.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.09 -51.24 46.38 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-O 119.739 -0.478 . . . . 0.0 112.665 -178.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.656 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -71.4 -32.34 68.31 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 117.994 0.897 . . . . 0.0 110.228 -178.055 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.66 -45.08 72.71 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 176.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.427 ' HH ' ' HB1' ' A' ' 36' ' ' ALA . 7.3 m-30 -61.57 -49.9 74.79 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 176.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.1 tp -60.75 -43.79 97.51 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.783 0.433 . . . . 0.0 110.931 -174.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -67.27 -45.24 77.22 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.471 178.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -64.32 -39.59 94.2 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 111.509 0.189 . . . . 0.0 111.509 -175.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.0 t -80.93 -33.79 33.83 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 118.037 0.38 . . . . 0.0 111.313 -179.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.7 ttt85 -67.03 -29.23 68.98 Favored 'General case' 0 C--N 1.339 0.122 0 CA-C-N 118.406 0.548 . . . . 0.0 110.405 177.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 24.2 t -69.97 -14.25 62.62 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 177.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -134.71 6.08 3.44 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -174.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 31.9 t -144.88 159.63 42.59 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 118.573 0.624 . . . . 0.0 111.051 -178.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -107.68 14.48 25.58 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.748 0.819 . . . . 0.0 111.073 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 33.3 m 54.31 31.94 15.32 Favored 'General case' 0 CA--C 1.527 0.085 0 C-N-CA 123.498 0.719 . . . . 0.0 111.994 -178.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 74.4 p -78.81 5.06 12.25 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.351 0.66 . . . . 0.0 112.176 -179.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 40.3 t -141.97 161.15 38.7 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 123.173 0.589 . . . . 0.0 110.12 178.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -119.65 -10.31 9.61 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.081 0.552 . . . . 0.0 111.386 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.452 ' N ' ' CD ' ' A' ' 91' ' ' PRO . 96.4 mttt -135.78 42.31 0.71 Allowed Pre-proline 0 CA--C 1.533 0.323 0 CA-C-O 118.901 -0.571 . . . . 0.0 112.106 -179.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.452 ' CD ' ' N ' ' A' ' 90' ' ' LYS . 62.2 Cg_endo -76.26 -4.06 14.6 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.856 2.371 . . . . 0.0 111.406 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 82.8 -172.02 51.46 Favored Glycine 0 C--N 1.338 0.661 0 N-CA-C 111.109 -0.796 . . . . 0.0 111.109 -178.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 54.23 -158.67 0.18 Allowed 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.466 1.106 . . . . 0.0 113.371 176.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 23.3 p -50.88 -30.34 14.33 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -175.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.82 -44.75 88.84 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.597 -0.689 . . . . 0.0 110.046 176.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -68.02 -30.29 69.5 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.931 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.49 -45.8 85.74 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 123.287 0.635 . . . . 0.0 110.143 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.6 mt -64.46 -42.23 94.65 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 175.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 44.6 t-20 -60.99 -33.62 73.52 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 121.255 -0.178 . . . . 0.0 110.725 178.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.8 m -73.54 -40.58 63.87 Favored 'General case' 0 N--CA 1.457 -0.097 0 CA-C-O 119.492 -0.29 . . . . 0.0 110.884 179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.1 mt -62.29 -29.65 70.58 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 173.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.69 -14.92 31.46 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 118.994 -0.892 . . . . 0.0 113.919 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -100.12 -6.24 26.58 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.016 1.408 . . . . 0.0 111.966 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.6 m -122.16 -18.57 4.74 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.163 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -178.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.7 tp -50.89 -28.46 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 CA-C-N 118.426 0.557 . . . . 0.0 111.602 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -59.35 -53.49 57.66 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.67 0.388 . . . . 0.0 110.849 177.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -80.72 -27.91 36.78 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 119.605 -0.236 . . . . 0.0 111.476 -177.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 82.0 mt -65.28 -50.84 64.18 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 178.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.414 ' O ' HG13 ' A' ' 113' ' ' ILE . 83.7 mt -64.37 -64.8 0.79 Allowed 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 175.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.2 t -34.4 -55.44 0.53 Allowed 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 179.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -73.12 -39.29 65.86 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-N 119.359 0.981 . . . . 0.0 112.054 -177.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.425 ' O ' ' HE2' ' A' ' 115' ' ' LYS . . . -57.56 -49.46 76.3 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.847 0.749 . . . . 0.0 110.216 179.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.2 OUTLIER -76.04 -32.57 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -179.119 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.35 -28.76 67.42 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.542 0.61 . . . . 0.0 109.841 179.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.425 ' HE2' ' O ' ' A' ' 112' ' ' ALA . 0.4 OUTLIER -79.21 -23.04 44.06 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.833 0.853 . . . . 0.0 110.374 175.12 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 35.5 m -76.87 154.95 33.28 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 113.75 1.018 . . . . 0.0 113.75 -172.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -92.1 -178.35 4.95 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 170.177 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -55.61 -43.82 76.44 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.094 0.407 . . . . 0.0 111.396 -178.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -66.71 -43.02 85.4 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 121.716 -0.615 . . . . 0.0 110.85 -178.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 55.7 m80 -70.25 -36.08 74.22 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 119.628 -0.225 . . . . 0.0 110.777 -178.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.08 -39.48 92.56 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 174.389 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -67.41 -38.65 84.95 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.689 -177.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -63.04 -44.47 95.8 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 121.209 -0.196 . . . . 0.0 111.169 175.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 97.5 mt -66.94 -35.92 75.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 80.0 ttt-85 -66.4 -32.19 73.42 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 122.079 -0.388 . . . . 0.0 110.181 176.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 58.3 ttp -67.19 -42.47 84.15 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 175.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 64.7 tp -57.34 -47.81 80.63 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.95 0.405 . . . . 0.0 110.221 176.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 84.1 mt -70.79 -27.79 64.16 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.443 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -69.69 -38.66 77.09 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 175.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 86.7 mt -65.14 -42.59 94.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 176.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 44.3 m0 -59.34 -47.41 85.52 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 117.807 0.276 . . . . 0.0 110.846 177.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -66.6 -39.55 88.44 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -177.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 77.4 mtp180 -73.68 -26.0 60.52 Favored 'General case' 0 C--O 1.231 0.09 0 C-N-CA 122.473 0.309 . . . . 0.0 111.45 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 52.9 m -78.83 -14.33 59.31 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 122.287 0.235 . . . . 0.0 111.126 175.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 76.67 15.9 81.2 Favored Glycine 0 CA--C 1.528 0.898 0 N-CA-C 111.317 -0.713 . . . . 0.0 111.317 -177.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 82.6 mt -105.84 166.0 10.79 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.433 0.693 . . . . 0.0 111.083 -175.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 53.46 25.93 5.1 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 178.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 42.2 mm-40 -73.72 4.26 5.34 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.079 0.552 . . . . 0.0 111.891 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -70.1 164.14 24.74 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.908 0.483 . . . . 0.0 111.091 -179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 20.1 m 53.77 22.19 3.07 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.733 0.813 . . . . 0.0 112.958 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 63.9 m-85 51.35 25.65 2.68 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 124.055 0.942 . . . . 0.0 112.915 178.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 93.7 mt 53.3 25.92 4.84 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 123.668 0.787 . . . . 0.0 112.483 -177.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . 0.418 ' HA ' ' HB3' ' A' ' 146' ' ' ARG . 52.5 t30 -50.23 -32.87 17.68 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.105 0.562 . . . . 0.0 111.854 -176.427 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -50.24 -36.61 31.81 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.969 1.708 . . . . 0.0 111.985 -172.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.426 HD12 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -119.61 -6.8 11.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-O 119.512 -0.28 . . . . 0.0 111.374 170.914 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.418 ' HB3' ' HA ' ' A' ' 143' ' ' ASN . 30.9 ttt85 -54.85 -31.52 59.64 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 176.066 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 29.5 m -63.09 101.98 0.33 Allowed 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 106.433 -1.691 . . . . 0.0 106.433 167.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -55.6 -26.95 46.63 Favored 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 115.62 1.711 . . . . 0.0 115.62 -166.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 86.2 m -50.9 -42.63 59.39 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.329 0.968 . . . . 0.0 110.933 -174.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -53.58 -92.7 0.0 OUTLIER 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.808 1.243 . . . . 0.0 113.814 -171.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -80.07 -11.86 59.73 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 178.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 32.2 mtm -105.61 -8.15 18.13 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -171.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -71.46 -14.77 62.24 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 120.369 1.44 . . . . 0.0 110.916 170.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 87.4 mt . . . . . 0 C--O 1.249 1.054 0 CA-C-O 117.743 -1.122 . . . . 0.0 110.481 -179.229 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 110.784 -0.08 . . . . 0.0 110.784 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 65.9 p -140.4 153.38 68.51 Favored Pre-proline 0 CA--C 1.533 0.289 0 C-N-CA 122.762 0.425 . . . . 0.0 110.111 179.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -80.17 -9.34 14.02 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 123.703 2.935 . . . . 0.0 112.495 -178.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 42.6 p -142.39 145.15 33.54 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.088 0.404 . . . . 0.0 111.285 -176.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 159' ' ' SEP . . . . . 0.568 ' H ' ' HA ' ' A' ' 25' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -72.29 177.13 36.34 Favored 'Cis proline' 0 N--CA 1.455 -0.759 0 N-CA-C 110.103 -0.768 . . . . 0.0 110.103 -7.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 38.1 m -68.4 154.9 40.91 Favored 'General case' 0 N--CA 1.457 -0.109 0 CA-C-O 120.679 0.276 . . . . 0.0 110.616 176.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 162' ' ' TYR . . . . . 0.423 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 3.2 t80 -150.58 138.53 20.04 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.911 0.484 . . . . 0.0 110.671 -179.145 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.4 t -133.46 134.67 24.07 Favored Pre-proline 0 N--CA 1.455 -0.195 0 C-N-CA 123.26 0.624 . . . . 0.0 111.4 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -58.42 -12.58 14.07 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.531 2.821 . . . . 0.0 112.593 174.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 2.8 m -78.21 -4.0 45.51 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 -173.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -60.3 160.53 22.92 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 123.11 2.54 . . . . 0.0 110.842 168.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 34.0 t . . . . . 0 C--O 1.251 1.136 0 CA-C-O 117.57 -1.205 . . . . 0.0 110.064 -179.521 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.5 ttm . . . . . 0 N--CA 1.476 0.868 0 N-CA-C 110.601 -0.148 . . . . 0.0 110.601 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -149.5 165.07 33.25 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.665 0.386 . . . . 0.0 110.632 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -139.78 161.9 36.44 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.288 0.635 . . . . 0.0 109.981 -179.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -149.25 159.02 44.63 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.992 0.517 . . . . 0.0 109.705 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 50.95 26.23 2.59 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.173 0.989 . . . . 0.0 113.014 -175.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.472 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 18.3 t70 -79.56 -154.78 0.09 Allowed 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 176.057 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.472 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 7.1 t80 -55.92 -13.65 1.99 Allowed 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.724 -0.61 . . . . 0.0 110.772 177.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -53.06 -37.98 62.09 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 124.367 1.067 . . . . 0.0 111.127 175.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -62.91 -45.02 94.46 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 119.217 0.917 . . . . 0.0 110.164 179.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -64.04 -51.34 64.6 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 117.693 0.224 . . . . 0.0 110.613 -178.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.2 t -64.72 -50.82 73.71 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.129 0 C-N-CA 121.002 -0.279 . . . . 0.0 110.773 -177.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.31 -29.47 69.89 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 119.537 -0.268 . . . . 0.0 111.683 -179.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 57.5 m -73.84 -43.55 58.34 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 118.456 0.571 . . . . 0.0 110.389 176.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.536 ' HG ' ' CD2' ' A' ' 53' ' ' TYR . 21.3 tp -66.32 -28.47 68.71 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.163 0.506 . . . . 0.0 109.741 179.228 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -70.64 -46.71 62.78 Favored 'General case' 0 C--N 1.337 0.035 0 C-N-CA 123.773 0.829 . . . . 0.0 109.35 175.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 64.8 m -63.4 -22.77 67.08 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.059 175.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -76.72 -39.56 51.49 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.484 0.314 . . . . 0.0 110.28 175.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.1 ttpp -69.94 -23.96 63.28 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.264 0.625 . . . . 0.0 111.05 175.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -68.92 -14.45 63.04 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.685 0.394 . . . . 0.0 111.564 176.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.7 mt -79.56 161.49 25.93 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 120.934 0.397 . . . . 0.0 110.724 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 65.6 tttm -129.72 -20.23 3.23 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.094 0.558 . . . . 0.0 110.471 178.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 38.9 t -156.9 147.56 21.55 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 123.376 0.67 . . . . 0.0 109.56 177.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.13 146.63 8.47 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-O 121.77 0.65 . . . . 0.0 112.907 175.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 29.9 mt -104.03 152.24 6.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 124.921 1.289 . . . . 0.0 107.968 174.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.0 t -140.06 125.1 18.56 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 175.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -61.39 -31.22 76.56 Favored Glycine 0 CA--C 1.524 0.615 0 CA-C-O 119.26 -0.744 . . . . 0.0 112.805 -175.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 88.8 p -63.47 -35.5 80.64 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 118.795 1.298 . . . . 0.0 110.879 -174.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.0 mmt-85 -68.39 -45.5 72.51 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 177.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 41.4 mt -62.59 -35.15 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.1 mmtt -71.22 -37.85 72.02 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 118.998 -0.525 . . . . 0.0 111.25 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.58 -42.73 91.4 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.065 0.848 . . . . 0.0 110.183 175.062 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.8 mt -64.15 -59.68 4.14 Favored 'General case' 0 N--CA 1.456 -0.156 0 O-C-N 122.611 -0.056 . . . . 0.0 111.149 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 56.3 p -56.26 -46.38 79.67 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 178.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 t -63.47 -44.69 93.69 Favored 'General case' 0 CA--C 1.521 -0.142 0 C-N-CA 119.814 -0.754 . . . . 0.0 111.295 -177.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -67.34 -35.95 80.43 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 118.928 -1.109 . . . . 0.0 111.12 -178.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.433 ' HB3' ' HH ' ' A' ' 76' ' ' TYR . . . -58.92 -57.56 12.51 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.743 0.306 . . . . 0.0 110.434 174.092 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 63.9 mt -70.51 -16.59 62.91 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.927 0.891 . . . . 0.0 113.045 -174.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -61.92 -29.56 70.3 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -178.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.5 p80 -152.62 -17.01 0.16 Allowed 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 115.243 1.572 . . . . 0.0 115.243 -177.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 27.5 mm 44.82 77.07 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 121.662 0.744 . . . . 0.0 112.084 178.05 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -147.32 21.13 1.21 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.406 0.682 . . . . 0.0 110.367 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.539 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -147.41 37.62 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 C-N-CA 124.407 1.083 . . . . 0.0 109.362 -171.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.431 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -51.11 -57.6 8.29 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -175.47 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 85.2 p -74.38 -25.85 59.75 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -173.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.62 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.04 -45.07 15.79 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 18.9 mt -55.58 -50.87 63.73 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 172.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 14.9 mm -67.99 -48.04 76.44 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -176.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.2 t -55.47 -42.81 74.86 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 119.96 -0.696 . . . . 0.0 109.96 179.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 73.9 mt -61.27 -62.02 2.14 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.021 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.5 pt -58.77 -35.49 56.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 119.621 1.1 . . . . 0.0 112.144 -174.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 76.2 mt -60.83 -59.18 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 178.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -63.98 -31.88 73.22 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.769 -178.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.536 ' CD2' ' HG ' ' A' ' 14' ' ' LEU . 3.7 m-85 -66.16 -34.23 77.56 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 122.092 -0.38 . . . . 0.0 110.162 178.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 29.5 t -68.89 -46.76 67.54 Favored 'General case' 0 C--O 1.231 0.087 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 173.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.6 tpp180 -56.14 -37.76 69.91 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 124.959 1.303 . . . . 0.0 112.519 -177.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 69.6 mt -78.35 -14.28 59.48 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 115.068 1.507 . . . . 0.0 115.068 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.447 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 82.4 m -115.18 160.08 35.42 Favored Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -169.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 93.9 Cg_endo -70.89 179.79 4.03 Favored 'Trans proline' 0 C--N 1.348 0.531 1 C-N-CA 125.344 4.029 . . . . 0.0 113.028 -179.234 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.558 ' HB3' ' HE3' ' A' ' 115' ' ' LYS . 5.0 p-10 -55.53 -34.51 64.74 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 114.53 1.308 . . . . 0.0 114.53 -171.152 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.2 t -63.77 -35.3 80.13 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.902 0.774 . . . . 0.0 109.452 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 62.8 t-80 -83.99 -31.1 25.68 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.078 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -58.71 -44.97 90.52 Favored 'General case' 0 C--N 1.341 0.219 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 53.5 tp -66.92 -52.05 47.83 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 122.757 0.423 . . . . 0.0 111.187 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.83 -39.63 97.75 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 -179.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.0 t -70.51 -33.52 71.29 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 117.322 0.561 . . . . 0.0 110.061 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.4 mt -64.82 -33.65 76.5 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.511 173.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -66.42 -39.15 88.78 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 119.331 0.969 . . . . 0.0 109.697 174.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 83.9 mt -64.12 -50.29 77.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 O-C-N 122.146 -0.346 . . . . 0.0 111.116 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 60.1 mt -62.1 -34.95 66.07 Favored 'Isoleucine or valine' 0 C--O 1.231 0.115 0 C-N-CA 123.712 0.805 . . . . 0.0 109.681 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -67.76 -42.76 81.27 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.985 -0.531 . . . . 0.0 110.442 177.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.422 ' HA ' ' NH1' ' A' ' 74' ' ' ARG . 8.0 t -66.93 -50.65 61.7 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 119.25 -0.98 . . . . 0.0 111.338 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 47.0 mt -64.89 -35.74 76.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.201 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.0 -54.31 25.31 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.966 -0.454 . . . . 0.0 111.966 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.422 ' NH1' ' HA ' ' A' ' 71' ' ' SER . 4.0 mtp-105 -61.74 -37.53 84.57 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-N 117.294 0.547 . . . . 0.0 110.817 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.02 -44.44 72.73 Favored 'General case' 0 N--CA 1.451 -0.375 0 O-C-N 122.46 -0.15 . . . . 0.0 111.004 179.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.433 ' HH ' ' HB3' ' A' ' 36' ' ' ALA . 7.2 m-30 -61.8 -45.57 93.27 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 176.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.6 tt -58.83 -52.95 63.53 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -177.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -58.21 -44.97 88.4 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 121.154 -0.218 . . . . 0.0 110.556 179.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -63.61 -43.02 98.08 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -174.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.48 HG23 HH11 ' A' ' 81' ' ' ARG . 14.6 t -82.16 -26.36 33.52 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -176.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.48 HH11 HG23 ' A' ' 80' ' ' THR . 9.5 mpt_? -73.32 -32.94 64.89 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 118.694 0.679 . . . . 0.0 110.206 175.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 75.3 m -71.72 -13.96 61.88 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-N 117.587 0.176 . . . . 0.0 111.219 174.039 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -105.48 24.48 12.1 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.84 0.856 . . . . 0.0 110.876 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 33.1 t -140.93 160.83 39.23 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.104 0.562 . . . . 0.0 110.716 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -138.05 7.43 2.68 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.602 0.761 . . . . 0.0 110.491 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 86.8 p -127.23 10.26 6.82 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.5 0.72 . . . . 0.0 111.073 -179.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 54.1 p 54.92 11.65 0.51 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.667 1.587 . . . . 0.0 113.817 -176.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.1 t -84.13 160.22 20.93 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.099 0.56 . . . . 0.0 110.841 -179.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 22.4 t30 -98.7 145.4 26.93 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.2 0.6 . . . . 0.0 109.756 -178.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -82.95 150.89 62.77 Favored Pre-proline 0 CA--C 1.532 0.283 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 -177.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -77.53 3.97 6.37 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 124.337 3.358 . . . . 0.0 113.651 -176.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -154.25 -176.18 26.29 Favored Glycine 0 C--N 1.337 0.629 0 CA-C-N 118.568 0.622 . . . . 0.0 112.123 -177.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 52.84 -152.74 0.26 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.198 0.999 . . . . 0.0 112.861 177.017 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.0 p -51.13 -27.26 8.07 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -177.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.3 -39.07 82.17 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.253 -0.904 . . . . 0.0 110.126 176.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 -68.55 -34.48 75.91 Favored 'General case' 0 CA--C 1.519 -0.227 0 C-N-CA 122.981 0.512 . . . . 0.0 109.801 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.74 -43.75 95.57 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.349 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.5 -42.89 94.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 175.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -59.98 -33.98 72.68 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 121.393 -0.123 . . . . 0.0 111.022 179.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.7 m -76.0 -41.47 51.03 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-O 119.535 -0.269 . . . . 0.0 111.346 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 62.6 mt -61.7 -29.74 70.29 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 119.782 -0.767 . . . . 0.0 108.985 173.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.88 -14.87 39.67 Favored Glycine 0 CA--C 1.529 0.948 0 CA-C-O 119.171 -0.794 . . . . 0.0 113.672 179.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.67 -6.16 25.54 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.591 1.196 . . . . 0.0 111.562 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 32.2 m -124.02 -18.12 4.05 Favored 'Isoleucine or valine' 0 C--N 1.338 0.094 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.1 tp -53.15 -31.1 17.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 CA-C-N 118.751 0.705 . . . . 0.0 111.28 -177.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -60.83 -55.08 37.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.884 0.474 . . . . 0.0 110.829 178.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -75.94 -31.56 59.15 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.684 0.394 . . . . 0.0 111.773 -177.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 58.6 mt -64.81 -50.53 66.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 97.4 mt -70.29 -50.41 39.67 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.643 -178.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.525 ' HB2' ' CZ ' ' A' ' 150' ' ' PHE . 88.9 p -52.21 -50.19 62.44 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 118.545 0.611 . . . . 0.0 111.852 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -68.29 -46.38 70.48 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 118.662 0.664 . . . . 0.0 111.167 -178.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -54.11 -54.12 43.9 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.844 0.458 . . . . 0.0 110.499 -179.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 10.8 mt -65.47 -46.0 91.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 CA-C-N 118.005 0.366 . . . . 0.0 110.801 -178.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.01 -21.47 66.4 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 119.74 -0.171 . . . . 0.0 111.292 -176.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.558 ' HE3' ' HB3' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -94.88 -13.68 25.25 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 117.69 0.223 . . . . 0.0 111.432 179.831 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.434 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 50.1 p -90.11 165.9 13.72 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -172.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -83.55 174.08 10.88 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.137 0.975 . . . . 0.0 109.894 179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.7 tt0 -55.55 -44.39 76.73 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.906 0.482 . . . . 0.0 111.851 -178.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -68.44 -37.46 80.26 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 121.964 -0.46 . . . . 0.0 110.606 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.434 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 56.4 m80 -71.51 -52.54 17.78 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 119.001 -0.523 . . . . 0.0 110.969 -177.773 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -36.99 65.74 Favored 'General case' 0 C--N 1.342 0.258 0 CA-C-N 119.238 0.927 . . . . 0.0 110.922 173.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.69 -43.57 98.47 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.566 178.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -64.7 -36.16 83.39 Favored 'General case' 0 C--O 1.227 -0.109 0 CA-C-O 119.549 -0.262 . . . . 0.0 111.685 177.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.4 mt -68.58 -40.5 81.96 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 178.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 15.4 ttp180 -60.55 -47.04 87.95 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.701 0.401 . . . . 0.0 110.766 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.72 -30.69 64.39 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.278 -178.139 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.6 tt -60.98 -47.67 85.36 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.621 0.646 . . . . 0.0 109.481 175.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 87.9 mt -70.09 -32.08 69.97 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.772 -0.194 . . . . 0.0 111.062 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -66.07 -38.58 88.65 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 110.391 -0.225 . . . . 0.0 110.391 177.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 87.3 mt -69.72 -41.9 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 177.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 15.5 t90 -64.12 -30.33 71.4 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 122.586 -0.071 . . . . 0.0 111.067 179.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -83.08 -37.76 23.4 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 122.032 -0.418 . . . . 0.0 111.536 176.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 29.9 tpt180 -73.35 -24.07 60.3 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 122.815 0.446 . . . . 0.0 111.956 -176.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 99.8 p -65.11 -14.48 60.63 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 71.26 18.09 76.44 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 111.591 -0.603 . . . . 0.0 111.591 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 31.1 tp -71.71 -17.46 62.22 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 117.533 0.667 . . . . 0.0 111.786 -177.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -80.64 164.16 23.07 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.615 0.366 . . . . 0.0 110.442 176.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -133.38 -12.9 2.71 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 15.3 ptmm? -160.56 163.89 32.41 Favored 'General case' 0 N--CA 1.457 -0.086 0 C-N-CA 123.001 0.52 . . . . 0.0 110.683 178.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 18.8 m 55.03 -173.88 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.228 1.011 . . . . 0.0 113.243 177.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -138.58 161.21 37.65 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.614 0.765 . . . . 0.0 110.111 179.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 53.2 tp -87.26 91.76 8.83 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.692 0.397 . . . . 0.0 109.938 -177.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -71.18 -15.44 62.48 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -179.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -49.81 -42.58 47.36 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.329 1.052 . . . . 0.0 112.159 -172.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.422 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -110.36 -25.21 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.07 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 176.33 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -66.04 -20.41 66.17 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 122.944 0.497 . . . . 0.0 110.78 -176.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 80.6 p -61.39 -40.67 95.19 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 118.47 -0.776 . . . . 0.0 113.06 -178.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -160.32 -161.89 0.92 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 115.568 1.692 . . . . 0.0 115.568 -178.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . 0.419 ' O ' ' C ' ' A' ' 150' ' ' PHE . 31.7 t -48.35 -24.82 1.34 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.298 1.839 . . . . 0.0 113.792 -171.32 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . 0.525 ' CZ ' ' HB2' ' A' ' 110' ' ' SER . 20.9 m-85 -24.22 -85.26 0.0 OUTLIER 'General case' 0 C--N 1.344 0.35 0 C-N-CA 125.058 1.343 . . . . 0.0 110.188 177.363 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -101.88 -6.04 24.02 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 118.372 -0.823 . . . . 0.0 111.655 167.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 35.4 mmt -70.69 -4.02 21.46 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-N 120.335 1.425 . . . . 0.0 111.643 175.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -54.64 -20.5 8.25 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.034 0.933 . . . . 0.0 112.342 174.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 42.9 tp . . . . . 0 C--O 1.248 1.01 0 CA-C-O 117.401 -1.285 . . . . 0.0 110.811 -179.473 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 110.578 -0.156 . . . . 0.0 110.578 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 37.7 p -146.18 153.37 48.71 Favored Pre-proline 0 CA--C 1.53 0.188 0 C-N-CA 122.917 0.487 . . . . 0.0 110.243 178.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -75.9 -10.93 19.9 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.593 2.862 . . . . 0.0 112.123 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 3.7 m 54.19 26.46 6.72 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.5 0.72 . . . . 0.0 111.708 -176.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 160' ' ' PRO . . . . . 0.555 ' HG2' ' H ' ' B' ' 161' ' ' SER . 61.1 Cg_endo -68.37 -66.57 0.03 OUTLIER 'Cis proline' 0 N--CA 1.457 -0.62 0 CA-C-N 119.493 0.855 . . . . 0.0 111.23 -5.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 161' ' ' SER . . . . . 0.555 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 68.2 p -169.0 156.18 7.14 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 124.115 0.966 . . . . 0.0 109.377 176.037 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -158.33 139.43 13.19 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.63 0.252 . . . . 0.0 111.618 173.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 27.0 t -140.44 142.66 30.09 Favored Pre-proline 0 N--CA 1.454 -0.26 0 C-N-CA 123.749 0.82 . . . . 0.0 110.78 178.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.85 -7.71 2.55 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 123.776 2.984 . . . . 0.0 112.975 173.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 38.0 m -64.46 -34.03 77.25 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 122.967 0.507 . . . . 0.0 110.977 -179.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -73.45 176.42 9.3 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.818 3.012 . . . . 0.0 111.286 175.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 55.3 m . . . . . 0 C--O 1.251 1.148 0 CA-C-O 117.616 -1.183 . . . . 0.0 111.087 177.546 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.4 mmm . . . . . 0 N--CA 1.476 0.841 0 CA-C-O 119.746 -0.169 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -146.42 150.59 35.93 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.875 0.47 . . . . 0.0 109.936 -179.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -134.9 0.78 2.95 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.861 0.464 . . . . 0.0 111.497 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -71.75 -3.69 23.43 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.143 0.577 . . . . 0.0 111.521 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -125.64 10.84 7.85 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.093 0.957 . . . . 0.0 111.347 178.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -88.57 -134.62 0.09 Allowed 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 177.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -55.64 -16.55 4.25 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 118.438 0.563 . . . . 0.0 111.077 175.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.7 tp60 -55.32 -40.1 70.77 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 123.106 0.563 . . . . 0.0 110.81 176.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -60.96 -40.59 93.93 Favored 'General case' 0 N--CA 1.458 -0.072 0 CA-C-N 118.516 0.598 . . . . 0.0 110.781 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -64.57 -55.73 18.56 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 57.6 t -59.09 -53.97 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.123 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -178.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.03 -33.07 70.33 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.165 0.586 . . . . 0.0 111.95 -177.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 56.3 m -70.26 -44.95 67.41 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 118.784 0.72 . . . . 0.0 110.047 177.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.6 tp -65.72 -34.51 78.35 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.385 0.612 . . . . 0.0 109.983 -179.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -67.57 -42.89 81.83 Favored 'General case' 0 CA--C 1.52 -0.2 0 C-N-CA 123.866 0.866 . . . . 0.0 109.763 178.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.0 m -63.94 -30.19 71.3 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 175.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.29 -36.27 76.88 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 176.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.9 tttm -74.4 -33.08 62.93 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 177.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -82.86 -30.0 28.96 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -175.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 98.7 mt -141.97 147.22 36.61 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 123.197 0.599 . . . . 0.0 110.328 -178.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.01 155.02 36.12 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.866 0.466 . . . . 0.0 111.44 179.357 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 77.6 p -150.61 -15.04 0.23 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.434 0.694 . . . . 0.0 110.557 176.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 177.21 -147.27 8.2 Favored Glycine 0 C--N 1.337 0.593 0 N-CA-C 108.058 -2.017 . . . . 0.0 108.058 178.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.1 mm -115.34 44.7 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 178.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.533 ' HA ' ' H ' ' B' ' 159' ' ' SEP . 68.3 m -50.53 127.94 18.98 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.836 0.454 . . . . 0.0 111.735 -175.732 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.22 -14.59 64.21 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-O 119.043 -0.865 . . . . 0.0 113.548 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 66.3 p -64.42 -42.25 96.14 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 119.272 1.536 . . . . 0.0 111.082 -177.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -64.3 -40.63 96.33 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 177.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 55.5 mt -64.03 -37.37 79.65 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -60.39 -47.44 86.07 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 122.722 0.409 . . . . 0.0 110.231 178.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.01 -46.53 88.79 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 118.025 0.375 . . . . 0.0 111.02 177.271 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 99.4 mt -61.6 -59.4 5.26 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 122.196 -0.315 . . . . 0.0 110.806 -177.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 67.3 p -56.36 -46.41 80.03 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.3 t -64.14 -44.28 92.65 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.182 -176.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -75.25 -18.56 60.07 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 120.205 -0.598 . . . . 0.0 112.349 -179.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.37 -59.25 3.56 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.699 0.681 . . . . 0.0 109.288 167.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.5 mp -70.92 -13.42 62.01 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -176.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -55.41 -26.64 42.92 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -153.08 -24.04 0.15 Allowed 'General case' 0 C--N 1.339 0.143 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -178.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 35.8 mm 45.44 72.45 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-O 121.837 0.827 . . . . 0.0 111.446 -177.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -146.6 21.69 1.31 Allowed 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.48 1.112 . . . . 0.0 109.229 179.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.572 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.57 33.24 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.231 0 C-N-CA 124.574 1.15 . . . . 0.0 109.209 -170.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.482 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.2 OUTLIER -49.12 -55.67 11.54 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -177.062 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 80.4 p -74.66 -27.15 60.3 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -173.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.615 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.48 -43.17 17.54 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 -179.306 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 39.2 mt -55.75 -51.77 55.7 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 14.9 mm -67.43 -49.3 72.68 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -176.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 72.2 m -57.53 -35.33 70.16 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 119.277 -0.969 . . . . 0.0 110.404 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.5 tp -70.0 -43.87 70.52 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 118.909 -0.567 . . . . 0.0 112.261 -178.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 36.8 pt -73.37 -33.21 39.89 Favored 'Isoleucine or valine' 0 C--N 1.34 0.187 0 CA-C-N 119.304 0.956 . . . . 0.0 111.809 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 97.3 mt -65.66 -52.59 48.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -63.06 -29.09 70.54 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.356 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 33.3 t80 -62.75 -47.71 82.34 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 174.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.9 t -62.23 -33.07 73.89 Favored 'General case' 0 C--N 1.338 0.087 0 CA-C-O 120.581 0.229 . . . . 0.0 110.567 176.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -69.23 -40.91 77.64 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.866 0.866 . . . . 0.0 112.597 -177.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.2 mt -91.92 -14.81 28.98 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -174.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 78.7 m -100.72 159.45 29.56 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -170.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -57.94 -178.66 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.367 1 C-N-CA 126.153 4.569 . . . . 0.0 115.406 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -62.84 -46.3 88.55 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.459 1.104 . . . . 0.0 112.766 -177.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 50.6 m -62.54 -30.53 71.37 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 20.6 m80 -79.17 -20.58 48.1 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 119.026 -0.512 . . . . 0.0 110.756 176.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.7 tppt? -67.63 -45.86 74.13 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 173.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.4 tp -63.91 -44.48 92.83 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.404 176.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.63 -40.96 95.38 Favored Glycine 0 C--N 1.339 0.712 0 N-CA-C 110.353 -1.099 . . . . 0.0 110.353 177.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 71.0 m -60.74 -44.15 97.05 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.93 -0.557 . . . . 0.0 109.792 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 20.8 mt -57.87 -42.29 84.22 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.586 0.63 . . . . 0.0 111.477 178.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -68.6 -34.99 76.73 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.026 0.83 . . . . 0.0 111.328 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 71.3 mt -69.98 -50.96 44.1 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 O-C-N 122.026 -0.421 . . . . 0.0 110.385 178.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 74.9 mt -60.11 -35.16 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.105 0 C-N-CA 124.211 1.004 . . . . 0.0 109.546 178.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -68.2 -45.99 71.85 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.848 -0.596 . . . . 0.0 110.871 178.18 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.5 t -64.57 -53.39 48.52 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 118.569 0.622 . . . . 0.0 110.955 -178.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 47.3 mt -63.68 -34.32 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.32 -52.79 37.18 Favored Glycine 0 CA--C 1.524 0.64 0 CA-C-O 119.927 -0.374 . . . . 0.0 112.43 -178.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.632 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -70.27 -33.79 72.01 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 117.961 0.88 . . . . 0.0 111.001 -178.857 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.42 -48.17 70.89 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 177.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 -60.02 -45.68 91.99 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 176.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -57.05 -46.19 82.64 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 119.363 -0.351 . . . . 0.0 110.601 -176.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -68.84 -41.7 78.15 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 119.732 -0.787 . . . . 0.0 111.005 178.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -65.77 -23.71 66.78 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -176.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.9 t -99.94 -21.71 15.56 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 118.583 0.629 . . . . 0.0 111.231 175.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -71.8 -29.07 64.05 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 117.908 0.322 . . . . 0.0 110.64 175.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 89.7 p -70.19 -14.36 62.59 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 177.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 47.2 t-20 -82.73 154.95 24.55 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.739 0.415 . . . . 0.0 110.25 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 51.0 m -134.36 15.51 3.76 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.545 0.738 . . . . 0.0 111.099 -178.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -130.73 164.98 23.88 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.06 0.544 . . . . 0.0 110.455 -178.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 54.2 m -139.11 164.49 29.64 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 123.391 0.676 . . . . 0.0 110.339 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.7 m -139.45 160.93 38.69 Favored 'General case' 0 C--O 1.232 0.144 0 C-N-CA 123.217 0.607 . . . . 0.0 110.695 -178.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 80.6 p -138.53 9.25 2.66 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.238 0.615 . . . . 0.0 111.645 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -134.22 28.92 3.72 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.508 0.723 . . . . 0.0 110.174 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -138.81 141.41 30.45 Favored Pre-proline 0 CA--C 1.531 0.226 0 C-N-CA 123.687 0.795 . . . . 0.0 109.616 -178.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -57.48 162.76 9.62 Favored 'Trans proline' 0 N--CA 1.452 -0.921 0 C-N-CA 123.662 2.908 . . . . 0.0 112.23 173.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -69.53 169.95 43.48 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 111.362 -0.695 . . . . 0.0 111.362 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.99 -152.27 0.42 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.455 1.102 . . . . 0.0 109.334 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.3 p -49.91 -30.09 9.5 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.194 0.906 . . . . 0.0 113.28 -177.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.56 -45.62 82.61 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.397 -0.814 . . . . 0.0 110.193 175.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -65.45 -31.61 72.78 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 123.579 0.752 . . . . 0.0 110.179 177.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.25 -45.29 81.07 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.617 0.767 . . . . 0.0 110.572 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.4 mt -64.31 -41.74 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 174.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -61.55 -33.48 73.92 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 120.476 0.179 . . . . 0.0 110.873 179.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.3 m -74.14 -41.75 61.07 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 122.085 -0.384 . . . . 0.0 110.928 179.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 61.2 mt -61.42 -30.89 70.85 Favored 'General case' 0 C--O 1.228 -0.074 0 CA-C-N 118.859 0.754 . . . . 0.0 109.014 173.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.93 -14.39 23.52 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-O 119.018 -0.879 . . . . 0.0 113.424 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -100.43 -3.94 29.94 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 118.961 1.38 . . . . 0.0 111.785 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 33.1 m -127.14 -19.98 2.24 Favored 'Isoleucine or valine' 0 C--N 1.339 0.15 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.1 tp -54.78 -28.39 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 C-N-CA 123.157 0.583 . . . . 0.0 111.891 -175.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -58.85 -58.23 9.56 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 120.739 0.304 . . . . 0.0 111.095 -179.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -78.05 -26.03 48.08 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 122.401 0.281 . . . . 0.0 111.219 -178.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.0 tt -66.45 -50.3 63.83 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 75.7 mt -69.7 -52.63 23.87 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.995 -0.526 . . . . 0.0 109.901 176.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.4 t -40.28 -49.39 2.73 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.073 0.397 . . . . 0.0 112.056 175.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -72.06 -48.48 43.97 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-N 118.222 0.465 . . . . 0.0 111.596 -178.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.04 -29.98 61.24 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 123.314 0.646 . . . . 0.0 112.277 179.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.404 HD13 ' CG2' ' A' ' 145' ' ' ILE . 2.5 mt -85.59 -41.18 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 118.855 0.752 . . . . 0.0 111.272 173.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.13 -25.93 67.21 Favored 'General case' 0 N--CA 1.454 -0.235 0 O-C-N 121.903 -0.498 . . . . 0.0 111.075 -177.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.21 -19.4 43.34 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.119 0.968 . . . . 0.0 110.93 177.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.475 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 24.4 p -83.44 163.13 20.72 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -172.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -94.62 175.45 6.66 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.676 1.191 . . . . 0.0 108.444 173.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -55.86 -38.96 70.8 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.831 0.741 . . . . 0.0 112.603 -176.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -73.29 -37.47 66.21 Favored 'General case' 0 C--O 1.232 0.132 0 O-C-N 121.526 -0.734 . . . . 0.0 110.514 -179.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.475 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 43.3 m170 -72.24 -44.12 63.34 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.856 -0.592 . . . . 0.0 110.857 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.4 ' C ' ' HD2' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -58.25 -38.66 77.33 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 119.573 1.079 . . . . 0.0 109.535 175.199 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -61.21 -44.11 97.81 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.129 177.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -64.17 -35.78 81.91 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 177.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 94.2 mt -74.59 -37.7 44.17 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.067 0 CA-C-N 118.359 0.527 . . . . 0.0 110.108 -178.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -63.68 -39.73 95.05 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 176.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 58.4 ttp -66.34 -42.43 88.14 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.369 0.268 . . . . 0.0 110.289 175.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.2 tt -59.93 -44.7 94.19 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 -178.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -69.36 -37.31 77.54 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 119.151 -0.452 . . . . 0.0 111.319 178.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -60.25 -41.6 93.54 Favored 'General case' 0 N--CA 1.457 -0.102 0 CA-C-N 118.431 0.559 . . . . 0.0 110.119 177.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.7 mt -71.4 -42.54 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 122.43 0.292 . . . . 0.0 110.585 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 10.8 t90 -67.29 -25.71 66.18 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 122.174 -0.329 . . . . 0.0 111.15 -177.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -86.0 -36.75 19.58 Favored 'General case' 0 N--CA 1.455 -0.178 0 O-C-N 121.841 -0.537 . . . . 0.0 110.959 175.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 56.8 ttm-85 -67.27 -43.12 82.61 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.967 0.507 . . . . 0.0 111.284 -179.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 61.0 m -78.97 -16.38 57.01 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 122.609 0.364 . . . . 0.0 111.563 179.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -82.98 -18.57 64.87 Favored Glycine 0 CA--C 1.528 0.847 0 CA-C-O 119.45 -0.639 . . . . 0.0 111.816 179.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 37.9 tp 60.46 140.08 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.717 1.607 . . . . 0.0 112.755 -175.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 53.4 -174.95 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.984 0.913 . . . . 0.0 112.14 -175.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -77.22 157.68 30.73 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.074 -0.391 . . . . 0.0 109.992 177.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -115.31 10.29 15.87 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.832 0.453 . . . . 0.0 111.935 -178.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 8.4 t 58.92 12.84 2.5 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 16.5 p90 -138.35 10.15 2.74 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.218 0.463 . . . . 0.0 111.712 174.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 38.7 tp -64.45 -16.62 62.75 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.716 0.407 . . . . 0.0 111.65 -177.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -55.94 -23.85 34.54 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.952 -0.468 . . . . 0.0 111.38 177.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -53.9 -29.29 41.29 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.215 1.406 . . . . 0.0 112.485 -173.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.404 ' CG2' HD13 ' A' ' 113' ' ' ILE . 0.1 OUTLIER -128.08 -14.45 2.98 Favored 'Isoleucine or valine' 0 C--N 1.339 0.111 0 N-CA-C 112.303 0.482 . . . . 0.0 112.303 169.408 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 31.3 tpt180 -67.96 -21.91 65.06 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 118.004 0.365 . . . . 0.0 110.623 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' SER . . . . . 0.494 ' HB3' ' CE2' ' A' ' 150' ' ' PHE . 21.9 t -61.93 158.5 16.06 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 172.172 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -55.18 -76.22 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -169.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 8.4 p -46.69 -62.77 1.23 Allowed 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 -169.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . 0.494 ' CE2' ' HB3' ' A' ' 147' ' ' SER . 12.9 m-30 -22.67 -94.56 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 126.671 1.988 . . . . 0.0 113.557 -173.242 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -101.87 -5.1 25.18 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 172.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 19.6 mmt -99.72 -2.04 36.29 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 119.653 1.115 . . . . 0.0 112.928 -174.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -56.09 -28.18 56.65 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 119.311 0.96 . . . . 0.0 111.085 174.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 65.6 tp . . . . . 0 C--O 1.254 1.306 0 CA-C-O 117.205 -1.378 . . . . 0.0 108.637 177.411 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 . . . . . 0 N--CA 1.473 0.705 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 38.0 t -150.38 142.72 15.84 Favored Pre-proline 0 CA--C 1.529 0.157 0 C-N-CA 122.864 0.466 . . . . 0.0 109.874 -178.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -72.72 156.25 53.39 Favored 'Trans proline' 0 N--CA 1.452 -0.962 0 C-N-CA 123.716 2.944 . . . . 0.0 111.058 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 46.3 p -145.28 149.6 35.15 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 123.438 0.695 . . . . 0.0 110.197 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 159' ' ' SEP . . . . . 0.533 ' H ' ' HA ' ' A' ' 25' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -74.22 177.75 36.77 Favored 'Cis proline' 0 N--CA 1.454 -0.852 0 N-CA-C 110.359 -0.67 . . . . 0.0 110.359 -6.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 73.5 p -71.31 160.38 32.91 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 122.447 0.299 . . . . 0.0 111.229 178.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 162' ' ' TYR . . . . . 0.43 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 16.0 t80 -146.06 138.78 25.6 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.451 0.3 . . . . 0.0 111.477 -179.112 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.9 t -130.72 139.44 35.62 Favored Pre-proline 0 CA--C 1.53 0.197 0 C-N-CA 123.411 0.684 . . . . 0.0 110.619 176.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -58.77 -11.25 11.35 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.293 2.662 . . . . 0.0 112.318 173.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.48 14.9 6.04 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.706 0.802 . . . . 0.0 111.872 -175.206 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -59.54 163.66 12.56 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.693 2.262 . . . . 0.0 110.882 170.005 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 41.8 m . . . . . 0 C--O 1.252 1.229 0 CA-C-O 117.006 -1.473 . . . . 0.0 111.818 -178.883 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.2 mtm . . . . . 0 N--CA 1.478 0.952 0 N-CA-C 110.454 -0.202 . . . . 0.0 110.454 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 52.7 mm-40 -138.51 171.73 13.94 Favored 'General case' 0 N--CA 1.458 -0.073 0 C-N-CA 123.564 0.746 . . . . 0.0 110.269 -179.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -132.3 147.65 52.41 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.394 0.677 . . . . 0.0 109.488 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -135.06 8.01 3.45 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.616 0.367 . . . . 0.0 111.378 -177.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -118.35 22.16 12.28 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 122.942 0.497 . . . . 0.0 111.387 -179.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.453 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 22.5 t70 -85.9 -138.53 0.08 Allowed 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 178.004 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.453 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 18.1 t80 -55.11 -14.65 1.7 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.227 1.011 . . . . 0.0 111.254 176.776 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.6 tp60 -54.59 -40.53 68.93 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.315 0.646 . . . . 0.0 111.15 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -58.1 -46.62 85.22 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 118.924 0.784 . . . . 0.0 110.811 177.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -63.96 -50.48 68.44 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 117.964 0.347 . . . . 0.0 110.803 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 62.1 t -62.69 -54.46 33.63 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 -178.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.12 -29.79 67.64 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.288 0.635 . . . . 0.0 111.819 -177.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 72.6 m -75.12 -41.36 58.68 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.255 0.479 . . . . 0.0 110.534 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.4 tp -65.85 -33.52 76.03 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -67.42 -42.91 82.43 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.915 0.886 . . . . 0.0 109.819 175.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.7 t -60.69 -31.16 70.42 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 174.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.422 ' CE2' HD12 ' A' ' 68' ' ' ILE . 0.1 OUTLIER -70.88 -38.04 73.05 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 176.479 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -73.26 -24.3 60.44 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.501 0.32 . . . . 0.0 111.565 177.147 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -68.22 -23.58 64.83 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 122.971 0.508 . . . . 0.0 112.254 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.6 pp -97.18 166.35 11.61 Favored 'General case' 0 C--N 1.339 0.131 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 177.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.7 mtmm -128.08 -1.51 5.82 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -176.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.4 p -154.36 151.71 29.37 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 118.135 0.425 . . . . 0.0 110.641 178.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.32 139.34 1.13 Allowed Glycine 0 CA--C 1.524 0.648 0 C-N-CA 123.644 0.64 . . . . 0.0 112.272 178.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 20.8 mm -94.2 139.62 18.11 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 173.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.453 ' HG ' ' P ' ' B' ' 159' ' ' SEP . 17.1 t -124.66 127.56 47.5 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 117.902 0.319 . . . . 0.0 110.203 -176.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.73 -32.44 78.09 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-O 119.497 -0.613 . . . . 0.0 112.468 -175.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 80.0 p -62.23 -39.28 92.29 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.404 1.102 . . . . 0.0 110.703 -175.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.4 mpt_? -68.71 -44.66 73.44 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.147 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 77.0 mt -59.91 -41.7 86.82 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.098 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -67.59 -36.97 81.89 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 118.9 -0.571 . . . . 0.0 111.569 -179.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.62 -41.41 88.39 Favored 'General case' 0 C--N 1.338 0.097 0 CA-C-N 119.534 1.061 . . . . 0.0 110.495 175.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.3 mt -62.14 -52.07 65.31 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 122.395 -0.191 . . . . 0.0 110.568 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 44.0 p -60.87 -42.01 97.08 Favored 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 122.087 -0.383 . . . . 0.0 110.753 179.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.9 m -55.41 -57.52 11.51 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 122.965 0.506 . . . . 0.0 111.101 179.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 63.9 m-85 -76.16 -18.65 59.01 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -173.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.43 -57.76 4.86 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 118.859 0.754 . . . . 0.0 109.141 168.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.5 mt -70.44 -15.2 62.8 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.851 0.86 . . . . 0.0 112.949 -175.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -55.6 -31.41 62.22 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -178.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.2 t-80 -152.74 -20.81 0.16 Allowed 'General case' 0 C--N 1.34 0.171 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 35.9 mm 46.8 73.78 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-O 121.82 0.819 . . . . 0.0 111.514 -178.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -143.97 22.65 1.74 Allowed 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.053 1.341 . . . . 0.0 108.656 178.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.561 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.8 pt -147.17 33.42 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 C-N-CA 124.679 1.192 . . . . 0.0 109.778 -170.117 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.432 ' N ' ' CD ' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -50.45 -54.41 22.27 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 -176.313 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 32.6 t -74.23 -32.6 63.06 Favored 'General case' 0 C--O 1.225 -0.193 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -174.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.661 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -76.77 -45.6 28.34 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -178.617 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 9.6 mm -56.44 -51.73 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 173.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.416 ' CG1' ' HB2' ' A' ' 97' ' ' ALA . 15.4 mm -66.84 -50.83 61.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -176.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.8 m -59.06 -33.54 70.91 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 119.635 -0.826 . . . . 0.0 110.762 179.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.1 tp -70.02 -43.29 71.63 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 33.1 pt -73.58 -35.13 43.91 Favored 'Isoleucine or valine' 0 C--N 1.341 0.226 0 CA-C-N 119.427 1.012 . . . . 0.0 111.481 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 97.6 mt -64.2 -52.53 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -63.44 -31.65 72.87 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.068 179.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -60.18 -46.13 90.77 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 175.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -64.64 -37.07 86.33 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-O 120.796 0.331 . . . . 0.0 110.578 177.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 52.3 tpt85 -67.15 -34.75 78.24 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 124.207 1.003 . . . . 0.0 112.834 -176.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 71.7 mt -92.25 -14.67 28.56 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -176.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 66.6 m -110.65 150.84 42.31 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -170.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -74.76 -170.67 0.8 Allowed 'Trans proline' 0 CA--C 1.536 0.617 1 C-N-CA 125.65 4.234 . . . . 0.0 114.303 -177.273 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -34.72 -64.38 0.26 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 128.122 2.569 . . . . 0.0 115.027 -175.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 37.5 m -58.09 -28.18 64.36 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 122.505 0.322 . . . . 0.0 110.896 -174.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -90.32 -16.73 28.66 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 118.522 -0.751 . . . . 0.0 111.923 -179.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -70.95 -42.32 69.95 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 169.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 59.9 tp -66.93 -47.49 71.53 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 176.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.64 -46.04 93.86 Favored Glycine 0 C--N 1.338 0.662 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 178.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 92.2 p -63.07 -41.45 99.44 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 117.574 0.687 . . . . 0.0 110.163 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 31.4 mt -61.68 -40.25 94.3 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 119.06 0.845 . . . . 0.0 111.487 177.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -67.84 -34.47 76.77 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 119.721 1.146 . . . . 0.0 111.147 177.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.422 HD12 ' CE2' ' A' ' 17' ' ' PHE . 69.3 mt -68.3 -49.05 70.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 O-C-N 121.72 -0.613 . . . . 0.0 110.497 177.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.25 -34.6 64.79 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.077 0 C-N-CA 124.13 0.972 . . . . 0.0 109.39 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -67.95 -44.17 77.41 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.162 0.585 . . . . 0.0 110.505 177.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 14.3 m -67.64 -49.88 60.71 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 119.725 -0.79 . . . . 0.0 111.038 -177.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 67.5 mt -67.11 -38.13 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 179.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.15 -46.7 78.2 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 -178.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.4 mtp-105 -69.22 -36.72 77.52 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 117.257 0.528 . . . . 0.0 110.773 178.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.16 -40.08 86.59 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 177.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.4 m-30 -64.99 -48.2 74.82 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 175.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.3 tp -56.9 -43.42 81.35 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 123.367 0.417 . . . . 0.0 109.968 -177.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -67.3 -42.43 83.75 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 122.523 -0.111 . . . . 0.0 110.874 178.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -62.8 -40.9 98.8 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 111.444 0.164 . . . . 0.0 111.444 -176.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.5 t -84.02 -26.99 28.68 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 13.7 tpp180 -75.07 -24.13 58.13 Favored 'General case' 0 C--N 1.34 0.193 0 CA-C-N 118.26 0.482 . . . . 0.0 110.807 175.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.4 t -68.21 -15.05 63.42 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 122.646 0.378 . . . . 0.0 111.055 176.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -101.82 158.84 15.83 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.48 0.712 . . . . 0.0 110.146 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 22.8 t -76.86 159.5 30.0 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.921 0.488 . . . . 0.0 110.78 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -76.77 157.72 31.42 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.039 0.447 . . . . 0.0 110.578 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 82.9 p -151.35 163.74 38.24 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.956 0.502 . . . . 0.0 110.419 179.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 79.6 p -144.13 5.25 1.29 Allowed 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.006 0.522 . . . . 0.0 111.75 179.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 80.1 p -91.8 -1.96 57.12 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 122.92 0.488 . . . . 0.0 111.974 -178.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -148.13 160.2 43.15 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.878 0.471 . . . . 0.0 110.159 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 25.8 pttm -95.51 154.67 39.23 Favored Pre-proline 0 C--O 1.233 0.228 0 C-N-CA 123.631 0.772 . . . . 0.0 110.678 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.47 157.67 60.1 Favored 'Trans proline' 0 N--CA 1.453 -0.867 0 C-N-CA 123.394 2.729 . . . . 0.0 110.976 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -173.94 23.14 0.07 OUTLIER Glycine 0 CA--C 1.529 0.948 0 CA-C-O 119.785 -0.453 . . . . 0.0 112.236 -178.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.406 ' HB ' ' H ' ' A' ' 94' ' ' CYS . 0.0 OUTLIER -145.67 -151.12 0.36 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.371 0.668 . . . . 0.0 109.883 -176.848 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.406 ' H ' ' HB ' ' A' ' 93' ' ' THR . 23.0 p -48.61 -30.62 5.57 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.107 0.867 . . . . 0.0 113.248 -178.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.64 -46.62 81.77 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.313 -0.867 . . . . 0.0 109.922 175.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 41.0 t60 -65.81 -32.05 73.36 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.949 -0.568 . . . . 0.0 109.955 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.416 ' HB2' ' CG1' ' A' ' 47' ' ' ILE . . . -64.27 -45.35 88.43 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 123.686 0.794 . . . . 0.0 110.597 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.4 mt -63.01 -42.72 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.171 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 174.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -59.83 -35.31 74.48 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 121.232 -0.187 . . . . 0.0 111.156 179.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.6 m -72.49 -41.33 66.1 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-O 119.588 -0.244 . . . . 0.0 111.235 178.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 55.3 mt -60.97 -29.62 69.77 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 119.459 -0.896 . . . . 0.0 108.955 174.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.8 -14.45 16.02 Favored Glycine 0 CA--C 1.533 1.159 0 CA-C-O 118.928 -0.929 . . . . 0.0 113.923 178.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -104.64 -3.73 23.39 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.261 1.531 . . . . 0.0 112.135 -178.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 35.5 m -123.61 -17.06 4.66 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.149 0 C-N-CA 122.784 0.433 . . . . 0.0 111.949 -178.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -48.3 -28.64 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -58.73 -59.05 6.03 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 117.917 0.326 . . . . 0.0 111.497 -178.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -70.97 -30.71 67.06 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 117.841 0.291 . . . . 0.0 110.711 -177.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.1 mp -63.02 -55.14 28.24 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.497 -0.287 . . . . 0.0 110.44 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 62.3 mt -71.36 -49.18 44.9 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 118.137 0.426 . . . . 0.0 110.965 -178.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.517 ' HB2' ' CE1' ' A' ' 150' ' ' PHE . 66.0 p -49.94 -52.04 36.5 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 119.003 -0.522 . . . . 0.0 112.327 178.297 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -72.53 -41.99 65.24 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 119.187 0.903 . . . . 0.0 111.709 -177.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.69 -41.76 82.29 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.575 0.625 . . . . 0.0 111.221 -178.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 10.5 mt -78.55 -35.14 18.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 118.822 0.737 . . . . 0.0 111.12 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.01 -30.14 70.63 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 120.316 -0.554 . . . . 0.0 111.119 -178.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.42 -19.89 48.89 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.141 0.576 . . . . 0.0 110.303 176.353 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 40.3 m -78.16 156.14 30.05 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -173.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.1 t-20 -88.75 176.48 7.06 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 169.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -55.65 -38.47 69.61 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.916 0.78 . . . . 0.0 111.433 -178.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -66.62 -43.51 84.57 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.662 -0.649 . . . . 0.0 111.01 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -72.74 -35.01 67.43 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 119.493 -0.289 . . . . 0.0 110.683 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -41.57 87.98 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 118.828 0.74 . . . . 0.0 109.139 172.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -66.45 -39.21 88.74 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.222 -178.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -61.81 -39.95 93.53 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 119.372 -0.347 . . . . 0.0 111.196 175.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.2 mt -73.36 -34.97 44.93 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.11 0 CA-C-N 118.437 0.562 . . . . 0.0 109.709 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -66.65 -39.32 88.17 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 122.224 -0.298 . . . . 0.0 110.52 177.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 25.6 ttt -64.19 -46.28 84.63 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 176.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.5 tt -55.88 -47.45 77.34 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.942 0.497 . . . . 0.0 110.663 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.1 mt -75.51 -30.9 59.96 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -177.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -65.71 -41.99 91.66 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 177.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 95.3 mt -69.61 -38.73 77.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 177.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 44.2 t90 -60.04 -34.99 74.14 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 117.674 0.215 . . . . 0.0 110.666 177.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -72.85 -42.59 63.58 Favored 'General case' 0 N--CA 1.456 -0.13 0 O-C-N 122.37 -0.206 . . . . 0.0 110.663 177.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 57.4 mmm-85 -75.57 -14.15 60.38 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 60.2 p -59.78 -17.72 37.86 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -179.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 148.23 1.58 0.47 Allowed Glycine 0 CA--C 1.532 1.141 0 CA-C-O 119.558 -0.579 . . . . 0.0 113.217 178.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 74.9 mt -72.8 164.06 27.16 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.139 0.969 . . . . 0.0 110.546 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -71.17 164.23 26.05 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.842 0.457 . . . . 0.0 110.88 -177.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -74.09 -6.02 45.1 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.054 0.541 . . . . 0.0 112.229 -176.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -138.94 156.9 46.89 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 123.133 0.573 . . . . 0.0 109.964 178.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 94.0 p -151.95 170.2 20.43 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 123.038 0.535 . . . . 0.0 110.354 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -111.73 9.16 20.88 Favored 'General case' 0 CA--C 1.528 0.096 0 C-N-CA 123.233 0.613 . . . . 0.0 111.634 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 84.9 mt -81.23 146.19 30.58 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 122.412 0.285 . . . . 0.0 110.678 -179.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . 0.42 ' HA ' ' HB3' ' A' ' 146' ' ' ARG . 53.5 t30 -114.81 -2.9 12.84 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.384 0.673 . . . . 0.0 111.215 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -47.49 -39.73 16.7 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 126.295 1.838 . . . . 0.0 113.223 -167.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.404 ' H ' HD13 ' A' ' 145' ' ' ILE . 0.2 OUTLIER -122.75 -9.24 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.152 0 CA-C-N 117.725 0.239 . . . . 0.0 111.497 170.579 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.42 ' HB3' ' HA ' ' A' ' 143' ' ' ASN . 49.1 tpt85 -65.27 -26.13 67.95 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-O 119.332 -0.366 . . . . 0.0 110.567 -177.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' SER . . . . . 0.577 ' HB3' ' CE2' ' A' ' 150' ' ' PHE . 28.7 t -65.05 135.94 56.17 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 170.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 66.4 tttp -55.92 -50.6 70.26 Favored 'General case' 0 C--O 1.23 0.061 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -168.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 83.7 m -42.14 -57.92 2.32 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.143 0.429 . . . . 0.0 112.059 -169.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . 0.577 ' CE2' ' HB3' ' A' ' 147' ' ' SER . 14.5 m-85 -35.78 -102.46 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 127.748 2.419 . . . . 0.0 114.038 -174.017 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -85.93 -7.12 58.89 Favored 'General case' 0 C--N 1.331 -0.203 0 O-C-N 121.457 -0.777 . . . . 0.0 113.068 175.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 18.5 mmt -104.62 -3.64 23.53 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -172.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -62.47 -23.9 67.16 Favored 'General case' 0 C--N 1.345 0.383 0 CA-C-N 120.154 1.343 . . . . 0.0 111.344 173.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 63.1 tp . . . . . 0 C--O 1.251 1.143 0 CA-C-O 117.658 -1.163 . . . . 0.0 109.676 179.682 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 52.7 p90 . . . . . 0 N--CA 1.474 0.732 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 156' ' ' SER . . . . . 0.586 ' H ' ' CD ' ' B' ' 157' ' ' PRO . 88.1 p -132.24 -23.48 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.464 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 -178.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . 0.586 ' CD ' ' H ' ' B' ' 156' ' ' SER . 82.2 Cg_endo -77.15 170.83 18.94 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 CA-C-N 122.022 1.758 . . . . 0.0 110.958 179.18 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 81.1 p -124.46 179.1 5.07 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.485 0.714 . . . . 0.0 110.144 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 159' ' ' SEP . . . . . 0.453 ' P ' ' HG ' ' A' ' 25' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -71.25 169.94 66.79 Favored 'Cis proline' 0 N--CA 1.454 -0.819 0 N-CA-C 110.251 -0.711 . . . . 0.0 110.251 -5.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 31.9 t -66.57 137.96 57.14 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -146.5 141.22 26.84 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 122.813 0.445 . . . . 0.0 111.44 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 16.4 t -133.8 145.69 57.08 Favored Pre-proline 0 C--O 1.233 0.213 0 C-N-CA 123.617 0.767 . . . . 0.0 111.093 -175.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.32 1.98 2.17 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 123.476 2.784 . . . . 0.0 111.341 177.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 24.2 p -72.08 -28.13 63.12 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 118.711 -0.661 . . . . 0.0 112.011 176.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -69.6 175.94 7.31 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 123.921 3.08 . . . . 0.0 111.916 174.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 69.5 m . . . . . 0 C--O 1.25 1.094 0 CA-C-O 117.745 -1.121 . . . . 0.0 110.528 178.709 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.5 ptp . . . . . 0 N--CA 1.478 0.937 0 CA-C-O 120.445 0.164 . . . . 0.0 110.676 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -137.41 153.71 50.1 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 123.291 0.636 . . . . 0.0 109.871 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 65.9 tt0 -129.96 142.74 50.6 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.489 0.716 . . . . 0.0 109.134 177.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 27.8 t70 60.25 155.87 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.868 1.267 . . . . 0.0 112.885 -174.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -140.73 19.46 2.34 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 122.801 0.441 . . . . 0.0 111.723 -177.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.444 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 19.1 t70 -81.79 -141.68 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.444 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 17.5 t80 -55.77 -13.05 1.51 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.546 0.739 . . . . 0.0 111.557 177.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -52.93 -44.53 67.11 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.512 0.725 . . . . 0.0 110.94 177.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -58.13 -41.74 84.33 Favored 'General case' 0 C--O 1.227 -0.095 0 CA-C-N 118.542 0.61 . . . . 0.0 111.523 177.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -64.86 -53.17 50.95 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 118.166 0.439 . . . . 0.0 110.302 -178.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.1 t -61.69 -53.73 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -178.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.51 -32.31 68.71 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 123.236 0.614 . . . . 0.0 111.916 -178.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 55.7 m -72.59 -44.95 61.34 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 118.403 0.547 . . . . 0.0 110.444 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.9 tp -65.47 -32.45 74.08 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.115 0.416 . . . . 0.0 109.975 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -67.81 -45.64 74.17 Favored 'General case' 0 N--CA 1.458 -0.058 0 C-N-CA 123.876 0.871 . . . . 0.0 109.777 176.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.0 t -63.43 -27.9 69.6 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.225 176.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.25 -43.57 70.28 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 175.646 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -70.72 -26.63 63.48 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.014 0.926 . . . . 0.0 112.359 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -56.41 -31.83 64.27 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -175.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.8 tp -159.5 155.72 26.95 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 118.32 0.509 . . . . 0.0 110.085 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -71.3 141.91 50.48 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 176.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 59.0 m -142.83 168.43 19.72 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 121.071 0.463 . . . . 0.0 111.341 -175.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -75.99 25.08 1.55 Allowed Glycine 0 CA--C 1.529 0.95 0 C-N-CA 124.212 0.91 . . . . 0.0 112.431 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.8 mm 57.65 49.08 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 124.074 0.95 . . . . 0.0 111.082 -178.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.3 t -57.98 132.74 54.35 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.785 0.434 . . . . 0.0 111.01 -178.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.89 -27.62 71.5 Favored Glycine 0 C--N 1.339 0.697 0 C-N-CA 123.582 0.61 . . . . 0.0 113.177 -175.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.432 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 39.6 t -59.08 -43.84 91.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 117.901 0.851 . . . . 0.0 111.515 -174.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -65.5 -42.32 92.27 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -179.199 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 52.9 mt -62.53 -41.34 91.64 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.2 mmtt -64.59 -35.68 81.76 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 119.327 -0.368 . . . . 0.0 111.383 -179.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.432 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -65.93 -46.25 78.91 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 118.712 0.687 . . . . 0.0 110.115 174.025 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.22 -56.28 23.53 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 121.237 -0.185 . . . . 0.0 110.627 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 77.3 p -58.13 -48.29 80.69 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 t -63.02 -44.0 97.16 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 120.084 -0.646 . . . . 0.0 111.389 -176.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -73.57 -22.48 60.05 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.652 0.66 . . . . 0.0 112.418 -178.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.82 -56.45 9.1 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 118.991 0.814 . . . . 0.0 109.172 168.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 55.7 mt -68.89 -15.84 63.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.157 0.983 . . . . 0.0 112.666 -175.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -59.81 -25.81 65.26 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.6 t-160 -150.23 -27.81 0.24 Allowed 'General case' 0 C--N 1.34 0.16 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -176.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 42.2 mm 45.21 74.18 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-O 121.815 0.817 . . . . 0.0 111.899 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -149.41 22.84 0.92 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.435 1.094 . . . . 0.0 109.61 179.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.531 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -147.7 39.54 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 124.69 1.196 . . . . 0.0 109.131 -170.413 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.33 -54.87 26.08 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -174.002 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 78.9 p -75.77 -27.06 57.9 Favored 'General case' 0 CA--C 1.521 -0.166 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -172.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.654 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -81.49 -43.83 18.26 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.146 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 36.7 mt -55.91 -53.5 37.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 171.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.0 mm -66.58 -47.87 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 CA-C-O 119.078 -0.487 . . . . 0.0 112.027 -176.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 73.6 m -59.15 -35.5 73.62 Favored 'General case' 0 C--O 1.23 0.054 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.153 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.3 tp -68.53 -43.49 76.62 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 119.17 -0.443 . . . . 0.0 112.055 -178.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 33.2 pt -74.03 -33.33 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 119.217 0.917 . . . . 0.0 112.265 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 97.1 mt -66.3 -50.32 68.99 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 177.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -57.86 -42.1 83.81 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.266 178.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -58.39 -41.09 84.08 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 175.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.585 ' CB ' ' HG ' ' A' ' 65' ' ' SER . 7.5 t -63.31 -46.22 87.73 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -178.527 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -80.47 -23.14 40.39 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -175.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.3 mt -84.87 -19.51 32.25 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 179.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 72.9 m -104.2 156.22 36.07 Favored Pre-proline 0 CA--C 1.534 0.339 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -170.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -50.74 176.36 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.537 1 C-N-CA 126.498 4.798 . . . . 0.0 115.997 175.067 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.441 ' HB2' ' HE3' ' A' ' 115' ' ' LYS . 10.4 p-10 -56.18 -49.61 73.53 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 125.905 1.682 . . . . 0.0 114.069 -174.019 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 52.8 m -62.75 -27.55 69.36 Favored 'General case' 0 CA--C 1.522 -0.101 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -81.95 -18.68 42.7 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 118.688 -0.673 . . . . 0.0 111.057 178.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -74.72 -40.2 61.44 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 119.381 0.991 . . . . 0.0 108.525 171.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 61.5 tp -64.35 -51.49 63.08 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 174.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.5 -36.82 90.81 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.765 -0.934 . . . . 0.0 110.765 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.585 ' HG ' ' CB ' ' A' ' 54' ' ' SER . 30.7 t -60.58 -48.4 81.94 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.976 0.388 . . . . 0.0 110.137 177.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 31.1 mt -59.88 -35.55 75.06 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 118.55 0.614 . . . . 0.0 111.357 178.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -67.68 -37.23 82.04 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.117 0.872 . . . . 0.0 110.789 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 66.8 mt -70.31 -47.97 63.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 O-C-N 121.683 -0.635 . . . . 0.0 110.219 178.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 85.6 mt -59.98 -38.85 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 C-N-CA 123.993 0.917 . . . . 0.0 109.279 178.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -65.99 -42.97 89.12 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 118.787 -0.625 . . . . 0.0 110.555 178.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.6 t -65.66 -54.6 25.37 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.621 0.646 . . . . 0.0 111.74 -177.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 55.8 mt -62.82 -33.48 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.18 -50.99 41.53 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-O 119.612 -0.549 . . . . 0.0 112.451 -179.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.623 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -70.82 -33.6 70.85 Favored 'General case' 0 CA--C 1.523 -0.07 0 CA-C-N 118.184 0.992 . . . . 0.0 110.72 -178.475 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.79 -44.49 77.26 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 177.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -62.83 -47.02 85.23 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 176.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.5 tp -57.42 -46.57 83.37 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 123.38 0.425 . . . . 0.0 110.379 -176.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -68.61 -44.45 74.27 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.094 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -68.9 -21.65 64.22 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -176.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 6.9 t -96.55 -28.01 14.58 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-N 118.675 0.67 . . . . 0.0 111.978 178.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 -80.72 -21.47 41.14 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 118.657 0.662 . . . . 0.0 111.58 176.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 95.2 p -68.55 -14.1 62.78 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 175.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -100.52 163.63 12.27 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.347 0.659 . . . . 0.0 110.186 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 53.7 m -133.8 158.82 42.4 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.15 0.58 . . . . 0.0 110.547 -179.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 50.0 t-20 -81.35 141.39 34.05 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.7 0.4 . . . . 0.0 110.573 -179.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.6 t -153.59 -13.33 0.14 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.935 0.494 . . . . 0.0 111.417 178.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 77.8 p -158.31 163.46 37.33 Favored 'General case' 0 CA--C 1.527 0.081 0 C-N-CA 123.085 0.554 . . . . 0.0 110.236 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 51.0 m -71.25 148.31 47.33 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.735 0.302 . . . . 0.0 110.54 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -152.17 159.21 43.65 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.869 0.467 . . . . 0.0 109.949 -178.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -80.55 154.15 73.73 Favored Pre-proline 0 CA--C 1.532 0.281 0 C-N-CA 123.02 0.528 . . . . 0.0 110.628 179.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -69.43 155.88 65.79 Favored 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 123.393 2.729 . . . . 0.0 110.816 178.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.526 ' H ' ' CD2' ' A' ' 96' ' ' HIS . . . 134.92 -160.88 24.45 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 111.833 -0.507 . . . . 0.0 111.833 179.228 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 54.07 -173.37 0.04 OUTLIER 'General case' 0 C--O 1.227 -0.094 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 23.1 p -50.29 -32.03 15.89 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.058 1.343 . . . . 0.0 113.758 -172.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.14 -48.04 81.87 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.648 0.658 . . . . 0.0 109.973 176.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.526 ' CD2' ' H ' ' A' ' 92' ' ' GLY . 18.4 m-70 -75.34 -21.42 58.39 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.586 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.0 -44.88 83.49 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.2 mt -64.26 -43.7 97.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 174.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -58.97 -33.74 70.99 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.48 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.8 m -73.75 -42.6 60.88 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-O 119.301 -0.381 . . . . 0.0 110.887 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 56.8 mt -60.83 -29.55 69.56 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-N 119.053 0.842 . . . . 0.0 109.233 174.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.21 -14.31 25.17 Favored Glycine 0 CA--C 1.531 1.038 0 CA-C-O 119.104 -0.831 . . . . 0.0 113.635 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.8 -4.58 27.72 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.873 1.337 . . . . 0.0 112.044 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.0 m -126.18 -18.44 2.97 Favored 'Isoleucine or valine' 0 C--N 1.337 0.056 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -178.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.0 tp -49.62 -27.84 3.33 Favored 'Isoleucine or valine' 0 C--N 1.339 0.15 0 C-N-CA 123.753 0.821 . . . . 0.0 112.293 -175.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.9 pt20 -61.97 -49.69 75.1 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 117.764 0.256 . . . . 0.0 110.709 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -70.12 -36.51 74.86 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 -177.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.5 mt -63.81 -53.41 51.26 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.612 -177.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 65.2 mt -66.05 -64.41 0.86 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.536 -0.745 . . . . 0.0 109.358 177.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.464 ' HB2' ' CE1' ' A' ' 150' ' ' PHE . 84.6 p -39.91 -49.69 2.44 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.666 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -71.66 -44.41 64.33 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 119.496 1.044 . . . . 0.0 111.404 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.13 -43.02 82.0 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.717 0.689 . . . . 0.0 110.874 -178.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -76.88 -32.92 20.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 CA-C-N 119.01 0.823 . . . . 0.0 111.953 178.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.95 -30.05 68.41 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.34 0.518 . . . . 0.0 110.902 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.441 ' HE3' ' HB2' ' A' ' 59' ' ' ASP . 0.8 OUTLIER -77.62 -19.46 55.47 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.328 0.651 . . . . 0.0 110.227 175.577 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 56.0 m -81.29 153.96 26.81 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -173.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -92.35 177.61 6.09 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 170.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -55.36 -36.33 66.21 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.001 0.819 . . . . 0.0 111.608 -177.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -67.27 -47.13 71.58 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.779 -0.576 . . . . 0.0 110.382 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -70.11 -33.48 71.9 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 119.474 -0.298 . . . . 0.0 110.519 -179.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -42.25 93.21 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 118.591 0.632 . . . . 0.0 109.325 173.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -66.44 -40.25 89.37 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.149 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp -61.74 -43.83 98.08 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 119.661 -0.209 . . . . 0.0 110.996 176.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 95.6 mt -69.81 -38.38 75.77 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -63.95 -40.89 97.48 Favored 'General case' 0 CA--C 1.523 -0.091 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 60.9 ttp -63.27 -43.92 96.58 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 177.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 8.2 tt -58.76 -45.01 90.73 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 97.1 mt -73.19 -32.9 65.09 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -66.28 -38.76 88.54 Favored 'General case' 0 N--CA 1.458 -0.051 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 177.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 90.9 mt -73.17 -35.03 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.179 0 C-N-CA 122.54 0.336 . . . . 0.0 110.16 178.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 87.2 t90 -64.66 -38.17 90.08 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 117.942 0.337 . . . . 0.0 110.187 177.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -73.53 -36.77 65.74 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.206 0.202 . . . . 0.0 110.549 177.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 49.1 ttm-85 -67.66 -30.31 69.82 Favored 'General case' 0 CA--C 1.527 0.06 0 C-N-CA 123.255 0.622 . . . . 0.0 110.879 178.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 51.0 m -82.58 -8.2 59.61 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.357 0.663 . . . . 0.0 111.719 177.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -66.87 163.08 44.88 Favored Glycine 0 CA--C 1.528 0.851 0 N-CA-C 112.142 -0.383 . . . . 0.0 112.142 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 37.8 tp -88.79 -8.58 54.14 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.025 0.53 . . . . 0.0 111.081 -178.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -138.84 163.88 31.11 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.181 0.592 . . . . 0.0 110.166 -178.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -84.89 160.45 20.14 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.821 0.449 . . . . 0.0 111.532 -179.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 95.8 mttt 58.9 163.51 0.04 OUTLIER 'General case' 0 C--N 1.341 0.218 0 C-N-CA 125.651 1.581 . . . . 0.0 113.334 -178.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 96.9 p -90.26 168.4 11.95 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.024 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -138.92 15.45 2.67 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.185 0.594 . . . . 0.0 111.335 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 85.9 mt -124.2 142.36 51.3 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.162 0.585 . . . . 0.0 110.425 -177.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 51.3 p-10 -82.5 -13.36 56.81 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.349 0.659 . . . . 0.0 111.812 178.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -47.2 -38.3 11.76 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 126.062 1.745 . . . . 0.0 113.898 -167.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -125.35 -14.35 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 CA-C-N 117.914 0.325 . . . . 0.0 110.506 170.193 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.566 ' C ' ' H ' ' A' ' 148' ' ' LYS . 28.0 ttt180 -63.13 -14.65 51.15 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 123.408 0.683 . . . . 0.0 110.86 -178.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 9.3 t -68.99 18.62 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 120.769 0.318 . . . . 0.0 111.632 169.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.566 ' H ' ' C ' ' A' ' 146' ' ' ARG . 67.6 mttm 55.63 -74.25 0.01 OUTLIER 'General case' 0 C--N 1.34 0.193 0 C-N-CA 128.347 2.659 . . . . 0.0 116.534 175.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 26.7 p -37.81 -32.23 0.06 Allowed 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -168.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . 0.464 ' CE1' ' HB2' ' A' ' 110' ' ' SER . 31.2 m-85 -48.06 -91.07 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.192 1.397 . . . . 0.0 113.568 178.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -77.05 -14.65 59.79 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.747 176.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 20.3 mmt -88.05 -20.8 25.27 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -172.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -74.79 -14.38 60.69 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.432 1.014 . . . . 0.0 112.122 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 98.1 mt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 117.242 -1.361 . . . . 0.0 110.599 -178.124 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 . . . . . 0 N--CA 1.475 0.815 0 CA-C-O 119.805 -0.141 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 54.6 m -112.0 151.54 43.63 Favored Pre-proline 0 C--O 1.233 0.211 0 C-N-CA 122.566 0.346 . . . . 0.0 111.035 -177.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -75.01 -179.16 4.72 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 124.214 3.276 . . . . 0.0 110.892 177.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 30.9 p -65.44 161.31 20.18 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 122.956 0.502 . . . . 0.0 110.998 177.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 160' ' ' PRO . . . . . 0.524 ' HG2' ' H ' ' B' ' 161' ' ' SER . 59.4 Cg_endo -67.75 -60.43 0.08 OUTLIER 'Cis proline' 0 N--CA 1.453 -0.902 0 CA-C-N 118.947 0.66 . . . . 0.0 110.868 -5.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 161' ' ' SER . . . . . 0.524 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 34.2 t -175.53 168.3 3.21 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 125.14 1.376 . . . . 0.0 108.079 178.369 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 162' ' ' TYR . . . . . 0.415 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 48.4 t80 -152.02 132.92 14.17 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.187 -0.321 . . . . 0.0 111.804 171.551 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.1 t -135.29 140.98 36.07 Favored Pre-proline 0 N--CA 1.455 -0.224 0 C-N-CA 123.181 0.592 . . . . 0.0 110.791 177.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -65.71 -6.56 14.22 Favored 'Trans proline' 0 N--CA 1.45 -1.052 0 C-N-CA 122.734 2.29 . . . . 0.0 111.302 177.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 71.1 p -92.02 11.88 23.77 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 113.345 0.868 . . . . 0.0 113.345 -177.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -57.28 148.92 67.83 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 122.543 2.162 . . . . 0.0 110.096 169.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 51.1 m . . . . . 0 C--O 1.25 1.079 0 CA-C-O 117.281 -1.342 . . . . 0.0 111.043 -178.862 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.5 tpt . . . . . 0 N--CA 1.476 0.838 0 N-CA-C 110.847 -0.057 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -132.28 4.64 4.05 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.503 0.721 . . . . 0.0 110.004 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.56 153.03 35.04 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.477 1.111 . . . . 0.0 109.79 -177.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 32.9 t0 53.16 27.41 5.89 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.794 0.838 . . . . 0.0 112.987 177.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -84.68 38.08 0.68 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.424 0.69 . . . . 0.0 110.907 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.473 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 14.1 t70 -77.18 -154.37 0.06 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.783 0.833 . . . . 0.0 110.297 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.473 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 10.6 t80 -55.59 -14.49 2.15 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.863 0.865 . . . . 0.0 111.297 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -55.27 -35.25 64.83 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.908 0.883 . . . . 0.0 111.485 176.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.6 m-20 -61.82 -45.46 93.72 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.359 0.981 . . . . 0.0 109.292 178.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -66.18 -48.39 70.87 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 110.557 -0.164 . . . . 0.0 110.557 -177.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.6 t -65.92 -54.67 24.82 Favored 'Isoleucine or valine' 0 C--N 1.339 0.118 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 -178.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.59 -31.76 69.76 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.828 0.451 . . . . 0.0 111.737 -178.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 69.5 m -73.63 -40.35 63.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 120.214 -0.595 . . . . 0.0 110.336 176.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.9 tp -66.28 -31.86 72.93 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.009 0.433 . . . . 0.0 109.852 179.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -69.74 -44.19 70.78 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.787 0.835 . . . . 0.0 109.683 175.155 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.2 t -63.26 -26.06 68.61 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 175.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.432 ' CE2' HD13 ' A' ' 68' ' ' ILE . 0.2 OUTLIER -71.19 -45.81 62.61 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 174.992 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -60.91 -31.64 71.14 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.865 0.466 . . . . 0.0 110.783 177.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -69.28 -14.12 62.77 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 94.3 mt -69.22 -46.26 67.81 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 118.844 0.747 . . . . 0.0 111.174 -177.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 94.0 mttt 47.64 24.54 0.55 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.367 1.067 . . . . 0.0 113.707 -179.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 96.1 p -143.75 -16.9 0.61 Allowed 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 113.952 1.093 . . . . 0.0 113.952 -176.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 173.6 -133.21 2.51 Favored Glycine 0 CA--C 1.523 0.585 0 CA-C-N 119.407 1.003 . . . . 0.0 111.9 179.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.8 mt -131.71 150.61 34.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 124.503 1.121 . . . . 0.0 109.33 -173.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.5 m -139.3 123.88 18.38 Favored 'General case' 0 CA--C 1.523 -0.093 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 176.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.14 -26.96 73.35 Favored Glycine 0 CA--C 1.525 0.714 0 CA-C-O 119.489 -0.617 . . . . 0.0 112.682 -174.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.414 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 83.4 p -65.28 -35.22 80.34 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 118.398 1.099 . . . . 0.0 109.87 -179.173 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.6 mmt-85 -68.08 -46.0 72.23 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 73.0 mt -60.87 -36.38 71.29 Favored 'Isoleucine or valine' 0 C--O 1.231 0.1 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.9 mmtt -69.26 -40.86 77.58 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 119.009 -0.52 . . . . 0.0 111.504 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.39 -38.48 87.61 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.188 0.904 . . . . 0.0 110.953 176.153 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.7 mt -63.32 -57.84 9.06 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 122.161 0.184 . . . . 0.0 110.797 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.4 HG21 ' HB2' ' A' ' 71' ' ' SER . 33.4 p -56.27 -42.12 76.95 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 118.074 0.397 . . . . 0.0 111.272 177.028 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.0 m -55.65 -55.08 36.38 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 119.01 -0.519 . . . . 0.0 110.913 -179.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -67.86 -37.18 81.5 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.326 -0.949 . . . . 0.0 111.584 -176.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.404 ' HB3' ' HH ' ' A' ' 76' ' ' TYR . . . -57.09 -58.66 7.22 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 118.063 0.392 . . . . 0.0 110.978 177.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.2 mp -67.95 -25.09 65.28 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -178.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -71.71 -19.15 62.1 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 117.857 0.299 . . . . 0.0 111.091 176.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -146.74 52.83 1.1 Allowed 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.36 0.264 . . . . 0.0 111.456 -175.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 33.3 mm -65.06 76.18 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-O 121.757 0.789 . . . . 0.0 109.908 171.133 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -144.13 10.96 1.53 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.597 1.559 . . . . 0.0 109.063 174.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.453 HG21 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -146.15 95.26 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 C-N-CA 125.68 1.592 . . . . 0.0 107.935 -176.572 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.581 ' CD ' ' H ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -91.76 -79.27 0.38 Allowed 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -177.18 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.581 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 46.1 m -57.72 -21.31 40.14 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 123.554 0.741 . . . . 0.0 112.96 -174.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.509 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -76.02 -54.07 7.41 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.349 0.659 . . . . 0.0 110.346 178.632 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 6.2 mt -56.36 -44.25 79.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 173.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.5 mm -67.14 -47.38 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.166 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.082 -179.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 42.7 t -58.95 -34.49 71.83 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-N 118.406 0.548 . . . . 0.0 109.968 178.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.9 tp -68.71 -45.42 71.64 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.811 -179.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.9 pt -72.3 -34.93 50.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 119.415 1.007 . . . . 0.0 112.183 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.3 mt -64.55 -51.71 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 178.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -64.91 -27.92 69.18 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.078 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -61.94 -46.81 87.68 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 175.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.7 t -61.86 -38.8 89.63 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.39 175.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -61.24 -42.77 99.19 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.621 0.769 . . . . 0.0 112.602 -176.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 83.7 mt -86.23 -14.76 42.9 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 -175.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.417 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 76.0 m -105.21 155.74 37.31 Favored Pre-proline 0 CA--C 1.533 0.309 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -170.569 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.417 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 92.3 Cg_endo -69.17 -176.44 1.32 Allowed 'Trans proline' 0 N--CA 1.459 -0.532 1 C-N-CA 125.431 4.088 . . . . 0.0 113.142 -178.882 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -54.82 -44.32 73.75 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.382 1.473 . . . . 0.0 113.98 -171.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.0 m -58.03 -29.32 65.25 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -92.86 -14.48 27.63 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 118.892 -0.575 . . . . 0.0 111.672 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -65.85 -49.0 69.73 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 169.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 44.5 tp -67.74 -48.21 67.1 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.346 179.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -56.84 -43.64 92.27 Favored Glycine 0 C--N 1.337 0.598 0 N-CA-C 110.73 -0.948 . . . . 0.0 110.73 179.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.2 t -67.5 -35.46 79.18 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.699 -0.667 . . . . 0.0 110.91 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 35.9 mt -60.9 -34.58 74.87 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 119.649 1.113 . . . . 0.0 110.66 173.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -71.67 -32.47 67.91 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.887 0.767 . . . . 0.0 111.347 175.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.432 HD13 ' CE2' ' A' ' 17' ' ' PHE . 92.6 mt -70.7 -44.07 76.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 CA-C-N 118.798 0.726 . . . . 0.0 110.413 176.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.1 mt -63.65 -35.41 72.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 177.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -70.07 -39.49 75.6 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 119.057 -0.496 . . . . 0.0 111.252 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.4 ' HB2' HG21 ' A' ' 33' ' ' THR . 95.8 p -69.72 -55.33 10.23 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 118.907 0.776 . . . . 0.0 110.5 -176.418 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 39.3 mt -64.75 -33.42 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.42 -52.21 45.59 Favored Glycine 0 CA--C 1.524 0.622 0 CA-C-O 119.846 -0.419 . . . . 0.0 112.239 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.639 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -72.06 -31.24 65.94 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 118.061 0.931 . . . . 0.0 111.115 -178.703 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.49 -41.89 72.08 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 177.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.404 ' HH ' ' HB3' ' A' ' 36' ' ' ALA . 6.6 m-30 -62.84 -48.49 78.82 Favored 'General case' 0 CA--C 1.519 -0.22 0 O-C-N 122.153 -0.342 . . . . 0.0 110.094 175.052 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 55.1 tp -58.04 -44.03 87.18 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 123.312 0.383 . . . . 0.0 110.277 -176.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -66.12 -46.02 79.06 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 110.598 -0.149 . . . . 0.0 110.598 179.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -64.39 -34.8 79.0 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -176.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.4 t -85.93 -23.7 26.86 Favored 'General case' 0 CA--C 1.527 0.082 0 CA-C-N 118.147 0.43 . . . . 0.0 112.022 -178.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.5 tpp180 -83.18 -30.73 27.56 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 118.328 0.513 . . . . 0.0 112.003 176.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 74.1 m -77.78 -14.25 59.64 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 122.459 0.303 . . . . 0.0 111.785 178.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 61.0 m-20 -105.53 161.12 14.63 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 122.911 0.485 . . . . 0.0 110.308 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 21.8 t 58.92 173.25 0.07 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.109 0.964 . . . . 0.0 112.759 -177.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -129.93 5.49 4.99 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.045 0.938 . . . . 0.0 109.804 176.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 81.3 p -143.42 19.08 1.88 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.836 0.854 . . . . 0.0 110.945 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 30.4 m 57.83 25.39 11.93 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.74 0.816 . . . . 0.0 112.317 -176.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 42.4 m 59.09 169.38 0.06 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.968 1.307 . . . . 0.0 113.217 -177.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -95.46 137.51 34.42 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.803 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm 59.06 151.41 0.08 OUTLIER Pre-proline 0 CA--C 1.534 0.356 0 C-N-CA 125.697 1.599 . . . . 0.0 113.001 -174.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -74.16 157.06 46.63 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 123.226 2.618 . . . . 0.0 110.888 177.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 162.44 174.8 32.77 Favored Glycine 0 CA--C 1.529 0.907 0 N-CA-C 111.394 -0.682 . . . . 0.0 111.394 178.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 50.0 -154.31 0.13 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.76 0.824 . . . . 0.0 112.913 175.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.6 p -52.53 -29.08 23.41 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -175.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.65 -44.57 85.97 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 118.842 0.746 . . . . 0.0 109.802 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -67.58 -30.44 70.05 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 120.99 0.424 . . . . 0.0 110.041 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.5 -43.63 80.42 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.344 -178.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.0 mt -63.66 -43.06 97.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 108.741 -0.836 . . . . 0.0 108.741 173.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -60.71 -32.76 71.99 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-O 120.572 0.225 . . . . 0.0 110.774 178.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.9 m -74.18 -40.25 62.65 Favored 'General case' 0 C--N 1.338 0.087 0 O-C-N 121.851 -0.531 . . . . 0.0 110.837 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 44.2 mt -61.56 -30.67 70.81 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 119.637 -0.825 . . . . 0.0 108.884 172.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.12 -14.6 18.7 Favored Glycine 0 CA--C 1.531 1.065 0 CA-C-O 119.027 -0.874 . . . . 0.0 114.019 178.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -102.48 -3.87 26.24 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 118.921 1.36 . . . . 0.0 112.307 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.8 m -123.9 -18.98 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.2 tp -49.99 -27.46 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 123.846 0.859 . . . . 0.0 112.796 -178.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -63.38 -46.54 86.02 Favored 'General case' 0 N--CA 1.453 -0.289 0 O-C-N 122.008 -0.433 . . . . 0.0 110.988 178.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -74.26 -39.04 63.27 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -178.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 97.1 mt -62.4 -51.02 69.22 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.419 -177.209 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 78.5 mt -66.3 -59.15 3.99 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.391 -0.814 . . . . 0.0 109.806 177.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.1 p -48.5 -46.04 37.85 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.526 1.057 . . . . 0.0 112.361 -175.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 -70.97 -45.57 63.85 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 119.192 0.906 . . . . 0.0 111.0 179.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.93 -37.83 74.8 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 119.02 -0.514 . . . . 0.0 112.035 -178.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -82.51 -32.29 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.154 0 C-N-CA 119.312 -0.955 . . . . 0.0 111.888 176.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.9 -29.45 66.64 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.469 -179.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.9 -16.56 53.26 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 122.853 0.461 . . . . 0.0 110.754 176.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 15.7 m -77.52 157.91 30.17 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -172.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -95.02 178.7 5.47 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 169.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -55.66 -39.58 71.1 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.64 -0.663 . . . . 0.0 111.949 -177.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -69.84 -37.25 76.12 Favored 'General case' 0 N--CA 1.456 -0.154 0 O-C-N 121.792 -0.567 . . . . 0.0 110.842 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -77.0 -39.15 51.44 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.169 -0.444 . . . . 0.0 111.322 -176.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.66 -34.35 78.0 Favored 'General case' 0 CA--C 1.522 -0.118 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 174.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -63.42 -45.06 92.72 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.478 176.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -61.95 -41.25 97.76 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.994 0.361 . . . . 0.0 111.436 177.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 95.6 mt -68.04 -40.58 83.37 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.117 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.6 tmm_? -62.51 -43.2 99.39 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 178.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -61.61 -45.68 93.04 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.387 0.675 . . . . 0.0 110.681 179.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.0 tt -60.49 -46.23 90.89 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.462 0.305 . . . . 0.0 110.458 177.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 98.1 mt -69.19 -29.98 68.07 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 119.796 -0.145 . . . . 0.0 111.363 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -66.75 -42.25 86.51 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 177.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.5 mt -64.99 -40.74 90.1 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 176.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -65.2 -29.81 70.65 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.323 0.249 . . . . 0.0 111.232 179.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -77.4 -40.84 42.2 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 122.076 -0.39 . . . . 0.0 110.947 177.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -74.05 -27.42 60.91 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -178.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 97.0 p -76.86 -16.86 59.29 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 118.387 0.54 . . . . 0.0 111.446 177.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 72.82 161.21 5.88 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 123.62 0.628 . . . . 0.0 112.21 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 7.4 mp -112.19 4.34 17.78 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.215 0.606 . . . . 0.0 110.588 178.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 54.81 18.41 2.14 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.835 0.854 . . . . 0.0 112.369 -175.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 33.1 tp60 -152.72 153.52 33.39 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.603 1.161 . . . . 0.0 108.204 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -63.91 139.73 58.8 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 120.803 0.335 . . . . 0.0 110.83 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 93.1 p -161.46 171.8 17.54 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.333 0.653 . . . . 0.0 110.404 -178.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -140.11 -1.26 1.57 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.599 0.36 . . . . 0.0 111.417 176.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 73.2 mt 49.31 35.55 7.92 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.435 0.694 . . . . 0.0 111.649 -178.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -54.16 -20.77 7.29 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.491 0.716 . . . . 0.0 111.941 -175.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -41.93 -41.73 2.56 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 125.765 1.626 . . . . 0.0 112.036 -176.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 1.9 pp -127.93 -13.92 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 173.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 58.5 mmm-85 -63.64 -15.49 58.41 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.685 0.675 . . . . 0.0 109.777 174.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 35.6 t -71.11 -24.8 62.36 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 176.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.468 ' HG3' ' H ' ' A' ' 149' ' ' CYS . 4.0 tppt? -149.52 170.92 17.51 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 -173.016 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . 0.468 ' H ' ' HG3' ' A' ' 148' ' ' LYS . 71.4 m -55.39 -13.39 1.41 Allowed 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 125.101 1.361 . . . . 0.0 112.854 -178.061 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . 0.424 ' CD2' ' HB3' ' A' ' 148' ' ' LYS . 24.4 m-85 -29.36 -66.55 0.09 Allowed 'General case' 0 C--N 1.341 0.215 0 C-N-CA 124.945 1.298 . . . . 0.0 109.954 177.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -114.96 -10.79 12.24 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.701 166.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 33.9 mmt -72.96 -0.95 15.14 Favored 'General case' 0 C--N 1.345 0.407 0 CA-C-N 119.561 1.073 . . . . 0.0 112.868 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -55.91 -16.01 4.13 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.459 0.572 . . . . 0.0 111.823 174.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 95.9 mt . . . . . 0 C--O 1.251 1.139 0 CA-C-O 117.603 -1.189 . . . . 0.0 109.642 177.905 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 . . . . . 0 N--CA 1.471 0.613 0 N-CA-C 110.747 -0.094 . . . . 0.0 110.747 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 63.6 m -75.0 151.61 86.3 Favored Pre-proline 0 C--O 1.233 0.214 0 CA-C-O 119.626 -0.226 . . . . 0.0 111.217 -178.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -61.12 167.64 8.8 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.554 2.836 . . . . 0.0 113.066 177.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 10.9 m 62.16 118.69 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.466 1.506 . . . . 0.0 112.975 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 160' ' ' PRO . . . . . 0.414 ' HD2' ' N ' ' A' ' 27' ' ' SER . 67.1 Cg_endo -67.5 173.09 36.86 Favored 'Cis proline' 0 N--CA 1.455 -0.785 0 N-CA-C 109.167 -1.128 . . . . 0.0 109.167 -10.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 79.5 p -63.46 152.78 37.41 Favored 'General case' 0 N--CA 1.455 -0.186 0 O-C-N 121.983 -0.448 . . . . 0.0 110.451 179.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 162' ' ' TYR . . . . . 0.469 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 10.1 t80 -141.78 136.99 31.25 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.41 0.284 . . . . 0.0 111.439 -178.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 31.3 t -133.15 143.96 50.62 Favored Pre-proline 0 N--CA 1.455 -0.214 0 C-N-CA 123.262 0.625 . . . . 0.0 110.815 178.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -58.6 -11.29 11.07 Favored 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 123.251 2.634 . . . . 0.0 112.653 173.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 69.9 p -89.61 21.08 3.62 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -58.05 155.94 31.55 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 122.646 2.231 . . . . 0.0 110.779 171.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 78.2 p . . . . . 0 C--O 1.252 1.23 0 CA-C-O 116.94 -1.505 . . . . 0.0 111.151 -176.547 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.4 ttp . . . . . 0 N--CA 1.476 0.875 0 CA-C-O 119.96 -0.067 . . . . 0.0 111.053 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -146.01 167.36 23.52 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 123.15 0.58 . . . . 0.0 110.473 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -147.64 146.47 29.35 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.82 0.448 . . . . 0.0 110.165 -178.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -131.88 0.04 3.86 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.603 0.761 . . . . 0.0 110.875 177.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -90.78 33.61 0.93 Allowed 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.005 0.922 . . . . 0.0 110.808 177.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.485 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 17.5 t70 -74.82 -157.04 0.06 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.853 0.861 . . . . 0.0 109.932 179.07 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.485 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 10.9 t80 -55.34 -15.1 2.22 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 121.712 -0.618 . . . . 0.0 111.386 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -55.27 -36.39 66.06 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 123.392 0.677 . . . . 0.0 110.681 175.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 42.9 m-20 -66.55 -44.86 81.21 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 118.952 0.796 . . . . 0.0 109.999 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -65.95 -47.85 73.3 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 117.903 0.32 . . . . 0.0 110.719 -176.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 98.6 t -65.27 -55.57 19.66 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -179.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.64 -31.07 65.91 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -178.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 62.3 m -74.6 -42.01 59.42 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 118.11 0.414 . . . . 0.0 111.051 177.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.7 tp -67.62 -31.08 70.86 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -68.76 -42.34 77.63 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.852 0.861 . . . . 0.0 109.653 174.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.0 t -62.84 -29.36 70.68 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 174.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.401 ' CD2' ' HB3' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -72.75 -36.61 67.74 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.182 0.193 . . . . 0.0 110.538 176.232 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -67.19 -34.23 77.07 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 122.435 0.294 . . . . 0.0 110.217 175.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -74.78 -18.93 60.4 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.722 0.409 . . . . 0.0 111.696 178.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.5 tp -78.01 146.43 35.37 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -147.81 -12.38 0.38 Allowed 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 78.1 p -77.66 -20.25 54.03 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 117.907 0.321 . . . . 0.0 111.775 -178.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 164.73 -143.81 8.83 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 109.953 -1.259 . . . . 0.0 109.953 177.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.2 mm -117.62 145.1 23.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 C-N-CA 125.607 1.563 . . . . 0.0 107.615 -179.21 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.8 m -136.84 138.07 40.4 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.806 0.336 . . . . 0.0 110.588 179.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.76 -21.55 65.35 Favored Glycine 0 CA--C 1.523 0.538 0 CA-C-O 119.11 -0.828 . . . . 0.0 112.751 -178.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 59.6 p -66.19 -45.67 80.0 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.838 1.319 . . . . 0.0 110.907 -175.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.401 ' HB3' ' CD2' ' A' ' 17' ' ' PHE . 8.4 mpt_? -68.06 -41.47 81.95 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 74.3 mt -61.68 -39.49 83.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.2 mmtt -63.57 -45.55 89.92 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.556 0.742 . . . . 0.0 110.759 179.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.59 -39.09 91.21 Favored 'General case' 0 C--N 1.339 0.125 0 CA-C-N 118.226 0.466 . . . . 0.0 111.715 179.325 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 93.0 mt -65.79 -53.86 34.71 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 119.408 -0.33 . . . . 0.0 111.249 -179.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.419 HG21 ' HB2' ' A' ' 71' ' ' SER . 41.1 p -57.81 -41.25 81.79 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 118.491 0.587 . . . . 0.0 110.959 177.056 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.1 m -55.85 -57.78 10.63 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.307 179.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -68.67 -31.29 70.3 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 118.993 -1.083 . . . . 0.0 111.777 -175.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.84 -59.2 5.59 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.304 0.502 . . . . 0.0 109.739 174.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.7 mp -72.06 -14.35 61.84 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -177.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -57.76 -26.73 62.27 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -179.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -151.97 -24.4 0.18 Allowed 'General case' 0 C--N 1.339 0.135 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -177.288 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 25.8 mm 44.2 73.06 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-O 121.708 0.766 . . . . 0.0 111.186 -177.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -147.89 22.19 1.11 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.936 0.894 . . . . 0.0 109.556 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.558 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.3 pt -148.51 35.46 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 C-N-CA 124.562 1.145 . . . . 0.0 109.354 -170.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.416 ' N ' ' CD ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -50.99 -55.5 17.05 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 123.887 0.875 . . . . 0.0 113.262 -176.015 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 57.5 p -75.61 -28.32 58.82 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -173.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.641 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -79.51 -45.82 18.59 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -179.833 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 14.8 mt -55.69 -50.26 68.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 118.019 0.372 . . . . 0.0 110.169 172.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 12.9 mm -66.74 -50.2 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.225 0 CA-C-O 119.341 -0.361 . . . . 0.0 111.894 -176.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.4 m -57.07 -34.28 68.12 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 118.962 0.801 . . . . 0.0 110.491 178.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.3 tp -70.06 -45.02 67.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -179.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 38.2 pt -72.01 -32.57 44.37 Favored 'Isoleucine or valine' 0 C--N 1.341 0.202 0 CA-C-N 119.472 1.033 . . . . 0.0 111.848 -179.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 92.7 mt -66.53 -48.46 80.42 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -63.8 -25.81 68.34 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.876 177.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -66.37 -43.57 85.6 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 173.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.593 ' HG ' ' CB ' ' A' ' 65' ' ' SER . 17.5 m -59.36 -38.07 79.48 Favored 'General case' 0 C--N 1.341 0.229 0 O-C-N 122.15 -0.344 . . . . 0.0 110.645 174.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -68.17 -43.17 78.79 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.35 1.06 . . . . 0.0 112.859 -177.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 73.4 mt -89.55 -15.26 33.3 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -173.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 86.2 m -104.11 159.13 30.33 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -171.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -57.11 177.45 0.19 Allowed 'Trans proline' 0 N--CA 1.46 -0.468 1 C-N-CA 125.524 4.149 . . . . 0.0 115.071 179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.429 ' HB3' ' HE3' ' A' ' 115' ' ' LYS . 72.3 m-20 -58.06 -47.26 83.68 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.19 1.396 . . . . 0.0 112.873 -178.024 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.9 m -60.06 -25.14 65.13 Favored 'General case' 0 N--CA 1.457 -0.096 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 6.2 m80 -86.92 -14.8 40.81 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.707 -0.663 . . . . 0.0 111.172 178.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -72.87 -43.53 62.45 Favored 'General case' 0 C--N 1.342 0.245 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 170.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.2 tp -65.61 -45.4 83.28 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.869 174.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.93 -42.37 98.22 Favored Glycine 0 C--N 1.336 0.534 0 N-CA-C 111.294 -0.723 . . . . 0.0 111.294 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.593 ' CB ' ' HG ' ' A' ' 54' ' ' SER . 89.3 p -67.18 -35.55 79.88 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 117.623 0.712 . . . . 0.0 110.292 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 33.7 mt -60.65 -39.01 86.75 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 119.267 -0.973 . . . . 0.0 110.285 173.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -67.31 -35.72 80.01 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.476 1.035 . . . . 0.0 111.772 176.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 87.2 mt -69.03 -45.68 79.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 O-C-N 121.705 -0.622 . . . . 0.0 111.144 176.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 72.9 mt -63.24 -32.94 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 C-N-CA 123.619 0.768 . . . . 0.0 109.263 177.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -71.42 -40.43 70.46 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.188 0.595 . . . . 0.0 110.44 177.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.419 ' HB2' HG21 ' A' ' 33' ' ' THR . 98.6 p -69.45 -54.37 14.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 119.165 0.893 . . . . 0.0 110.523 -177.336 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 39.7 mt -65.07 -33.83 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 117.76 0.255 . . . . 0.0 110.555 176.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.57 -53.01 38.01 Favored Glycine 0 C--N 1.337 0.626 0 N-CA-C 111.909 -0.476 . . . . 0.0 111.909 -179.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.435 ' NH2' ' C ' ' B' ' 166' ' ' SEP . 6.3 mtp-105 -66.49 -36.13 81.98 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 117.308 0.554 . . . . 0.0 110.445 178.397 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.45 -45.95 81.79 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 178.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.8 m-30 -62.94 -44.87 94.89 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 175.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.1 tp -55.96 -44.89 78.92 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 -177.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -69.64 -39.98 76.8 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.806 178.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -70.26 -15.02 62.85 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -178.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.6 t -107.48 -19.09 13.68 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.876 0.762 . . . . 0.0 111.928 173.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 -84.1 -41.83 16.71 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 123.026 0.53 . . . . 0.0 111.697 177.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 37.4 m -110.05 -6.06 15.24 Favored 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -173.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -140.65 165.95 26.08 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.673 0.389 . . . . 0.0 110.31 -177.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 49.3 m -145.54 160.14 42.08 Favored 'General case' 0 CA--C 1.528 0.135 0 C-N-CA 123.279 0.631 . . . . 0.0 110.222 -179.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -150.99 158.87 44.69 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 13.7 t 58.47 178.18 0.07 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.42 1.088 . . . . 0.0 113.023 -178.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 78.1 p -119.05 6.5 11.31 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 124.128 0.971 . . . . 0.0 110.963 179.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 54.0 m -137.41 163.08 31.91 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.901 0.88 . . . . 0.0 109.408 178.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -134.51 9.09 3.67 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 122.336 0.254 . . . . 0.0 111.517 -177.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.431 ' N ' ' CD ' ' A' ' 91' ' ' PRO . 65.1 tttp -72.7 -40.15 6.3 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-O 118.432 -0.794 . . . . 0.0 112.842 -178.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 90' ' ' LYS . 31.5 Cg_exo -62.84 -21.92 73.47 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 122.402 2.068 . . . . 0.0 112.976 178.074 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 75.28 152.92 3.61 Favored Glycine 0 CA--C 1.53 0.98 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 -176.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -156.62 -154.92 0.5 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.356 0.662 . . . . 0.0 110.226 -179.424 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.8 p -50.49 -29.49 10.59 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -176.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.22 -45.73 86.95 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.851 0.75 . . . . 0.0 109.872 175.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 27.8 m80 -68.4 -28.6 67.24 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.311 177.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.25 -46.26 81.26 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 178.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 95.0 mt -63.32 -42.73 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.077 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 175.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -61.81 -33.0 73.35 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 122.359 -0.213 . . . . 0.0 111.261 179.115 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.8 m -74.35 -41.09 61.63 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.552 -0.261 . . . . 0.0 110.96 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 45.5 mt -60.87 -31.05 70.52 Favored 'General case' 0 C--O 1.226 -0.158 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 173.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.8 -14.4 9.89 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-O 119.021 -0.877 . . . . 0.0 113.813 178.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -103.41 -4.93 23.44 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.177 1.488 . . . . 0.0 112.371 -179.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 32.4 m -123.18 -18.18 4.43 Favored 'Isoleucine or valine' 0 C--N 1.339 0.141 0 C-N-CA 122.824 0.45 . . . . 0.0 111.964 -179.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.8 tp -50.94 -25.2 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 C-N-CA 123.984 0.913 . . . . 0.0 112.601 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -64.86 -49.15 71.67 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 118.079 0.399 . . . . 0.0 111.52 178.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -69.6 -39.85 77.0 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 -177.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 10.7 mp -66.33 -50.91 61.98 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.189 -176.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 65.8 mt -63.99 -60.75 2.87 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 118.767 -0.635 . . . . 0.0 109.78 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 89.4 p -54.88 -41.91 71.45 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 118.622 -1.231 . . . . 0.0 112.318 -172.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -69.79 -40.68 75.86 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-N 119.413 1.006 . . . . 0.0 111.385 178.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.34 -42.62 96.06 Favored 'General case' 0 N--CA 1.457 -0.102 0 CA-C-N 118.531 0.605 . . . . 0.0 110.618 -179.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -38.57 53.53 Favored 'Isoleucine or valine' 0 C--N 1.338 0.093 0 C-N-CA 120.003 -0.679 . . . . 0.0 111.636 178.58 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.99 -25.36 66.27 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 119.607 -0.837 . . . . 0.0 110.094 178.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.429 ' HE3' ' HB3' ' A' ' 59' ' ' ASP . 7.8 tmtt? -75.32 -23.12 57.25 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 125.018 1.327 . . . . 0.0 111.144 175.401 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 55.7 p -86.14 159.68 19.46 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -170.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.7 p30 -102.33 -175.02 2.71 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 170.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -55.75 -39.01 70.57 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.996 0.816 . . . . 0.0 112.445 -177.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -70.73 -46.4 63.1 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 121.54 -0.725 . . . . 0.0 110.45 -178.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 35.9 m170 -72.37 -32.49 66.48 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 119.106 -0.474 . . . . 0.0 111.257 -178.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -37.65 82.79 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 176.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -62.67 -41.94 99.35 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 110.248 -0.279 . . . . 0.0 110.248 177.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -61.79 -41.5 97.81 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 117.827 0.285 . . . . 0.0 111.072 176.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.5 mt -69.51 -39.02 78.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 CA-C-N 118.004 0.366 . . . . 0.0 110.196 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 37.9 ttt180 -63.86 -40.74 97.27 Favored 'General case' 0 C--O 1.23 0.068 0 C-N-CA 122.56 0.344 . . . . 0.0 110.47 178.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 16.0 tmm? -68.01 -41.97 81.38 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 122.701 0.4 . . . . 0.0 110.253 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.1 tt -60.34 -43.62 96.27 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 176.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 86.2 mt -70.8 -30.27 66.68 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 119.524 -0.274 . . . . 0.0 111.468 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -66.8 -40.76 88.22 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.334 0.515 . . . . 0.0 109.96 177.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.2 mt -69.43 -36.92 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 176.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 57.3 t90 -63.68 -35.64 81.2 Favored 'General case' 0 N--CA 1.455 -0.204 0 O-C-N 122.358 -0.214 . . . . 0.0 110.436 178.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -72.38 -38.57 68.46 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 176.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 22.9 tpp180 -67.2 -27.64 67.42 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 122.345 0.258 . . . . 0.0 111.211 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 63.5 m -74.18 -13.96 60.88 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 123.193 0.597 . . . . 0.0 111.979 178.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 76.05 -179.35 47.78 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 -177.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.469 ' HG ' ' H ' ' A' ' 138' ' ' GLN . 40.1 tp -150.12 148.95 29.59 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 122.406 -0.467 . . . . 0.0 109.914 -179.033 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -132.78 15.89 4.32 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.414 0.686 . . . . 0.0 111.107 -178.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . 0.469 ' H ' ' HG ' ' A' ' 136' ' ' LEU . 24.0 mp0 -127.75 163.85 23.43 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 124.392 1.077 . . . . 0.0 108.844 178.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -69.32 -54.17 15.95 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-O 119.241 -0.409 . . . . 0.0 111.405 -176.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 30.7 m 41.57 -151.64 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.246 1.018 . . . . 0.0 112.6 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -140.19 148.76 42.05 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 174.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.471 HD22 ' H ' ' A' ' 142' ' ' LEU . 1.9 pt? -109.47 -7.43 15.17 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 122.781 0.432 . . . . 0.0 111.856 179.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 52.9 p-10 -101.41 7.62 42.53 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.779 0.832 . . . . 0.0 111.399 178.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . 0.485 ' C ' ' H ' ' A' ' 146' ' ' ARG . . . -45.65 -33.78 3.09 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 126.258 1.823 . . . . 0.0 113.068 -173.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.576 HD12 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -69.67 18.52 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 C-N-CA 123.119 0.567 . . . . 0.0 111.802 176.123 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.485 ' H ' ' C ' ' A' ' 144' ' ' ALA . 82.5 mtp180 48.5 51.28 15.61 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 123.397 0.679 . . . . 0.0 109.719 -172.412 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 14.2 t 69.45 161.0 0.2 Allowed 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.669 1.188 . . . . 0.0 112.769 -174.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -55.63 -15.23 2.74 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 115.781 1.771 . . . . 0.0 115.781 -168.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 76.6 m -49.3 -43.45 43.32 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 119.791 1.178 . . . . 0.0 111.164 -175.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -53.24 -87.37 0.0 OUTLIER 'General case' 0 C--O 1.228 -0.034 0 C-N-CA 126.399 1.88 . . . . 0.0 113.646 -173.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -82.4 -14.56 55.0 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -178.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 34.8 mtm -110.03 -11.48 14.62 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 -168.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -110.18 -14.65 14.15 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 120.18 1.355 . . . . 0.0 112.273 174.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 83.9 mt . . . . . 0 C--O 1.252 1.217 0 CA-C-O 117.511 -1.233 . . . . 0.0 110.738 179.159 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 . . . . . 0 N--CA 1.478 0.929 0 N-CA-C 110.656 -0.127 . . . . 0.0 110.656 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 156' ' ' SER . . . . . 0.415 ' N ' ' HD2' ' B' ' 157' ' ' PRO . 30.5 m -93.7 -45.21 0.3 Allowed Pre-proline 0 CA--C 1.533 0.317 0 CA-C-O 118.601 -0.714 . . . . 0.0 112.31 177.491 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . 0.415 ' HD2' ' N ' ' B' ' 156' ' ' SER . 96.3 Cg_endo -76.49 178.69 7.23 Favored 'Trans proline' 0 N--CA 1.454 -0.849 0 C-N-CA 122.441 2.094 . . . . 0.0 110.119 175.474 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 5.2 m 56.86 42.57 26.28 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.873 0.469 . . . . 0.0 110.718 -177.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 160' ' ' PRO . . . . . 0.5 ' HG2' ' H ' ' B' ' 161' ' ' SER . 58.6 Cg_endo -67.89 -58.5 0.14 OUTLIER 'Cis proline' 0 N--CA 1.456 -0.687 0 N-CA-C 110.452 -0.634 . . . . 0.0 110.452 -4.297 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 161' ' ' SER . . . . . 0.5 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 36.8 t -171.55 141.13 1.46 Allowed 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.695 1.198 . . . . 0.0 108.415 174.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -156.54 133.31 10.26 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 118.362 0.528 . . . . 0.0 112.12 174.117 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 25.8 t -134.67 144.63 51.53 Favored Pre-proline 0 N--CA 1.454 -0.228 0 C-N-CA 123.765 0.826 . . . . 0.0 110.76 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -66.65 -1.62 6.12 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.257 2.638 . . . . 0.0 111.638 177.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 34.9 p -72.19 -23.53 61.27 Favored 'General case' 0 C--N 1.338 0.093 0 O-C-N 121.845 -0.534 . . . . 0.0 112.042 177.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 166' ' ' SEP . . . . . 0.435 ' C ' ' NH2' ' A' ' 74' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -69.21 166.35 27.2 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 123.869 3.046 . . . . 0.0 112.243 177.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 43.9 m . . . . . 0 C--O 1.251 1.176 0 CA-C-O 117.172 -1.394 . . . . 0.0 112.035 -179.388 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.3 tpp . . . . . 0 N--CA 1.475 0.798 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -149.05 148.85 30.19 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 123.013 0.525 . . . . 0.0 109.915 179.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -141.18 169.37 17.73 Favored 'General case' 0 CA--C 1.527 0.089 0 C-N-CA 123.434 0.694 . . . . 0.0 109.726 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -139.56 161.24 37.98 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.089 0.556 . . . . 0.0 110.219 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -140.34 12.08 2.36 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.611 0.764 . . . . 0.0 111.251 -175.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -91.25 -123.12 0.07 Allowed 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -57.11 -17.81 12.21 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.109 0.413 . . . . 0.0 111.196 176.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.4 tp60 -56.61 -45.31 81.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.218 -0.42 . . . . 0.0 110.31 175.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -57.51 -39.98 77.71 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.306 176.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -64.35 -54.04 39.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.888 0.767 . . . . 0.0 110.766 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 59.4 t -63.5 -50.44 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.179 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 -178.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.72 -32.26 69.03 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 123.268 0.627 . . . . 0.0 111.432 -179.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 52.3 m -72.27 -43.91 63.6 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 122.025 -0.422 . . . . 0.0 110.145 176.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 21.0 tp -64.73 -29.33 70.31 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 120.426 -0.51 . . . . 0.0 109.999 179.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -70.44 -41.81 72.35 Favored 'General case' 0 C--N 1.338 0.074 0 C-N-CA 123.667 0.787 . . . . 0.0 110.57 175.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.9 p -63.96 -29.0 70.2 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.067 174.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -33.41 63.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.316 0.647 . . . . 0.0 110.241 174.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -67.67 -38.19 83.39 Favored 'General case' 0 C--N 1.339 0.123 0 C-N-CA 123.384 0.674 . . . . 0.0 110.514 178.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -77.3 -7.58 56.24 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 122.379 0.272 . . . . 0.0 110.643 175.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 18.2 tp 53.25 49.4 19.93 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 124.467 1.107 . . . . 0.0 111.427 179.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -69.0 -6.28 26.91 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 89.0 p -149.78 162.8 39.55 Favored 'General case' 0 CA--C 1.528 0.126 0 O-C-N 122.061 -0.4 . . . . 0.0 111.0 -179.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.86 66.06 3.92 Favored Glycine 0 C--N 1.337 0.614 0 N-CA-C 111.211 -0.756 . . . . 0.0 111.211 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.4 mm 56.66 37.49 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 C-N-CA 123.452 0.701 . . . . 0.0 110.699 -177.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.437 ' HG ' ' P ' ' B' ' 159' ' ' SEP . 47.0 t -59.5 137.73 57.92 Favored 'General case' 0 C--O 1.23 0.073 0 CA-C-O 120.968 0.413 . . . . 0.0 111.719 -175.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.95 -23.1 67.3 Favored Glycine 0 CA--C 1.526 0.721 0 CA-C-O 119.27 -0.739 . . . . 0.0 113.715 -173.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.467 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 38.5 t -59.01 -40.82 86.12 Favored 'General case' 0 N--CA 1.458 -0.065 0 CA-C-N 118.658 1.229 . . . . 0.0 110.633 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -69.45 -39.05 78.01 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -178.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 69.4 mt -65.61 -36.19 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -69.17 -36.06 76.97 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 119.459 -0.305 . . . . 0.0 111.369 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.467 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -65.85 -44.48 85.37 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 118.332 0.514 . . . . 0.0 110.342 174.626 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.7 mt -62.56 -52.33 63.86 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 122.291 -0.256 . . . . 0.0 110.957 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.404 HG22 ' HB2' ' A' ' 71' ' ' SER . 27.3 p -59.77 -50.72 72.7 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 118.413 0.552 . . . . 0.0 111.936 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.3 t -61.26 -45.13 95.76 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 120.092 -0.643 . . . . 0.0 111.623 -174.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -75.63 -21.46 57.7 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -178.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.06 -57.12 8.45 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 119.172 0.897 . . . . 0.0 109.031 167.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.3 mp -69.05 -14.75 63.21 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -177.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -64.94 -16.83 63.78 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.991 0.814 . . . . 0.0 113.065 178.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -140.4 -41.63 0.42 Allowed 'General case' 0 C--N 1.34 0.185 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -178.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 44.8 mm 43.06 67.0 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-O 122.352 1.072 . . . . 0.0 111.07 -172.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -147.34 20.65 1.21 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 114.709 -1.132 . . . . 0.0 108.865 179.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.607 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.38 33.85 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 C-N-CA 125.157 1.383 . . . . 0.0 109.456 -171.471 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.485 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.3 OUTLIER -49.57 -55.64 12.77 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -177.131 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 83.6 p -75.38 -24.73 57.28 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -173.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.607 ' HE2' ' HA ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -84.95 -42.72 14.68 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 -179.511 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 30.8 mt -56.21 -52.82 46.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 118.277 0.489 . . . . 0.0 109.752 171.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 15.4 mm -66.17 -48.94 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 CA-C-O 119.335 -0.364 . . . . 0.0 111.643 -177.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.0 t -56.53 -37.15 70.08 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 119.891 -0.724 . . . . 0.0 110.101 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.3 tp -70.55 -40.19 73.51 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 118.624 -0.703 . . . . 0.0 112.782 -177.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.8 pt -73.67 -37.52 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 119.775 1.17 . . . . 0.0 111.965 178.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 93.9 mt -63.4 -49.2 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.099 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -59.41 -41.43 89.48 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.855 177.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -55.73 -40.12 72.04 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 176.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.6 t -68.0 -53.63 24.53 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 179.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -68.63 -24.6 64.58 Favored 'General case' 0 C--O 1.228 -0.074 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -172.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 47.1 mt -80.56 -15.89 55.54 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 83.1 m -121.74 164.26 26.07 Favored Pre-proline 0 CA--C 1.536 0.426 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -169.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_exo -55.57 -177.83 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.407 1 C-N-CA 126.001 4.467 . . . . 0.0 116.072 -179.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -56.19 -40.44 73.97 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 125.611 1.565 . . . . 0.0 113.427 -176.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 74.9 m -61.5 -23.1 65.67 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 19.3 m80 -87.59 -23.63 24.24 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 118.906 -0.568 . . . . 0.0 110.928 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -67.18 -42.21 84.61 Favored 'General case' 0 C--N 1.343 0.321 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 169.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.7 tp -66.84 -51.99 48.92 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 120.915 0.388 . . . . 0.0 110.365 177.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.43 -39.65 90.91 Favored Glycine 0 C--N 1.336 0.574 0 N-CA-C 110.246 -1.142 . . . . 0.0 110.246 178.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 40.1 t -63.24 -45.65 90.6 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 117.483 0.641 . . . . 0.0 110.767 178.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 33.9 mt -57.93 -38.2 75.5 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 118.854 0.752 . . . . 0.0 111.403 178.146 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -74.45 -31.51 62.29 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 119.492 -0.883 . . . . 0.0 112.16 178.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 81.0 mt -73.47 -41.65 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 118.92 0.782 . . . . 0.0 110.669 176.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.8 mt -62.71 -40.06 87.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 176.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -66.8 -42.77 85.42 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 119.278 -0.391 . . . . 0.0 110.959 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.404 ' HB2' HG22 ' A' ' 33' ' ' THR . 84.1 p -66.93 -56.52 9.88 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 118.338 0.517 . . . . 0.0 111.148 -174.789 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 38.3 mt -65.19 -31.17 52.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 176.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.89 -52.92 37.64 Favored Glycine 0 CA--C 1.522 0.489 0 CA-C-O 119.751 -0.471 . . . . 0.0 112.191 -179.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.647 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -72.28 -31.1 65.44 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 117.992 0.896 . . . . 0.0 110.824 -179.242 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.74 -46.61 74.87 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 176.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -62.32 -45.23 94.15 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 175.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -57.34 -43.08 83.12 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -178.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -67.16 -41.17 86.45 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 121.38 -0.128 . . . . 0.0 110.902 178.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -64.58 -40.41 95.48 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 119.51 -0.281 . . . . 0.0 111.227 -178.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.3 t -82.78 -18.85 39.14 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 118.192 0.451 . . . . 0.0 111.496 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 56.6 ttp180 -76.23 -31.25 58.29 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 122.078 -0.389 . . . . 0.0 110.417 171.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.5 t -76.92 -33.72 57.72 Favored 'General case' 0 C--O 1.231 0.129 0 C-N-CA 122.764 0.426 . . . . 0.0 111.94 -179.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -153.73 154.12 33.47 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 80.2 p -116.06 160.42 20.33 Favored 'General case' 0 C--O 1.231 0.091 0 C-N-CA 122.981 0.512 . . . . 0.0 111.586 -177.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 -140.4 172.4 12.78 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.714 0.805 . . . . 0.0 109.772 -178.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.8 m -126.34 159.36 33.39 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 122.825 0.45 . . . . 0.0 110.746 -178.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 31.9 m -81.52 12.3 3.87 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.417 0.687 . . . . 0.0 111.929 -178.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.8 p -86.11 -1.66 57.6 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.249 0.62 . . . . 0.0 112.239 -179.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -132.19 -15.24 2.93 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.594 0.357 . . . . 0.0 111.572 178.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -146.99 153.72 45.93 Favored Pre-proline 0 C--N 1.342 0.249 0 C-N-CA 123.685 0.794 . . . . 0.0 109.722 179.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -72.48 -13.23 27.6 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.959 2.439 . . . . 0.0 111.138 176.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 163.98 172.4 31.42 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 109.744 -1.342 . . . . 0.0 109.744 178.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -153.68 -156.97 0.74 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 117.155 0.478 . . . . 0.0 110.528 178.247 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 26.7 p -47.91 -32.64 6.57 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 -176.204 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.76 -46.9 80.2 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.582 -0.699 . . . . 0.0 110.137 176.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 67.2 m80 -67.24 -28.78 68.33 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.299 0.639 . . . . 0.0 110.202 177.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.22 -45.45 80.64 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 122.434 0.294 . . . . 0.0 110.546 177.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 93.3 mt -62.89 -42.41 96.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 175.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -61.48 -33.69 74.2 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.779 -0.191 . . . . 0.0 111.389 178.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.3 m -73.21 -42.29 62.81 Favored 'General case' 0 C--O 1.227 -0.084 0 C-N-CA 122.332 0.253 . . . . 0.0 111.185 179.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 44.9 mt -60.85 -30.78 70.32 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 173.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.17 -14.65 19.22 Favored Glycine 0 CA--C 1.534 1.237 0 CA-C-O 118.826 -0.986 . . . . 0.0 113.81 178.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -100.59 -6.92 24.6 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 119.061 1.431 . . . . 0.0 111.805 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 35.3 m -121.15 -18.31 5.35 Favored 'Isoleucine or valine' 0 C--N 1.338 0.108 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.7 tp -53.69 -26.03 12.74 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 C-N-CA 122.92 0.488 . . . . 0.0 111.817 179.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.406 ' HG3' ' H ' ' A' ' 107' ' ' GLU . 16.4 pt20 -59.49 -61.42 2.64 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 122.77 0.428 . . . . 0.0 110.614 176.199 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.406 ' H ' ' HG3' ' A' ' 106' ' ' GLN . 12.1 pt-20 -71.13 -28.27 64.17 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.929 -0.482 . . . . 0.0 111.332 -179.063 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.51 -55.67 25.25 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.38 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 59.9 mt -62.95 -58.14 8.36 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 118.44 -0.791 . . . . 0.0 110.428 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 91.1 p -55.27 -43.13 74.43 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 118.857 -1.137 . . . . 0.0 112.133 -172.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -70.69 -41.67 71.7 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 119.237 0.926 . . . . 0.0 111.077 177.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.17 -37.25 71.82 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 119.157 -0.449 . . . . 0.0 111.359 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -80.91 -35.31 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.101 0 C-N-CA 119.572 -0.851 . . . . 0.0 112.135 175.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.09 -25.4 65.31 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 119.813 -0.755 . . . . 0.0 111.125 -178.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.52 -14.3 38.08 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.293 0.637 . . . . 0.0 111.225 177.008 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 46.3 p -71.42 156.49 39.41 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -170.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 68.4 m-20 -96.36 177.89 5.55 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 106.908 -1.515 . . . . 0.0 106.908 168.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -56.26 -45.1 80.19 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.738 0.699 . . . . 0.0 111.149 -177.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -64.99 -41.13 95.68 Favored 'General case' 0 CA--C 1.53 0.173 0 O-C-N 121.974 -0.454 . . . . 0.0 110.481 -179.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 31.6 m170 -69.42 -37.35 77.41 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 119.295 -0.383 . . . . 0.0 110.882 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -41.16 96.83 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 174.551 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -64.4 -39.54 94.06 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.568 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -64.21 -41.08 97.21 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 121.15 -0.22 . . . . 0.0 111.19 176.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.9 mt -69.8 -37.39 73.34 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.087 0 CA-C-N 118.281 0.492 . . . . 0.0 109.719 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 80.5 ttt-85 -64.8 -38.1 89.84 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 177.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 65.6 ttp -66.05 -40.76 91.23 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 55.1 tp -60.4 -44.62 95.51 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 110.53 -0.174 . . . . 0.0 110.53 178.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.9 mt -68.06 -35.59 78.47 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 122.094 0.158 . . . . 0.0 111.028 179.039 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -65.72 -36.01 82.38 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 110.332 -0.248 . . . . 0.0 110.332 178.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 88.2 mt -69.81 -42.61 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 176.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 48.9 m0 -64.39 -29.77 70.82 Favored 'General case' 0 C--O 1.226 -0.169 0 O-C-N 122.303 -0.248 . . . . 0.0 110.88 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -78.81 -34.52 45.27 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 122.102 -0.374 . . . . 0.0 110.784 176.202 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 8.4 tpm_? -73.54 -25.92 60.62 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 122.942 0.497 . . . . 0.0 111.598 -179.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 83.1 p -58.83 -23.71 60.94 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 64.43 -170.22 22.43 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 123.599 0.618 . . . . 0.0 112.599 177.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.2 mm? 55.9 -176.4 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.773 1.229 . . . . 0.0 112.177 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 53.71 -166.94 0.07 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.257 1.023 . . . . 0.0 112.809 178.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -62.22 156.28 22.38 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.656 0.783 . . . . 0.0 110.115 178.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -134.6 167.59 20.52 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 123.156 0.582 . . . . 0.0 110.61 -177.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 25.2 m 56.5 19.28 4.03 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.131 0.973 . . . . 0.0 113.59 -179.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -93.98 1.47 56.26 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.804 0.441 . . . . 0.0 111.128 178.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -76.94 5.76 7.41 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.327 0.651 . . . . 0.0 111.447 -176.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -58.23 -10.58 2.06 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.68 0.792 . . . . 0.0 112.623 179.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . 0.509 ' C ' ' H ' ' A' ' 146' ' ' ARG . . . -39.76 -32.83 0.16 Allowed 'General case' 0 C--N 1.342 0.267 0 C-N-CA 126.989 2.116 . . . . 0.0 113.099 177.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.414 ' O ' ' CD1' ' A' ' 150' ' ' PHE . 0.2 OUTLIER -67.84 16.81 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-N 118.035 0.379 . . . . 0.0 111.809 177.269 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.509 ' H ' ' C ' ' A' ' 144' ' ' ALA . 83.8 mtp180 51.59 49.9 19.91 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.29 0.636 . . . . 0.0 109.611 -173.428 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 16.1 t 69.95 147.85 0.07 Allowed 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.741 1.216 . . . . 0.0 112.887 -174.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -41.38 -36.81 0.9 Allowed 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 -166.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 69.3 m -43.57 -29.07 0.44 Allowed 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 -168.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . 0.414 ' CD1' ' O ' ' A' ' 145' ' ' ILE . 14.0 m-85 -49.76 -82.29 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.982 1.713 . . . . 0.0 113.317 179.405 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -82.74 -13.41 56.38 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 122.213 -0.305 . . . . 0.0 111.534 178.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 18.6 mmt -97.07 -21.41 17.39 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 -169.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -77.86 -18.84 55.79 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 119.807 1.185 . . . . 0.0 113.149 -175.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 2.1 pt? . . . . . 0 C--O 1.25 1.096 0 CA-C-O 117.592 -1.194 . . . . 0.0 111.335 -177.979 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 . . . . . 0 N--CA 1.472 0.638 0 N-CA-C 110.67 -0.122 . . . . 0.0 110.67 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 156' ' ' SER . . . . . 0.624 ' H ' ' CD ' ' B' ' 157' ' ' PRO . 42.8 m -133.46 -27.68 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.471 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -179.245 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . 0.624 ' CD ' ' H ' ' B' ' 156' ' ' SER . 65.9 Cg_endo -78.9 173.48 13.5 Favored 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 122.033 1.822 . . . . 0.0 111.217 179.586 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 64.2 p -127.36 147.54 50.26 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 123.187 0.595 . . . . 0.0 110.304 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 159' ' ' SEP . . . . . 0.437 ' P ' ' HG ' ' A' ' 25' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -72.44 176.77 38.24 Favored 'Cis proline' 0 N--CA 1.454 -0.84 0 N-CA-C 109.806 -0.882 . . . . 0.0 109.806 -5.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 47.5 m -68.01 155.18 40.07 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 174.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 162' ' ' TYR . . . . . 0.416 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 15.8 t80 -139.95 127.42 21.5 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 120.574 0.225 . . . . 0.0 110.938 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.9 t -124.17 124.54 25.88 Favored Pre-proline 0 C--O 1.234 0.276 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.543 177.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.18 -12.66 35.8 Favored 'Trans proline' 0 N--CA 1.449 -1.143 0 C-N-CA 122.386 2.057 . . . . 0.0 109.828 -179.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 22.5 m -59.88 -23.33 63.37 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 123.536 0.735 . . . . 0.0 111.853 -174.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -57.56 153.91 39.31 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 124.407 3.405 . . . . 0.0 112.073 177.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 21.6 m . . . . . 0 C--O 1.251 1.177 0 CA-C-O 117.617 -1.182 . . . . 0.0 111.114 -178.041 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -146.2 168.21 21.58 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.183 0.593 . . . . 0.0 110.481 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -143.4 152.76 41.95 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.48 0.712 . . . . 0.0 109.577 -179.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -137.95 164.65 28.49 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 122.843 0.457 . . . . 0.0 110.875 -178.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -122.26 17.96 10.68 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.589 0.756 . . . . 0.0 111.073 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -82.45 -141.22 0.05 Allowed 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -55.41 -15.42 2.62 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.179 0.592 . . . . 0.0 111.714 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 34.3 tp60 -55.27 -41.26 71.99 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.137 0.575 . . . . 0.0 110.362 176.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -63.96 -37.89 89.08 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 118.246 0.475 . . . . 0.0 110.615 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -64.72 -55.38 20.29 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.536 0.607 . . . . 0.0 109.899 179.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 66.5 t -60.72 -53.08 53.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -177.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.53 -35.73 70.66 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.118 0.567 . . . . 0.0 111.627 -178.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 77.5 m -69.12 -44.95 71.36 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-N 118.352 0.524 . . . . 0.0 110.452 177.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 20.7 tp -66.46 -29.16 69.23 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.487 -179.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.4 -45.16 66.52 Favored 'General case' 0 CA--C 1.523 -0.079 0 C-N-CA 123.787 0.835 . . . . 0.0 109.85 177.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 72.8 m -61.44 -29.35 69.89 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 173.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.86 -32.47 61.9 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 120.601 0.238 . . . . 0.0 110.623 175.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -71.61 -31.13 66.57 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 123.348 0.659 . . . . 0.0 110.57 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -70.51 -19.82 62.89 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 122.636 0.374 . . . . 0.0 111.275 177.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 44.3 tp -85.81 144.7 27.58 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.092 0.557 . . . . 0.0 109.845 -179.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -104.99 -21.01 13.36 Favored 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -175.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.1 p -160.45 160.9 32.66 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 122.974 0.509 . . . . 0.0 110.452 179.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.67 139.55 6.29 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 111.083 -0.807 . . . . 0.0 111.083 -179.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.6 mm -109.27 146.35 14.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 C-N-CA 123.988 0.915 . . . . 0.0 108.713 179.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 42.9 t -138.98 121.67 16.37 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.72 -20.08 63.64 Favored Glycine 0 CA--C 1.523 0.562 0 CA-C-O 119.229 -0.762 . . . . 0.0 112.208 -176.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.45 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 47.7 t -65.42 -42.34 92.58 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 118.611 1.205 . . . . 0.0 109.853 177.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.4 mmp_? -60.42 -48.16 82.94 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 176.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.5 mt -63.15 -34.33 66.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.201 -177.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 23.0 mmtp -69.1 -39.67 78.85 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 118.83 -0.605 . . . . 0.0 110.777 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.45 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.3 OUTLIER -65.22 -42.58 93.29 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.359 0.982 . . . . 0.0 110.225 175.296 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.5 mt -62.45 -56.91 13.65 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 122.487 -0.133 . . . . 0.0 110.82 -178.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.446 HG21 ' HB2' ' A' ' 71' ' ' SER . 41.6 p -55.29 -42.97 74.34 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 121.986 -0.447 . . . . 0.0 111.593 176.469 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.9 m -55.37 -55.92 26.06 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 119.279 -0.391 . . . . 0.0 111.131 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -79.07 -18.54 53.24 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -173.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.26 -56.0 8.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 119.041 0.837 . . . . 0.0 109.15 167.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 50.0 mt -72.92 -14.58 61.5 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.913 0.885 . . . . 0.0 113.154 -174.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -55.37 -30.33 60.14 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -178.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -153.1 -20.78 0.15 Allowed 'General case' 0 C--N 1.341 0.214 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 -178.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 35.0 mm 45.75 74.15 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-O 121.837 0.827 . . . . 0.0 111.173 -177.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -134.52 6.74 3.53 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.177 0.991 . . . . 0.0 109.835 178.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.474 HG21 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -142.5 108.64 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 124.888 1.275 . . . . 0.0 108.359 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.599 ' CD ' ' H ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -102.13 -82.77 0.47 Allowed 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -178.54 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.599 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 99.2 p -55.86 -24.48 37.09 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 123.504 0.722 . . . . 0.0 112.569 -174.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.583 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -70.86 -56.42 6.33 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 177.812 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.464 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 6.5 mt -57.52 -40.64 75.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 123.179 0.591 . . . . 0.0 110.556 175.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 14.8 mm -69.68 -51.71 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-O 119.275 -0.393 . . . . 0.0 111.481 -178.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.4 m -60.63 -27.13 67.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 118.821 0.737 . . . . 0.0 110.03 177.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.9 tp -70.39 -45.01 66.83 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 118.72 -0.657 . . . . 0.0 111.778 178.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 25.7 pt -74.91 -33.83 31.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 119.581 1.082 . . . . 0.0 111.437 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.2 mt -65.63 -52.19 53.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -65.18 -29.46 70.28 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.071 178.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -59.13 -42.54 90.87 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 173.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.6 m -58.33 -49.36 77.47 Favored 'General case' 0 C--N 1.338 0.093 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 174.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 52.5 tpt85 -56.15 -30.55 62.35 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.803 0.841 . . . . 0.0 112.486 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 80.3 mt -90.59 -14.59 32.15 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -179.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 50.7 m -97.05 159.01 32.38 Favored Pre-proline 0 CA--C 1.531 0.231 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -171.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -75.79 -139.54 0.02 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.707 1 C-N-CA 125.723 4.282 . . . . 0.0 109.063 172.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -56.12 -19.6 13.96 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.002 0.819 . . . . 0.0 112.125 178.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.8 m -59.46 -25.69 64.61 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.755 0.422 . . . . 0.0 109.961 173.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -55.28 -64.64 0.78 Allowed 'General case' 0 C--N 1.341 0.204 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 172.543 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.412 ' HB3' ' HE2' ' A' ' 62' ' ' LYS . 23.3 ttpt -50.44 -75.68 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.871 -179.305 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 33.0 tp -74.27 -43.14 58.14 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 119.102 -1.039 . . . . 0.0 111.639 -168.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.57 -48.32 44.28 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -174.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.9 m -70.66 -38.61 73.8 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 118.504 -1.278 . . . . 0.0 110.041 -178.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.7 mt -58.26 -42.08 85.69 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 118.293 -1.363 . . . . 0.0 110.826 177.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -68.66 -40.03 80.38 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.324 0.966 . . . . 0.0 112.168 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 79.0 mt -66.89 -42.09 88.52 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-N 118.395 0.543 . . . . 0.0 111.15 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.2 mt -66.89 -29.94 47.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -76.75 -37.85 55.2 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-O 119.041 -0.504 . . . . 0.0 111.975 178.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.446 ' HB2' HG21 ' A' ' 33' ' ' THR . 61.2 p -70.78 -52.68 19.09 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 119.286 0.948 . . . . 0.0 110.324 178.297 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 53.1 mt -67.81 -36.21 75.05 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 178.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.9 -46.79 64.45 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 -178.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 28.2 mtt-85 -63.05 -43.51 98.44 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 117.623 0.711 . . . . 0.0 109.942 176.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.33 -40.54 93.82 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.769 -0.196 . . . . 0.0 110.694 -178.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -63.96 -45.62 88.3 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 175.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.8 tp -57.88 -41.62 82.91 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 -177.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -67.94 -41.36 82.66 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 117.725 0.238 . . . . 0.0 110.397 177.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -60.07 -39.72 87.02 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.877 -0.147 . . . . 0.0 111.074 -177.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 9.3 t -87.31 -20.34 26.94 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 117.995 0.362 . . . . 0.0 111.702 178.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 67.2 ttp85 -71.14 -27.72 63.77 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 118.371 0.532 . . . . 0.0 110.185 174.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.7 t -55.86 -22.59 26.05 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -151.92 125.74 9.05 Favored 'General case' 0 N--CA 1.456 -0.142 0 O-C-N 121.909 -0.495 . . . . 0.0 110.193 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 33.8 t -152.29 162.56 40.97 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.707 0.403 . . . . 0.0 110.695 -179.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -140.88 20.43 2.31 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.549 0.74 . . . . 0.0 110.275 178.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 23.4 m 55.95 13.04 1.01 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.397 1.079 . . . . 0.0 113.409 -177.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 69.1 m -147.21 151.66 37.08 Favored 'General case' 0 C--O 1.23 0.074 0 C-N-CA 123.939 0.896 . . . . 0.0 109.636 178.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.1 m -147.93 153.35 38.94 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 120.755 0.312 . . . . 0.0 110.939 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 50.2 t30 -152.83 142.5 21.92 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 176.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 83.3 tttt 43.64 62.39 9.24 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 123.703 0.801 . . . . 0.0 110.502 -177.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -67.35 164.67 29.71 Favored 'Trans proline' 0 N--CA 1.451 -0.991 0 C-N-CA 123.897 3.064 . . . . 0.0 111.766 -174.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -169.1 -171.66 35.05 Favored Glycine 0 CA--C 1.527 0.784 0 N-CA-C 110.309 -1.116 . . . . 0.0 110.309 -179.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 50.95 -160.25 0.08 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.082 0.953 . . . . 0.0 113.444 177.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 28.6 p -49.3 -30.31 7.25 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -175.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.4 -46.69 79.03 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 118.787 0.722 . . . . 0.0 110.073 177.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 43.0 t60 -69.52 -27.53 65.26 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 121.038 0.447 . . . . 0.0 110.21 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.09 -42.69 79.97 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.185 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.3 mt -64.77 -41.78 93.14 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.163 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 173.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -59.82 -33.3 71.57 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 110.782 -0.081 . . . . 0.0 110.782 178.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 88.6 m -75.57 -42.72 51.41 Favored 'General case' 0 N--CA 1.457 -0.075 0 CA-C-O 119.526 -0.273 . . . . 0.0 111.026 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 49.6 mt -60.54 -29.02 68.87 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 173.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.4 -15.38 31.28 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-O 119.154 -0.803 . . . . 0.0 113.563 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -98.28 -6.28 31.36 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.961 1.38 . . . . 0.0 111.684 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 31.1 m -123.71 -22.68 2.66 Favored 'Isoleucine or valine' 0 C--O 1.23 0.027 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -178.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.0 tp -55.87 -26.49 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 C-N-CA 122.935 0.494 . . . . 0.0 111.44 -177.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -61.93 -59.08 5.65 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.144 0.578 . . . . 0.0 111.198 178.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -73.75 -29.87 62.47 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 122.168 0.187 . . . . 0.0 110.766 -179.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.0 tt -63.03 -56.64 15.21 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 49.5 mt -61.2 -57.98 10.2 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 118.695 -0.669 . . . . 0.0 110.261 176.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 55.9 p -54.84 -44.26 73.76 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 119.605 -0.838 . . . . 0.0 112.053 -172.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -69.04 -42.46 76.31 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-N 119.13 0.877 . . . . 0.0 110.794 177.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.28 -50.89 70.1 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.85 0.46 . . . . 0.0 111.603 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -35.46 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 O-C-N 121.781 -0.575 . . . . 0.0 111.224 179.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.65 -24.6 64.56 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.05 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.62 -14.21 38.04 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.071 0.548 . . . . 0.0 110.827 178.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.417 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 29.5 p -79.46 157.4 27.51 Favored 'General case' 0 N--CA 1.457 -0.102 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 -171.274 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -90.16 173.42 8.18 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 172.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 85.2 mt-30 -55.56 -45.78 77.26 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.772 0.714 . . . . 0.0 111.679 -176.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -63.99 -39.03 93.21 Favored 'General case' 0 N--CA 1.454 -0.244 0 O-C-N 121.719 -0.613 . . . . 0.0 110.404 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.417 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 31.7 m170 -70.83 -45.43 64.56 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.125 -178.148 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -35.95 71.69 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-N 118.839 0.745 . . . . 0.0 109.984 174.542 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.31 -41.99 88.91 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.237 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.6 mtpp -61.57 -44.26 97.35 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.349 175.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 98.0 mt -65.28 -38.23 82.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 43.7 ttt85 -62.26 -39.34 92.57 Favored 'General case' 0 CA--C 1.521 -0.145 0 C-N-CA 122.693 0.397 . . . . 0.0 109.932 177.286 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 51.1 ttp -66.09 -44.03 85.56 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.547 -0.168 . . . . 0.0 110.547 178.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.3 mp -57.83 -46.34 84.86 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 177.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.9 mt -73.66 -32.7 64.13 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -177.052 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -70.27 -35.66 73.9 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 118.673 0.67 . . . . 0.0 110.029 179.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.6 mt -70.8 -40.68 76.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 36.5 t-105 -64.39 -34.65 78.66 Favored 'General case' 0 N--CA 1.456 -0.13 0 O-C-N 122.306 -0.246 . . . . 0.0 110.381 177.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -70.7 -41.07 72.44 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 122.948 0.499 . . . . 0.0 110.481 178.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 63.2 ttp180 -63.9 -41.18 97.77 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.307 0.243 . . . . 0.0 110.616 179.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 59.4 m -77.12 -14.78 59.75 Favored 'General case' 0 CA--C 1.527 0.093 0 C-N-CA 122.608 0.363 . . . . 0.0 111.763 178.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -82.77 -7.36 87.45 Favored Glycine 0 CA--C 1.526 0.765 0 CA-C-O 119.754 -0.47 . . . . 0.0 112.236 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 68.7 mt 53.93 -163.03 0.11 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.851 0.86 . . . . 0.0 111.199 -177.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.407 ' CG ' ' N ' ' A' ' 138' ' ' GLN . 35.4 t80 56.79 -166.51 0.13 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.598 0.759 . . . . 0.0 111.367 -178.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . 0.407 ' N ' ' CG ' ' A' ' 137' ' ' PHE . 54.3 mm-40 -63.68 159.1 19.82 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.071 0.548 . . . . 0.0 111.199 -179.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 47.3 tttp -68.29 169.79 9.91 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 122.879 0.471 . . . . 0.0 110.173 -179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 36.6 m 59.0 43.1 18.21 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 123.051 0.54 . . . . 0.0 110.405 -175.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -63.1 -9.3 10.06 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.619 1.167 . . . . 0.0 111.519 -179.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.2 tp -135.97 132.17 36.03 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 176.482 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 52.9 p-10 -101.22 -5.39 25.62 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -177.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . 0.445 ' C ' ' H ' ' A' ' 146' ' ' ARG . . . -42.86 -38.67 2.25 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 125.39 1.476 . . . . 0.0 113.499 -176.094 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -72.13 27.87 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 C-N-CA 123.66 0.784 . . . . 0.0 112.13 175.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.445 ' H ' ' C ' ' A' ' 144' ' ' ALA . 18.4 mmt85 52.07 21.62 1.61 Allowed 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 124.198 0.999 . . . . 0.0 110.501 -169.477 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 6.0 t 52.35 24.83 3.1 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.964 1.305 . . . . 0.0 114.001 -177.171 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -140.69 -153.18 0.45 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -175.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 35.5 t -41.04 -30.1 0.13 Allowed 'General case' 0 C--N 1.34 0.182 0 C-N-CA 127.447 2.299 . . . . 0.0 115.629 -169.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -31.83 -72.83 0.04 OUTLIER 'General case' 0 C--N 1.34 0.178 0 C-N-CA 124.573 1.149 . . . . 0.0 111.255 -178.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -112.32 -13.89 13.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 118.989 -0.529 . . . . 0.0 111.439 168.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 20.7 mmt -79.84 -9.4 59.66 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.206 0.912 . . . . 0.0 111.977 -177.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 31.3 t70 59.19 0.06 0.17 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 63.6 tp . . . . . 0 C--O 1.25 1.096 0 CA-C-O 117.628 -1.177 . . . . 0.0 109.587 177.276 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 85.6 t80 . . . . . 0 N--CA 1.472 0.649 0 N-CA-C 110.807 -0.071 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 61.9 m -147.44 146.93 26.51 Favored Pre-proline 0 C--N 1.341 0.237 0 C-N-CA 123.183 0.593 . . . . 0.0 109.538 178.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -76.79 163.83 30.89 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 123.654 2.903 . . . . 0.0 111.432 177.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 75.4 p 54.32 147.16 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 127.37 2.268 . . . . 0.0 115.695 177.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -85.14 -165.43 3.67 Favored 'Cis proline' 0 N--CA 1.458 -0.59 0 CA-C-N 121.16 1.45 . . . . 0.0 112.233 3.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 13.0 t -107.26 173.79 6.17 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.876 0.87 . . . . 0.0 111.713 -178.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -131.92 143.06 49.86 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 124.577 1.151 . . . . 0.0 109.265 176.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 26.7 t -121.25 137.07 26.32 Favored Pre-proline 0 N--CA 1.451 -0.386 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 176.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -66.47 -9.74 25.21 Favored 'Trans proline' 0 N--CA 1.447 -1.253 0 C-N-CA 122.912 2.408 . . . . 0.0 111.205 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 71.7 p -74.95 -19.79 59.96 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-O 118.801 -0.619 . . . . 0.0 111.76 -178.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -75.66 169.45 22.28 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 123.723 2.949 . . . . 0.0 110.213 174.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 70.4 m . . . . . 0 C--O 1.252 1.197 0 CA-C-O 117.079 -1.439 . . . . 0.0 110.88 178.612 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.7 mtm . . . . . 0 N--CA 1.476 0.868 0 N-CA-C 111.144 0.054 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 -145.95 150.56 36.29 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.721 0.408 . . . . 0.0 110.266 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -148.84 159.61 44.0 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -135.14 1.59 2.97 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 113.167 0.802 . . . . 0.0 113.167 -176.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.6 p-10 -127.53 21.53 6.55 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.87 0.468 . . . . 0.0 111.88 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -78.75 -153.15 0.07 Allowed 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.029 0.932 . . . . 0.0 110.536 177.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -54.16 -14.49 1.13 Allowed 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.477 0.711 . . . . 0.0 110.58 175.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -54.7 -36.29 64.52 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 123.041 0.537 . . . . 0.0 110.352 174.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -56.76 -48.56 77.57 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-N 119.138 0.881 . . . . 0.0 109.812 176.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -65.3 -50.32 66.15 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 120.408 0.147 . . . . 0.0 111.2 -177.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 62.1 t -64.56 -53.08 46.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 O-C-N 122.368 -0.208 . . . . 0.0 110.488 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.65 -31.54 70.76 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 119.588 -0.244 . . . . 0.0 111.441 -178.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 53.3 m -71.46 -40.97 69.96 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.487 177.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.9 tp -66.37 -33.38 75.59 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -67.4 -42.62 83.0 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.894 0.878 . . . . 0.0 110.079 175.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 66.3 m -63.8 -27.47 69.21 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 174.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -68.99 -39.59 79.26 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 175.199 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -66.73 -30.25 70.43 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 122.614 0.366 . . . . 0.0 111.02 175.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -70.11 -27.55 64.67 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 122.576 0.351 . . . . 0.0 111.663 178.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 8.8 mp -85.53 141.41 29.9 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 175.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -143.38 14.21 1.8 Allowed 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 122.37 0.268 . . . . 0.0 111.67 -176.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 83.1 p -133.89 7.47 3.75 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -174.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 166.95 144.92 4.28 Favored Glycine 0 CA--C 1.524 0.623 0 CA-C-N 118.628 0.649 . . . . 0.0 111.775 179.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 17.1 mm -76.66 152.52 5.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 174.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.3 t -145.1 137.78 26.19 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 118.099 0.409 . . . . 0.0 111.067 -178.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -61.89 -37.97 95.24 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-O 119.267 -0.74 . . . . 0.0 112.793 -176.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.434 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 35.6 t -56.2 -44.06 79.08 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 118.438 1.119 . . . . 0.0 111.419 -173.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? -69.42 -44.85 70.55 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 -178.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 91.1 mt -58.52 -38.49 70.84 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.2 mmtp -73.39 -35.65 65.91 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-O 118.605 -0.712 . . . . 0.0 111.849 -178.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.434 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.1 OUTLIER -65.18 -38.47 90.61 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-N 119.516 1.053 . . . . 0.0 110.095 174.646 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.0 mt -64.06 -55.7 20.3 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 119.386 -0.34 . . . . 0.0 110.802 178.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.403 HG22 ' HB2' ' A' ' 71' ' ' SER . 41.3 p -58.01 -42.42 85.18 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 118.622 0.646 . . . . 0.0 111.066 177.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.3 m -55.65 -58.14 9.05 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 119.101 -0.476 . . . . 0.0 111.057 -179.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -69.12 -31.64 70.47 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 118.74 -1.184 . . . . 0.0 111.367 -175.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.483 ' HB1' ' HH ' ' A' ' 76' ' ' TYR . . . -58.54 -59.81 4.78 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.994 177.359 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.8 mp -68.93 -23.24 64.14 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 122.268 0.227 . . . . 0.0 111.525 -177.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -72.38 -18.77 61.71 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 122.205 -0.309 . . . . 0.0 111.26 176.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -148.6 52.53 0.99 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 117.758 0.254 . . . . 0.0 111.648 -175.142 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 35.8 mm -62.84 80.96 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 121.494 0.664 . . . . 0.0 110.425 172.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -153.28 20.21 0.56 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.421 1.489 . . . . 0.0 108.541 175.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.585 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -148.94 34.89 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 C-N-CA 125.343 1.457 . . . . 0.0 109.114 -171.284 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.462 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -49.28 -55.28 13.22 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -176.408 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 86.6 p -75.97 -24.27 55.4 Favored 'General case' 0 CA--C 1.522 -0.106 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -173.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.612 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -86.0 -39.16 17.15 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 119.286 -0.388 . . . . 0.0 110.108 -179.686 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 24.3 mt -59.11 -51.65 70.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.096 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 170.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 11.5 mm -65.55 -47.26 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-O 119.281 -0.39 . . . . 0.0 111.187 -178.122 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 48.3 t -55.82 -38.29 69.82 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.232 176.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.6 tp -68.54 -43.6 76.34 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 118.954 -0.546 . . . . 0.0 112.458 -177.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 38.5 pt -73.09 -37.31 52.77 Favored 'Isoleucine or valine' 0 C--N 1.343 0.286 0 CA-C-N 119.495 1.043 . . . . 0.0 111.993 -179.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.0 mt -64.26 -50.42 76.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -63.72 -31.05 72.1 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.451 178.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -58.98 -45.19 91.18 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 173.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.9 t -67.94 -31.3 70.94 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 111.656 0.243 . . . . 0.0 111.656 177.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 53.0 tpt85 -71.12 -36.29 72.08 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.911 0.884 . . . . 0.0 112.716 -177.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 78.5 mt -93.77 -14.71 25.93 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 -176.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 92.1 m -104.73 155.85 36.85 Favored Pre-proline 0 C--N 1.331 -0.206 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -171.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -66.11 -176.69 0.66 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 1 C-N-CA 125.349 4.033 . . . . 0.0 114.004 -178.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.405 ' HB3' ' HE3' ' A' ' 115' ' ' LYS . 53.0 m-20 -56.44 -44.44 80.45 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 125.654 1.582 . . . . 0.0 114.367 -172.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.4 p -57.45 -30.27 64.88 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 178.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -86.94 -13.4 44.79 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-O 118.472 -0.775 . . . . 0.0 111.62 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -74.19 -37.5 63.91 Favored 'General case' 0 C--N 1.342 0.252 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 169.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.3 mt -65.07 -51.77 59.52 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.145 173.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.38 -39.28 90.21 Favored Glycine 0 C--N 1.337 0.635 0 N-CA-C 110.323 -1.111 . . . . 0.0 110.323 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.5 t -55.71 -59.21 5.18 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 176.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 32.5 mt -49.39 -43.47 44.33 Favored 'General case' 0 C--O 1.228 -0.054 0 CA-C-O 118.837 -0.601 . . . . 0.0 111.625 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -66.96 -34.11 77.06 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 119.24 -0.984 . . . . 0.0 111.471 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 69.3 mt -72.13 -48.63 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 O-C-N 122.003 -0.436 . . . . 0.0 111.19 178.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 1.8 mp -59.46 -37.18 68.56 Favored 'Isoleucine or valine' 0 C--N 1.339 0.119 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -71.33 -39.42 71.37 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 119.414 -0.327 . . . . 0.0 111.285 -177.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.422 ' HB3' ' CE2' ' B' ' 162' ' ' TYR . 89.9 p -69.34 -52.96 22.2 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.527 0.603 . . . . 0.0 111.012 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 35.1 mt -66.47 -36.31 77.0 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 CA-C-N 118.166 0.439 . . . . 0.0 110.205 179.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.91 -44.6 91.49 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.651 -0.579 . . . . 0.0 111.651 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.451 ' CD ' ' HD3' ' B' ' 167' ' ' PRO . 32.6 ttm105 -67.39 -40.12 85.63 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 117.107 0.453 . . . . 0.0 110.528 178.078 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.78 -41.29 78.99 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.43 -179.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.483 ' HH ' ' HB1' ' A' ' 36' ' ' ALA . 8.2 m-30 -64.15 -49.2 73.04 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 175.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.45 -46.51 83.54 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -62.49 -44.68 95.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 122.439 -0.163 . . . . 0.0 110.797 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -64.89 -40.1 94.57 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -176.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.7 t -84.61 -20.15 31.86 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -177.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 25.9 mmm180 -87.42 -23.14 24.6 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-N 118.775 0.716 . . . . 0.0 111.651 174.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 28.2 t -74.97 -12.32 60.31 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.833 0.453 . . . . 0.0 111.763 177.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -131.68 168.46 17.71 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.479 0.712 . . . . 0.0 110.186 -177.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 34.3 t -78.11 148.42 34.2 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 178.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 51.5 p30 -149.52 167.16 27.04 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.304 0.641 . . . . 0.0 110.759 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.7 m -145.59 165.28 29.13 Favored 'General case' 0 C--O 1.231 0.119 0 C-N-CA 122.976 0.51 . . . . 0.0 110.914 -177.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 44.6 m -72.39 164.35 26.49 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 122.979 0.512 . . . . 0.0 110.887 178.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 93.1 p -145.96 170.36 16.78 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 122.964 0.505 . . . . 0.0 110.487 -178.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -121.17 -12.96 8.6 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 122.592 0.357 . . . . 0.0 111.945 -179.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.516 ' H ' ' CD ' ' A' ' 91' ' ' PRO . 23.7 tptm -151.66 -42.12 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.342 0 CA-C-O 118.595 -0.717 . . . . 0.0 112.095 177.207 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.516 ' CD ' ' H ' ' A' ' 90' ' ' LYS . 40.8 Cg_exo -60.11 159.67 25.28 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.597 2.198 . . . . 0.0 111.956 173.453 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -170.04 156.31 26.88 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 111.429 -0.668 . . . . 0.0 111.429 178.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.39 -153.37 0.44 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.786 0.834 . . . . 0.0 109.422 -179.65 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 28.4 p -47.81 -31.55 5.08 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -177.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.43 -44.23 91.84 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.272 -0.892 . . . . 0.0 110.244 176.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -72.26 -25.58 61.67 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 122.612 0.365 . . . . 0.0 110.225 177.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.24 -45.36 84.94 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.14 -43.13 98.71 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -60.57 -33.51 72.81 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.803 -0.181 . . . . 0.0 111.344 178.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.4 m -74.76 -40.75 61.02 Favored 'General case' 0 C--N 1.338 0.072 0 CA-C-O 119.686 -0.197 . . . . 0.0 110.974 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 48.7 mt -61.94 -29.45 70.24 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 173.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.76 -14.54 16.01 Favored Glycine 0 CA--C 1.53 1.027 0 CA-C-O 118.911 -0.939 . . . . 0.0 113.829 178.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -102.2 -6.6 23.0 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.085 1.442 . . . . 0.0 112.002 -179.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 35.4 m -121.29 -16.78 6.13 Favored 'Isoleucine or valine' 0 C--N 1.338 0.079 0 C-N-CA 122.917 0.487 . . . . 0.0 111.904 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -52.79 -27.34 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 C-N-CA 123.039 0.536 . . . . 0.0 111.642 179.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -60.6 -58.45 8.44 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 122.598 0.359 . . . . 0.0 110.965 178.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -74.53 -29.36 61.35 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 122.403 0.281 . . . . 0.0 111.092 -177.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 49.2 tp -63.92 -54.87 27.82 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 179.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.408 ' O ' HG13 ' A' ' 113' ' ' ILE . 87.0 mt -63.0 -63.86 1.08 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.51 -0.757 . . . . 0.0 109.156 176.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.476 ' HB2' ' CZ ' ' A' ' 150' ' ' PHE . 87.5 p -40.49 -49.48 2.9 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -177.633 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -73.6 -38.74 65.02 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 119.821 1.191 . . . . 0.0 112.109 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.52 -48.14 82.8 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.802 0.728 . . . . 0.0 110.706 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.2 OUTLIER -76.01 -34.62 27.39 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 117.963 0.347 . . . . 0.0 111.774 -179.69 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.72 -27.51 67.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 119.585 -0.846 . . . . 0.0 109.81 179.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.405 ' HE3' ' HB3' ' A' ' 59' ' ' ASP . 3.3 tmtt? -78.43 -26.94 46.44 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.308 0.643 . . . . 0.0 110.986 175.679 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.404 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 53.6 p -69.05 153.17 44.23 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -168.217 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -89.58 175.76 7.15 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 125.045 1.338 . . . . 0.0 108.439 172.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -55.84 -41.96 75.07 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 119.253 0.933 . . . . 0.0 111.838 -178.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -69.25 -38.89 78.66 Favored 'General case' 0 C--O 1.232 0.173 0 O-C-N 121.666 -0.646 . . . . 0.0 110.479 179.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.404 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 46.9 m170 -72.19 -39.19 68.79 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 119.397 -0.335 . . . . 0.0 111.188 -178.314 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.84 -36.41 83.4 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 176.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -62.09 -44.46 96.62 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.43 177.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -63.15 -43.89 97.06 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 117.545 0.157 . . . . 0.0 111.394 177.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.6 mt -68.03 -38.69 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-N 117.781 0.264 . . . . 0.0 110.546 -179.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -68.68 -33.97 74.88 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.3 0.24 . . . . 0.0 110.504 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 64.1 ttp -68.31 -43.87 76.68 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 176.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.6 tt -57.8 -47.46 82.52 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 178.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.4 mt -71.9 -31.23 66.2 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 111.76 0.281 . . . . 0.0 111.76 -179.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -65.54 -39.83 92.19 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 118.29 0.496 . . . . 0.0 109.787 177.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.5 mt -70.54 -39.41 76.09 Favored 'Isoleucine or valine' 0 C--N 1.339 0.147 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 176.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 70.4 t-105 -65.87 -24.74 66.93 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.673 0.389 . . . . 0.0 111.147 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -87.77 -34.09 18.44 Favored 'General case' 0 N--CA 1.453 -0.3 0 O-C-N 122.124 -0.36 . . . . 0.0 111.07 174.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -72.14 -24.25 61.42 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 122.923 0.489 . . . . 0.0 111.439 -178.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 96.6 p -63.39 -14.65 52.5 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 117.914 0.324 . . . . 0.0 111.744 176.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 81.57 3.41 90.63 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-O 119.448 -0.64 . . . . 0.0 113.183 176.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 46.9 tp -147.46 143.89 28.22 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 118.313 1.056 . . . . 0.0 110.104 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -145.41 -179.07 6.41 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.193 0.597 . . . . 0.0 110.735 -177.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 7.3 pm0 -64.04 170.46 3.57 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 123.481 0.712 . . . . 0.0 112.447 -176.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 49.7 mmtm -66.73 165.2 15.48 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.3 0.64 . . . . 0.0 111.059 179.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 10.0 t 59.72 -177.7 0.09 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.669 0.788 . . . . 0.0 111.74 -175.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -71.8 162.13 29.91 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.136 0.493 . . . . 0.0 111.725 -177.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -106.54 25.93 10.56 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.816 0.846 . . . . 0.0 111.644 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . 0.414 ' HA ' ' HB3' ' A' ' 146' ' ' ARG . 25.9 t-20 -55.9 -16.39 4.6 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.734 0.814 . . . . 0.0 112.41 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -46.43 -36.69 6.79 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.98 1.712 . . . . 0.0 112.141 -172.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.473 ' H ' HD12 ' A' ' 145' ' ' ILE . 0.2 OUTLIER -121.09 -14.15 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-O 119.632 -0.223 . . . . 0.0 111.568 170.95 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.481 ' C ' ' H ' ' A' ' 148' ' ' LYS . 37.4 ttp180 -62.09 -14.58 37.97 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 117.925 0.33 . . . . 0.0 110.986 179.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 10.4 t -61.2 2.07 0.15 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 120.534 0.207 . . . . 0.0 111.528 169.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.481 ' H ' ' C ' ' A' ' 146' ' ' ARG . 40.0 ttmt 62.94 -50.35 0.19 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 128.536 2.734 . . . . 0.0 116.919 172.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 26.1 p -47.36 -34.89 7.47 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.466 1.03 . . . . 0.0 112.014 -172.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . 0.476 ' CZ ' ' HB2' ' A' ' 110' ' ' SER . 35.2 m-85 -55.17 -100.27 0.0 OUTLIER 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 125.679 1.592 . . . . 0.0 113.86 -177.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -69.38 -14.06 62.7 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -178.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 23.4 mtm -106.96 -12.5 15.43 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.298 1.221 . . . . 0.0 114.298 -172.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -125.54 -14.3 6.36 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 120.231 1.378 . . . . 0.0 112.174 172.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 30.1 tp . . . . . 0 C--O 1.25 1.099 0 C-N-CA 125.39 1.476 . . . . 0.0 112.25 -179.522 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 53.4 p90 . . . . . 0 N--CA 1.473 0.714 0 N-CA-C 110.632 -0.136 . . . . 0.0 110.632 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 46.3 t -154.26 146.56 17.36 Favored Pre-proline 0 CA--C 1.53 0.205 0 C-N-CA 122.793 0.437 . . . . 0.0 110.131 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -72.4 1.24 6.37 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 123.492 2.795 . . . . 0.0 112.12 176.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 73.5 p -133.14 170.29 15.62 Favored 'General case' 0 C--O 1.232 0.144 0 C-N-CA 123.54 0.736 . . . . 0.0 109.978 179.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 160' ' ' PRO . . . . . 0.433 ' HG2' ' H ' ' B' ' 161' ' ' SER . 58.4 Cg_endo -65.36 -49.65 0.19 OUTLIER 'Cis proline' 0 N--CA 1.454 -0.824 0 CA-C-N 119.436 0.834 . . . . 0.0 111.357 -3.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 161' ' ' SER . . . . . 0.433 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 38.8 t -177.97 152.08 0.72 Allowed 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.046 0.938 . . . . 0.0 109.351 176.634 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 162' ' ' TYR . . . . . 0.422 ' CE2' ' HB3' ' A' ' 71' ' ' SER . 44.5 t80 -152.25 125.86 8.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.732 0.301 . . . . 0.0 110.933 169.516 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 163' ' ' SER . . . . . 0.437 ' C ' ' H ' ' B' ' 165' ' ' THR . 9.3 t -131.93 148.77 71.18 Favored Pre-proline 0 N--CA 1.453 -0.32 0 C-N-CA 124.607 1.163 . . . . 0.0 109.558 179.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_exo -58.22 -1.46 0.65 Allowed 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 123.607 2.871 . . . . 0.0 112.954 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 165' ' ' THR . . . . . 0.437 ' H ' ' C ' ' B' ' 163' ' ' SER . 28.0 m -76.58 -34.38 58.43 Favored 'General case' 0 N--CA 1.456 -0.159 0 O-C-N 122.226 -0.297 . . . . 0.0 111.139 -179.136 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . 0.451 ' HD3' ' CD ' ' A' ' 74' ' ' ARG . 41.9 Cg_endo -81.55 -7.17 12.68 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 123.605 2.87 . . . . 0.0 113.694 -173.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 C--O 1.252 1.235 0 CA-C-O 117.016 -1.469 . . . . 0.0 111.145 -174.932 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 12.4 t70 . . . . . 0 CA--C 1.537 0.443 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -55.21 -14.19 1.61 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.167 0.587 . . . . 0.0 110.876 178.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -52.89 -37.09 60.13 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 124.396 1.078 . . . . 0.0 111.214 175.465 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -65.18 -43.88 90.27 Favored 'General case' 0 N--CA 1.457 -0.101 0 CA-C-N 119.328 0.967 . . . . 0.0 110.342 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -65.65 -50.52 64.68 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -177.769 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 99.7 t -63.13 -54.52 32.32 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -178.763 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.51 -33.62 70.03 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 119.437 -0.316 . . . . 0.0 111.654 -178.005 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 67.1 m -70.65 -43.98 68.04 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 118.62 0.646 . . . . 0.0 110.495 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.3 tp -65.59 -33.99 77.19 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.208 0.528 . . . . 0.0 110.064 -179.367 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -66.62 -45.72 78.16 Favored 'General case' 0 CA--C 1.522 -0.101 0 C-N-CA 124.164 0.985 . . . . 0.0 110.063 177.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 74.2 m -65.43 -26.36 67.93 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 110.371 -0.233 . . . . 0.0 110.371 176.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -68.03 -45.06 75.02 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 174.694 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt . . . . . 0 CA--C 1.529 0.157 0 C-N-CA 123.768 0.827 . . . . 0.0 111.659 177.663 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 18.7 mm . . . . . 0 CA--C 1.529 0.151 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.5 m -51.7 132.06 30.67 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.354 0.661 . . . . 0.0 112.049 -174.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -70.04 -16.0 72.41 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-O 118.909 -0.939 . . . . 0.0 113.366 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.422 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 41.2 t -65.93 -42.79 89.63 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-N 118.974 1.387 . . . . 0.0 110.625 -177.54 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -68.04 -37.46 81.36 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 62.8 mt -63.59 -41.71 93.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.448 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -58.39 -43.28 88.46 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 118.561 -0.733 . . . . 0.0 111.967 176.104 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.401 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -65.62 -43.54 89.23 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 119.735 1.152 . . . . 0.0 111.102 178.459 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.3 mt -61.44 -57.08 13.65 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.612 0.244 . . . . 0.0 110.413 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 43.3 p -56.69 -41.17 76.9 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.474 0.31 . . . . 0.0 111.748 177.242 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.9 m -56.02 -56.23 23.29 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 119.143 -0.456 . . . . 0.0 110.698 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -67.27 -33.64 75.75 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 118.971 -1.091 . . . . 0.0 111.548 -175.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.52 -59.76 4.89 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 118.225 0.466 . . . . 0.0 110.817 174.146 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 53.9 mt -71.62 -14.66 62.13 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.181 0.992 . . . . 0.0 112.889 -173.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -55.82 -34.85 65.75 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -178.33 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -153.11 -17.9 0.15 Allowed 'General case' 0 C--N 1.34 0.155 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -177.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 31.3 mm 47.75 75.91 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-O 121.829 0.823 . . . . 0.0 111.417 -178.094 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -132.09 8.19 4.37 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.911 0.884 . . . . 0.0 109.83 177.099 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.548 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.8 pt -144.54 123.72 6.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 C-N-CA 125.301 1.44 . . . . 0.0 108.145 -178.73 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.22 -66.72 1.04 Allowed 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 179.328 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 50.8 m -66.85 -22.47 65.99 Favored 'General case' 0 N--CA 1.46 0.051 0 C-N-CA 122.714 0.406 . . . . 0.0 111.844 -174.089 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.618 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -75.17 -52.99 9.59 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 123.996 0.918 . . . . 0.0 109.203 179.012 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.435 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 10.8 mt -58.95 -45.81 91.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 C-N-CA 123.041 0.536 . . . . 0.0 110.025 175.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.419 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 12.3 mm -69.59 -46.28 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-O 119.298 -0.382 . . . . 0.0 111.517 -177.046 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 40.4 t -58.68 -36.59 74.44 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 118.712 0.687 . . . . 0.0 109.697 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.9 tp -67.87 -45.01 75.74 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 118.754 -0.641 . . . . 0.0 112.282 -178.531 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 28.5 pt -73.41 -37.07 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-N 119.608 1.095 . . . . 0.0 111.893 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.444 HD13 HG21 ' A' ' 104' ' ' VAL . 97.4 mt -63.25 -52.65 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.797 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -66.91 -25.63 66.47 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.516 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -61.49 -43.68 98.44 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 173.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.3 t -64.51 -42.78 95.59 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 120.747 0.308 . . . . 0.0 110.346 175.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.64 -48.91 76.51 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 124.809 1.244 . . . . 0.0 112.536 -176.042 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 78.4 mt -81.89 -14.59 55.98 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -174.153 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 78.9 m -108.91 156.17 39.51 Favored Pre-proline 0 CA--C 1.535 0.375 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -169.2 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_exo -55.77 -179.87 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.351 1 C-N-CA 126.069 4.513 . . . . 0.0 115.409 176.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -55.46 -43.65 75.67 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.574 1.55 . . . . 0.0 114.036 -174.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.9 p -58.7 -28.44 65.79 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 31.8 m80 -92.02 -14.93 28.6 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 118.861 -0.59 . . . . 0.0 111.208 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.403 ' HB2' ' HE2' ' A' ' 115' ' ' LYS . 35.5 mmtp -69.15 -47.47 64.95 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 169.341 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.1 tp -66.14 -45.41 81.11 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.383 177.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.94 -43.65 96.65 Favored Glycine 0 C--N 1.336 0.556 0 N-CA-C 111.124 -0.79 . . . . 0.0 111.124 178.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.7 t -67.0 -37.72 84.72 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 117.579 0.689 . . . . 0.0 110.608 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 28.5 mt -57.89 -39.58 78.21 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.317 0.962 . . . . 0.0 110.579 174.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -71.57 -32.03 67.63 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.251 0.932 . . . . 0.0 111.835 178.097 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 83.7 mt -70.96 -47.02 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 O-C-N 121.609 -0.682 . . . . 0.0 110.18 176.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 79.7 mt -61.02 -36.05 69.64 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 C-N-CA 124.208 1.003 . . . . 0.0 109.156 176.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -62.9 -50.05 72.39 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 123.729 0.812 . . . . 0.0 110.656 176.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.5 t -70.47 -49.07 52.37 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 118.887 -1.125 . . . . 0.0 111.952 -175.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 46.2 mt -65.33 -37.55 80.4 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.8 -48.97 58.28 Favored Glycine 0 CA--C 1.523 0.583 0 CA-C-O 119.596 -0.558 . . . . 0.0 112.309 -178.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.5 mtp-105 -66.12 -38.53 88.43 Favored 'General case' 0 CA--C 1.522 -0.106 0 CA-C-N 117.845 0.823 . . . . 0.0 110.92 178.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.74 -42.57 81.62 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 121.091 -0.243 . . . . 0.0 110.47 178.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.0 m-30 -61.39 -47.52 85.42 Favored 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 175.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.0 tp -59.09 -44.94 91.97 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.743 0.417 . . . . 0.0 110.813 -176.136 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -67.62 -41.65 83.63 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.631 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 59.2 tt0 -65.95 -38.96 89.94 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.502 -176.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.3 t -82.93 -23.17 33.61 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 117.928 0.331 . . . . 0.0 111.303 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 28.9 ttp180 . . . . . 0 N--CA 1.463 0.177 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 172.204 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.531 0.229 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.9 p -50.95 -30.01 13.76 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.088 0.955 . . . . 0.0 113.416 -175.179 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.98 -46.83 89.14 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 118.753 0.706 . . . . 0.0 109.579 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -74.72 -23.09 58.52 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.987 178.748 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.419 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -64.29 -45.59 87.33 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 175.356 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.77 -42.25 91.99 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -59.35 -34.97 73.03 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 121.303 -0.159 . . . . 0.0 110.969 178.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.3 m -76.61 -40.77 48.36 Favored 'General case' 0 C--O 1.227 -0.098 0 O-C-N 122.288 -0.258 . . . . 0.0 111.244 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.8 mt -61.41 -29.49 69.97 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 174.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.47 -14.58 28.25 Favored Glycine 0 CA--C 1.529 0.95 0 CA-C-O 119.016 -0.88 . . . . 0.0 113.816 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -100.51 -6.79 24.94 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 118.776 1.288 . . . . 0.0 111.689 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.444 HG21 HD13 ' A' ' 51' ' ' ILE . 27.3 m -123.72 -18.28 4.13 Favored 'Isoleucine or valine' 0 C--N 1.339 0.134 0 N-CA-C 112.5 0.555 . . . . 0.0 112.5 -178.125 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -54.53 -28.08 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 118.48 0.582 . . . . 0.0 111.548 -177.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -62.29 -51.79 66.29 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.778 0.431 . . . . 0.0 111.215 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -77.94 -28.49 49.62 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 122.093 -0.379 . . . . 0.0 111.008 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.0 mt -65.25 -49.78 68.32 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 178.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 69.2 mt -65.56 -60.14 3.24 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 118.5 -0.762 . . . . 0.0 110.31 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.9 p -53.67 -40.37 65.87 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 119.011 -1.076 . . . . 0.0 112.199 -173.883 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -72.67 -45.0 61.11 Favored 'General case' 0 C--N 1.342 0.24 0 CA-C-N 119.44 1.018 . . . . 0.0 111.095 178.418 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.409 ' O ' ' HE3' ' A' ' 115' ' ' LYS . . . -55.96 -33.98 65.26 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.148 0.579 . . . . 0.0 111.635 177.64 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -79.2 -41.97 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 CA-C-N 119.345 0.975 . . . . 0.0 112.019 173.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.54 -27.08 66.66 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.001 0.364 . . . . 0.0 111.746 -177.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.409 ' HE3' ' O ' ' A' ' 112' ' ' ALA . 0.1 OUTLIER -81.33 -18.41 45.8 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.647 0.779 . . . . 0.0 110.653 177.933 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.2 m -80.44 164.63 22.91 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -173.687 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -101.4 -179.41 4.02 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 169.502 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 15.9 tp60 -51.33 -39.92 58.01 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.639 0.654 . . . . 0.0 111.592 -178.352 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -69.08 -54.56 14.38 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -177.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -64.87 -35.87 82.52 Favored 'General case' 0 C--N 1.339 0.131 0 O-C-N 122.2 -0.312 . . . . 0.0 110.4 -178.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 11.9 ttpt -56.71 -51.9 67.04 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 175.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.5 -35.29 78.91 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.885 -176.301 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -63.59 -39.64 94.91 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 122.215 -0.303 . . . . 0.0 111.239 175.095 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.5 mt -68.88 -37.38 77.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 49.7 tpt85 -60.89 -41.41 95.97 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 122.792 0.437 . . . . 0.0 109.967 175.374 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 65.9 ttp -68.42 -37.67 80.5 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 122.62 0.368 . . . . 0.0 110.611 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 8.4 tt -59.48 -51.71 68.72 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.278 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.4 mt -71.03 -25.87 62.85 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 120.444 -0.502 . . . . 0.0 111.446 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 13.4 t70 . . . . . 0 N--CA 1.455 -0.179 0 CA-C-N 118.285 0.493 . . . . 0.0 109.874 175.775 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 160' ' ' PRO . . . . . 0.422 ' HD2' ' N ' ' A' ' 27' ' ' SER . 80.7 Cg_endo . . . . . 0 N--CA 1.451 -0.975 0 N-CA-C 109.742 -0.907 . . . . 0.0 109.742 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 45.5 m -65.74 144.9 56.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -151.23 142.6 23.4 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.634 0.254 . . . . 0.0 111.326 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 36.5 p -144.09 159.71 51.83 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-O 120.996 0.427 . . . . 0.0 111.328 177.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -57.02 -0.91 0.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 124.335 3.357 . . . . 0.0 113.464 174.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 26.9 m . . . . . 0 N--CA 1.455 -0.215 0 CA-C-N 118.045 0.384 . . . . 0.0 110.877 178.823 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 36.2 t70 . . . . . 0 N--CA 1.455 -0.218 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -56.97 -17.12 8.53 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.018 0.372 . . . . 0.0 110.469 174.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -55.52 -42.75 74.95 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.109 0.564 . . . . 0.0 110.327 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -56.55 -43.32 79.82 Favored 'General case' 0 C--N 1.337 0.064 0 CA-C-N 118.264 0.484 . . . . 0.0 110.506 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -66.91 -52.68 40.22 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 110.576 -0.157 . . . . 0.0 110.576 -177.459 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 67.1 t -61.44 -53.49 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 -179.17 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.6 -34.66 71.37 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.921 0.488 . . . . 0.0 111.906 -177.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 78.4 m -72.03 -41.03 67.97 Favored 'General case' 0 CA--C 1.523 -0.079 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.707 177.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.3 tp -65.36 -33.05 75.04 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -68.42 -44.76 74.31 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.934 0.894 . . . . 0.0 109.941 176.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 72.1 m -64.36 -26.31 68.41 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 175.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.1 -45.82 69.28 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 174.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt . . . . . 0 CA--C 1.53 0.201 0 C-N-CA 122.967 0.507 . . . . 0.0 111.197 177.698 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 15.8 mm . . . . . 0 CA--C 1.529 0.161 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.4 m -54.88 132.05 45.65 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.045 0.538 . . . . 0.0 111.988 -176.023 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.14 -19.23 63.6 Favored Glycine 0 C--N 1.338 0.658 0 C-N-CA 124.542 1.067 . . . . 0.0 113.208 -178.442 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.45 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 63.1 p -67.32 -39.54 85.89 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 118.707 1.253 . . . . 0.0 110.649 -176.037 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -67.55 -40.24 84.97 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 178.066 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.5 mt -63.72 -39.48 85.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 177.17 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 47.5 mmtt -63.41 -40.19 96.53 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-O 118.939 -0.553 . . . . 0.0 110.77 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.95 -47.29 75.15 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 118.822 0.737 . . . . 0.0 110.554 175.647 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.7 mt -59.23 -58.77 7.16 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 122.452 -0.155 . . . . 0.0 110.833 -178.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.4 p -57.39 -49.13 77.17 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 t -62.53 -43.98 97.48 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 119.965 -0.694 . . . . 0.0 111.282 -175.237 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -77.27 -21.38 53.72 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -178.022 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.29 -55.81 10.83 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 119.029 0.831 . . . . 0.0 110.019 169.246 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.5 mt -65.46 -26.14 67.81 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.178 0.991 . . . . 0.0 111.334 -176.436 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -76.06 -16.81 59.86 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.077 0.551 . . . . 0.0 111.654 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -145.65 48.95 1.24 Allowed 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.206 0.203 . . . . 0.0 111.436 -173.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.634 HG22 HG22 ' A' ' 93' ' ' THR . 43.9 mm -63.07 79.05 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-O 121.468 0.651 . . . . 0.0 110.45 171.729 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -153.36 18.15 0.55 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.068 1.747 . . . . 0.0 108.538 176.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.576 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.8 OUTLIER -147.09 36.88 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.065 0 C-N-CA 125.542 1.537 . . . . 0.0 108.541 -171.965 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.469 ' HB2' ' HB2' ' A' ' 97' ' ' ALA . 0.0 OUTLIER -51.37 -53.81 32.75 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -175.237 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 85.6 p -75.4 -23.62 57.08 Favored 'General case' 0 CA--C 1.522 -0.107 0 O-C-N 121.577 -0.702 . . . . 0.0 112.369 -173.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.626 ' HD3' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -86.25 -41.61 14.47 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 -179.323 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 45.4 mt -57.37 -50.84 75.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 171.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.509 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 13.9 mm -66.85 -50.4 65.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 CA-C-O 119.128 -0.463 . . . . 0.0 112.094 -177.604 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 87.6 p -58.95 -31.98 69.2 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 118.973 -1.091 . . . . 0.0 110.438 178.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 57.1 tp -68.97 -44.7 72.4 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 118.765 -0.636 . . . . 0.0 112.145 178.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.0 pt -72.01 -34.71 51.49 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 119.682 1.128 . . . . 0.0 112.0 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.472 HD13 HG21 ' A' ' 104' ' ' VAL . 96.4 mt -64.86 -50.83 73.32 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.103 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 177.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -58.43 -41.2 84.48 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.498 177.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -57.95 -40.86 81.57 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 176.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.2 t -64.21 -53.57 47.09 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 121.245 -0.182 . . . . 0.0 111.42 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -72.4 -23.42 61.09 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 113.761 1.022 . . . . 0.0 113.761 -172.43 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.9 mt -84.03 -15.06 48.96 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.415 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 95.0 m -112.45 158.31 37.66 Favored Pre-proline 0 CA--C 1.533 0.318 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -171.008 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.415 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 74.3 Cg_endo -66.51 -177.47 0.91 Allowed 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 125.09 3.86 . . . . 0.0 113.486 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -55.18 -41.15 71.52 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.114 1.365 . . . . 0.0 114.26 -171.098 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.4 p -59.74 -32.33 70.46 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 28.9 m170 -88.99 -15.95 32.9 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 119.086 -0.483 . . . . 0.0 111.527 -178.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -68.87 -46.35 68.68 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 170.383 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 64.3 tp -66.5 -46.66 75.5 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.81 0.338 . . . . 0.0 110.111 177.522 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.81 -44.07 96.14 Favored Glycine 0 C--N 1.337 0.592 0 N-CA-C 110.7 -0.96 . . . . 0.0 110.7 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.3 t -66.18 -38.53 88.24 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 117.467 0.633 . . . . 0.0 110.367 -179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 66' ' ' LEU . 23.3 mt -58.62 -40.12 82.4 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 119.123 0.874 . . . . 0.0 110.717 175.464 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -69.02 -32.46 71.99 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 119.137 0.881 . . . . 0.0 111.497 178.211 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 70.8 mt -71.38 -48.21 54.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 O-C-N 121.639 -0.663 . . . . 0.0 110.252 177.163 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.6 mt -59.56 -36.15 63.32 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.176 0 C-N-CA 124.111 0.964 . . . . 0.0 109.307 176.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -64.33 -52.46 58.34 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.597 0.759 . . . . 0.0 110.54 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.8 t -66.14 -50.56 63.56 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 118.855 -1.138 . . . . 0.0 111.93 -176.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 52.2 mt -65.07 -37.43 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 110.289 -0.263 . . . . 0.0 110.289 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.41 -48.48 57.47 Favored Glycine 0 C--N 1.338 0.658 0 N-CA-C 111.95 -0.46 . . . . 0.0 111.95 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.8 mtp-105 -67.61 -35.11 78.34 Favored 'General case' 0 C--O 1.23 0.061 0 CA-C-N 117.685 0.742 . . . . 0.0 110.701 179.236 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.61 -42.77 81.86 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 177.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 -62.43 -46.84 86.71 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 176.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 57.6 tp -58.63 -45.1 89.99 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 123.461 0.476 . . . . 0.0 110.424 -177.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -65.79 -46.56 78.27 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.553 -0.092 . . . . 0.0 110.878 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -69.89 -30.9 68.44 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -174.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.5 t -86.35 -26.58 24.77 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 118.61 0.641 . . . . 0.0 111.37 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 . . . . . 0 CA--C 1.529 0.152 0 O-C-N 122.206 -0.309 . . . . 0.0 110.326 174.142 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.634 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.274 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 26.3 p -50.24 -30.37 11.52 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.98 -41.37 95.49 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.308 -0.87 . . . . 0.0 110.152 176.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 -66.11 -34.72 78.7 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.111 0.481 . . . . 0.0 110.33 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.509 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -63.56 -45.15 91.81 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.964 179.173 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 98.3 mt -63.54 -42.92 97.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 175.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -61.03 -33.24 72.98 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 122.379 -0.201 . . . . 0.0 110.852 179.582 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 86.1 m -75.48 -41.33 55.73 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.467 0.307 . . . . 0.0 111.191 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.5 mt -62.01 -30.29 70.85 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 174.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.08 -14.58 25.51 Favored Glycine 0 CA--C 1.53 1.014 0 CA-C-O 119.174 -0.792 . . . . 0.0 113.668 178.652 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -101.95 -3.73 27.32 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.846 1.323 . . . . 0.0 112.136 -179.426 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.472 HG21 HD13 ' A' ' 51' ' ' ILE . 26.8 m -125.86 -18.82 3.0 Favored 'Isoleucine or valine' 0 C--N 1.338 0.074 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -178.693 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.4 tp -50.83 -27.12 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -177.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -64.98 -46.35 81.83 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 118.03 0.377 . . . . 0.0 110.886 178.145 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -74.23 -40.81 62.16 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -178.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 89.5 mt -60.32 -50.3 74.18 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.422 -177.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.412 ' O ' HG13 ' A' ' 113' ' ' ILE . 78.0 mt -66.51 -59.62 3.48 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 118.383 -0.818 . . . . 0.0 110.245 177.529 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 62.2 p -49.45 -42.09 42.05 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 118.951 0.796 . . . . 0.0 111.898 -173.657 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -70.57 -51.69 26.77 Favored 'General case' 0 C--O 1.226 -0.152 0 CA-C-N 118.638 0.654 . . . . 0.0 110.863 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.407 ' O ' ' HE3' ' A' ' 115' ' ' LYS . . . -56.06 -32.43 64.08 Favored 'General case' 0 C--O 1.228 -0.078 0 C-N-CA 123.836 0.854 . . . . 0.0 113.044 -178.787 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -86.94 -36.43 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.151 0 CA-C-N 119.446 1.021 . . . . 0.0 112.35 175.237 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.92 -28.37 66.6 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.395 0.543 . . . . 0.0 111.0 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.407 ' HE3' ' O ' ' A' ' 112' ' ' ALA . 0.1 OUTLIER -79.0 -18.12 54.18 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.0 0.92 . . . . 0.0 110.843 178.386 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 14.9 m -79.07 166.4 22.33 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -174.578 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -107.93 -174.15 2.45 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.307 1.443 . . . . 0.0 107.886 173.547 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -50.89 -55.22 18.15 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.349 0.66 . . . . 0.0 112.097 -177.145 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -68.79 -32.74 72.69 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 122.004 -0.435 . . . . 0.0 111.617 -176.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 58.8 m-70 -76.67 -42.04 43.31 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 118.796 -0.621 . . . . 0.0 111.419 -177.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.73 -33.19 75.09 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 119.328 0.967 . . . . 0.0 108.787 176.111 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.07 -46.21 90.12 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.172 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -62.42 -42.33 99.37 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.352 176.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.6 mt -66.19 -35.06 74.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.02 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -67.43 -38.31 84.36 Favored 'General case' 0 C--O 1.227 -0.107 0 O-C-N 121.986 -0.446 . . . . 0.0 110.637 178.221 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 64.6 ttp -66.07 -40.99 91.33 Favored 'General case' 0 N--CA 1.457 -0.116 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 176.22 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.9 tt -59.24 -45.01 92.31 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 177.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 91.2 mt -71.36 -28.68 64.22 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.1 t70 . . . . . 0 N--CA 1.453 -0.291 0 CA-C-N 118.482 0.583 . . . . 0.0 109.506 176.578 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 160' ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' ' 27' ' ' SER . 58.4 Cg_endo . . . . . 0 N--CA 1.457 -0.62 0 N-CA-C 111.698 -0.155 . . . . 0.0 111.698 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 161' ' ' SER . . . . . 0.421 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 65.9 p -170.47 148.48 3.14 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.18 0.992 . . . . 0.0 108.997 175.381 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -158.62 137.96 11.62 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 120.677 0.275 . . . . 0.0 111.628 172.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 16.3 t -137.69 144.76 45.93 Favored Pre-proline 0 CA--C 1.529 0.138 0 C-N-CA 123.743 0.817 . . . . 0.0 110.152 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -66.23 -1.46 5.46 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 123.305 2.67 . . . . 0.0 111.712 177.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 39.4 p . . . . . 0 CA--C 1.53 0.211 0 CA-C-O 119.125 -0.464 . . . . 0.0 111.414 178.234 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.0 p30 . . . . . 0 CA--C 1.53 0.175 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -54.98 -16.41 2.73 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.199 0.6 . . . . 0.0 110.776 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -54.53 -39.16 67.4 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 118.944 -0.551 . . . . 0.0 110.289 173.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 -64.82 -42.31 95.08 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-N 118.947 0.794 . . . . 0.0 110.216 178.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -64.89 -50.32 67.0 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 118.087 0.403 . . . . 0.0 110.425 -178.117 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 93.0 t -63.75 -54.15 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.6 -30.69 67.42 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 122.781 0.432 . . . . 0.0 111.589 -178.143 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 54.0 m -74.64 -41.91 59.5 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.268 0.485 . . . . 0.0 110.594 177.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.4 tp -67.05 -29.75 69.62 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -71.04 -39.92 71.99 Favored 'General case' 0 CA--C 1.523 -0.09 0 C-N-CA 124.032 0.933 . . . . 0.0 109.868 175.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.6 t -63.78 -28.75 70.09 Favored 'General case' 0 N--CA 1.456 -0.134 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 173.212 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.52 -32.25 60.42 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 110.002 -0.369 . . . . 0.0 110.002 174.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt . . . . . 0 N--CA 1.455 -0.185 0 C-N-CA 122.678 0.391 . . . . 0.0 110.203 176.395 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 20.7 mm . . . . . 0 N--CA 1.457 -0.083 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.42 ' HB2' HH11 ' A' ' 28' ' ' ARG . 73.8 m -59.35 132.41 53.93 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.112 0.565 . . . . 0.0 112.41 -175.127 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.73 -23.62 72.44 Favored Glycine 0 C--N 1.337 0.627 0 C-N-CA 124.117 0.865 . . . . 0.0 112.581 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.49 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 36.6 t -65.08 -41.12 95.32 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 118.533 1.167 . . . . 0.0 110.46 -175.372 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.42 HH11 ' HB2' ' A' ' 25' ' ' SER . 81.0 mtt85 -69.57 -38.8 77.54 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 75.9 mt -64.17 -39.42 85.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 176.366 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp -67.7 -36.86 81.41 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.348 -0.358 . . . . 0.0 111.412 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.453 ' HE3' ' O ' ' A' ' 27' ' ' SER . 0.0 OUTLIER -68.98 -43.93 73.94 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.676 0.671 . . . . 0.0 110.703 175.484 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.4 mt -62.85 -56.47 17.05 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 110.605 -0.146 . . . . 0.0 110.605 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.573 HG21 ' HB2' ' A' ' 71' ' ' SER . 50.8 p -56.3 -49.18 75.04 Favored 'General case' 0 CA--C 1.522 -0.13 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 177.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 t -62.28 -43.86 97.86 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.964 -174.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -68.47 -35.54 77.71 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 118.721 -1.192 . . . . 0.0 111.503 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.86 -58.0 10.57 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.132 0.424 . . . . 0.0 110.226 174.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.83 -16.23 63.23 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -176.216 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -59.62 -27.25 66.15 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -179.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.3 t-80 -152.3 -23.63 0.17 Allowed 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 -176.311 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.51 HG22 HG22 ' A' ' 93' ' ' THR . 33.5 mm 46.51 74.96 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 123.431 0.693 . . . . 0.0 111.675 -178.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -147.24 20.57 1.22 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.857 0.863 . . . . 0.0 109.8 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.58 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.3 pt -147.45 35.33 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 C-N-CA 124.291 1.036 . . . . 0.0 109.805 -171.319 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.487 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -50.61 -58.16 6.5 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.205 1.002 . . . . 0.0 113.601 -177.05 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 52.9 m -73.09 -26.8 61.38 Favored 'General case' 0 CA--C 1.52 -0.192 0 O-C-N 121.864 -0.523 . . . . 0.0 112.4 -174.1 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.655 ' H ' ' CD ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.76 -44.12 15.95 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 119.305 -0.378 . . . . 0.0 109.989 -178.741 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 16.7 mt -56.22 -51.93 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.125 0 CA-C-N 118.303 0.502 . . . . 0.0 109.711 171.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.43 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 13.4 mm -66.8 -49.45 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -176.412 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 34.2 t -56.66 -36.72 69.88 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 119.987 -0.685 . . . . 0.0 109.646 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.1 tp -69.71 -42.37 74.12 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 118.444 -0.789 . . . . 0.0 112.63 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 32.1 pt -72.99 -37.64 54.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 120.003 1.274 . . . . 0.0 111.773 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.446 HD13 HG21 ' A' ' 104' ' ' VAL . 95.5 mt -63.39 -49.6 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.251 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -59.21 -41.72 89.28 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.762 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -55.83 -40.13 72.38 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 176.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -67.9 -52.6 34.47 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -69.0 -23.03 64.05 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -173.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 55.9 mt -81.33 -14.84 56.85 Favored 'General case' 0 C--O 1.231 0.113 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 177.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.546 ' HB3' ' CG ' ' A' ' 61' ' ' HIS . 76.4 m -126.39 157.89 68.91 Favored Pre-proline 0 CA--C 1.539 0.554 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -170.448 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.452 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 64.0 Cg_endo -74.76 -166.56 0.35 Allowed 'Trans proline' 0 CA--C 1.537 0.665 1 C-N-CA 125.34 4.027 . . . . 0.0 114.648 -176.07 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -38.77 -57.2 1.24 Allowed 'General case' 0 C--O 1.236 0.358 0 C-N-CA 128.167 2.587 . . . . 0.0 115.342 -173.326 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.3 t -58.92 -31.49 68.7 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.774 0.321 . . . . 0.0 110.46 -175.191 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.546 ' CG ' ' HB3' ' A' ' 57' ' ' CYS . 16.2 m80 -82.49 -23.9 34.45 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.076 0.551 . . . . 0.0 111.272 -178.219 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -68.31 -44.67 74.89 Favored 'General case' 0 C--N 1.342 0.25 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 172.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 49.2 tp -66.39 -46.2 77.42 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.271 178.573 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.63 -44.0 97.22 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.153 -1.179 . . . . 0.0 110.153 177.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.3 t -55.82 -50.51 70.32 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.941 0.371 . . . . 0.0 110.064 177.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 37.5 mt -58.58 -39.94 81.74 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 118.692 -0.671 . . . . 0.0 111.645 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -69.2 -29.36 67.32 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.081 0.855 . . . . 0.0 111.789 179.011 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 64.1 mt -79.1 -39.24 21.18 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 O-C-N 121.797 -0.564 . . . . 0.0 110.588 178.427 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 75.9 mt -64.81 -35.8 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 175.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.12 -52.79 53.25 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.102 1.361 . . . . 0.0 110.127 177.03 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.573 ' HB2' HG21 ' A' ' 33' ' ' THR . 81.3 p -66.38 -52.52 45.96 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 120.049 -0.66 . . . . 0.0 112.015 -175.512 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 37.6 mt -67.86 -34.43 67.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 CA-C-N 117.641 0.2 . . . . 0.0 110.649 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.98 -50.16 59.27 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 111.692 -0.563 . . . . 0.0 111.692 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.7 mtp-105 -68.02 -36.96 80.82 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-N 117.364 0.582 . . . . 0.0 110.866 178.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.95 -40.95 83.14 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 117.623 0.192 . . . . 0.0 110.551 179.05 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.8 m-30 -64.79 -45.45 86.24 Favored 'General case' 0 CA--C 1.516 -0.332 0 O-C-N 122.147 -0.346 . . . . 0.0 110.093 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 48.4 tp -59.34 -44.7 92.61 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 123.37 0.419 . . . . 0.0 110.209 -177.026 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -66.3 -43.74 85.42 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 122.259 -0.276 . . . . 0.0 110.315 177.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.1 tp10 -67.03 -27.71 67.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 119.485 -0.293 . . . . 0.0 111.745 -176.362 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.9 t -94.04 -23.76 17.88 Favored 'General case' 0 CA--C 1.528 0.115 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 69.9 mtm180 . . . . . 0 C--N 1.342 0.245 0 CA-C-N 119.097 0.862 . . . . 0.0 112.592 176.377 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.51 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.232 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.9 p -48.35 -32.58 7.67 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -176.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.82 -46.73 83.8 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.835 0.743 . . . . 0.0 110.074 176.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 66.9 m80 -67.07 -29.79 69.67 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.005 0.522 . . . . 0.0 110.593 178.282 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.43 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -65.14 -46.6 80.25 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 122.99 0.516 . . . . 0.0 110.462 177.815 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.8 -42.77 97.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 176.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -61.48 -33.94 74.63 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 122.257 -0.277 . . . . 0.0 111.165 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.1 m -73.36 -42.16 62.56 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.161 -0.337 . . . . 0.0 110.889 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 47.8 mt -60.09 -31.4 69.99 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 174.088 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.55 -14.53 14.47 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-O 119.019 -0.878 . . . . 0.0 114.23 178.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -101.63 -6.25 24.03 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.957 1.379 . . . . 0.0 112.059 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.446 HG21 HD13 ' A' ' 51' ' ' ILE . 30.1 m -121.75 -19.36 4.56 Favored 'Isoleucine or valine' 0 C--N 1.337 0.048 0 C-N-CA 123.099 0.56 . . . . 0.0 111.846 -178.853 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.406 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.9 tp -52.14 -26.99 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 C-N-CA 122.891 0.476 . . . . 0.0 112.055 -178.854 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -59.44 -57.21 14.0 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 122.896 0.479 . . . . 0.0 111.499 177.783 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -76.37 -32.81 58.82 Favored 'General case' 0 N--CA 1.457 -0.115 0 O-C-N 122.137 -0.352 . . . . 0.0 111.409 -177.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.4 mt -61.65 -49.48 76.39 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.412 ' O ' HG13 ' A' ' 113' ' ' ILE . 70.7 mt -65.41 -58.18 6.49 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.343 -0.836 . . . . 0.0 109.989 177.002 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 98.0 p -50.33 -43.93 54.14 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.093 0.861 . . . . 0.0 111.735 -173.261 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -68.49 -52.53 31.32 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 118.422 0.555 . . . . 0.0 110.776 177.336 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.461 ' O ' ' HE3' ' A' ' 115' ' ' LYS . . . -56.19 -33.06 64.96 Favored 'General case' 0 N--CA 1.457 -0.107 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -177.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -87.15 -36.16 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 119.853 1.206 . . . . 0.0 112.374 175.295 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.44 -25.49 63.22 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 119.771 -0.772 . . . . 0.0 110.747 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.461 ' HE3' ' O ' ' A' ' 112' ' ' ALA . 0.1 OUTLIER -80.2 -20.09 45.52 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.629 0.772 . . . . 0.0 110.536 177.277 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.7 m -77.08 159.18 30.03 Favored 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -171.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -90.62 175.79 6.91 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.831 1.253 . . . . 0.0 107.859 170.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -55.97 -40.76 73.73 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.832 -0.542 . . . . 0.0 112.069 -177.558 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -69.7 -36.77 76.22 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.958 -0.464 . . . . 0.0 110.654 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -75.3 -42.92 53.63 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 118.734 -0.651 . . . . 0.0 110.843 -178.377 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.404 ' HD2' ' C ' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -64.88 -33.66 76.54 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 119.539 1.063 . . . . 0.0 109.78 176.348 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.1 -46.5 87.04 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.023 177.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -63.89 -37.59 87.97 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.688 177.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 92.7 mt -68.58 -35.55 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -65.44 -40.1 92.86 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 176.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 24.2 ttt -62.41 -43.13 99.55 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 176.102 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.0 tt -58.04 -44.63 87.52 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 178.001 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.9 mt -71.45 -32.13 67.97 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.3 t70 . . . . . 0 N--CA 1.456 -0.174 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.019 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 160' ' ' PRO . . . . . 0.49 ' HD2' ' N ' ' A' ' 27' ' ' SER . 63.5 Cg_endo . . . . . 0 N--CA 1.456 -0.69 0 N-CA-C 110.864 -0.475 . . . . 0.0 110.864 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 161' ' ' SER . . . . . 0.482 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 41.2 t -168.43 145.55 3.96 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 124.186 0.994 . . . . 0.0 108.585 175.109 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -157.75 137.84 12.52 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 117.842 0.292 . . . . 0.0 111.434 174.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 12.2 t -135.37 144.98 51.87 Favored Pre-proline 0 N--CA 1.454 -0.227 0 C-N-CA 123.773 0.829 . . . . 0.0 110.362 -178.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -67.81 -0.09 4.95 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 123.186 2.591 . . . . 0.0 110.707 178.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 37.9 m . . . . . 0 CA--C 1.532 0.262 0 C-N-CA 122.582 0.353 . . . . 0.0 110.568 178.688 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.8 t70 . . . . . 0 CA--C 1.535 0.376 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -55.81 -14.77 2.55 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.768 -0.583 . . . . 0.0 111.189 177.388 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.5 tp60 -55.3 -40.18 70.79 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.265 0.626 . . . . 0.0 110.836 177.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -64.44 -38.64 91.72 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.754 0.706 . . . . 0.0 111.004 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -64.46 -55.13 22.86 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.501 0.591 . . . . 0.0 109.897 178.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.8 t -60.04 -55.37 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 -178.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.12 -33.28 67.19 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 123.248 0.619 . . . . 0.0 112.026 -178.163 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 53.5 m -70.22 -45.17 67.11 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.847 0.749 . . . . 0.0 110.415 177.07 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.8 tp -65.6 -33.06 75.04 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.216 0.531 . . . . 0.0 109.741 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -66.72 -45.92 77.15 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 123.916 0.886 . . . . 0.0 110.325 178.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 73.1 m -63.23 -29.45 70.79 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 174.256 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.79 -29.62 64.66 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.545 0.338 . . . . 0.0 110.264 176.538 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt . . . . . 0 CA--C 1.53 0.174 0 C-N-CA 122.894 0.478 . . . . 0.0 111.635 176.116 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.4 mm . . . . . 0 CA--C 1.531 0.222 0 CA-C-O 120.967 0.413 . . . . 0.0 110.389 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.0 t -57.53 136.56 56.74 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 120.974 0.416 . . . . 0.0 110.844 -177.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.59 -24.12 72.4 Favored Glycine 0 CA--C 1.526 0.731 0 CA-C-O 118.999 -0.889 . . . . 0.0 113.911 -172.545 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.422 ' O ' ' HE3' ' A' ' 31' ' ' LYS . 81.0 p -63.36 -35.89 81.9 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 118.958 1.379 . . . . 0.0 111.217 -175.415 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -65.52 -44.54 86.65 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 178.15 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 48.7 mt -61.5 -40.59 86.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -63.68 -38.5 91.36 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 119.241 -0.409 . . . . 0.0 111.415 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.422 ' HE3' ' O ' ' A' ' 27' ' ' SER . 0.0 OUTLIER -64.28 -47.32 79.96 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 118.627 0.649 . . . . 0.0 109.85 175.194 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 92.8 mt -60.28 -56.82 16.89 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 122.395 -0.191 . . . . 0.0 110.973 -178.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.405 HG21 ' OG ' ' A' ' 71' ' ' SER . 75.9 p -58.28 -48.06 81.65 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 t -63.27 -42.48 99.13 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.247 -0.581 . . . . 0.0 111.453 -175.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -75.56 -22.94 56.57 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.99 -55.6 13.77 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 119.043 0.838 . . . . 0.0 109.166 167.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 61.8 mt -69.78 -15.72 63.17 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.21 1.004 . . . . 0.0 113.05 -175.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -57.07 -29.49 63.49 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -178.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.5 t-160 -150.91 -24.65 0.22 Allowed 'General case' 0 N--CA 1.461 0.122 0 N-CA-C 113.994 1.109 . . . . 0.0 113.994 -176.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.405 HG22 HG22 ' A' ' 93' ' ' THR . 40.3 mm 45.73 73.92 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-O 122.06 0.933 . . . . 0.0 111.351 -179.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -138.02 8.63 2.75 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.23 1.012 . . . . 0.0 109.83 178.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.528 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -142.72 109.61 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 125.142 1.377 . . . . 0.0 107.913 -178.301 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.472 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -104.92 -67.96 0.88 Allowed 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -177.342 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.431 ' H ' ' HG2' ' A' ' 43' ' ' GLU . 81.6 p -68.29 -23.16 64.71 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 122.98 0.512 . . . . 0.0 111.894 -173.235 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.622 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -73.36 -54.8 7.45 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.799 0.84 . . . . 0.0 109.299 178.377 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.419 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 8.6 mt -57.25 -45.79 84.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 C-N-CA 122.836 0.454 . . . . 0.0 110.143 175.584 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 14.6 mm -69.5 -47.98 69.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 CA-C-O 119.143 -0.456 . . . . 0.0 111.988 -177.162 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 95.5 p -63.02 -30.65 71.76 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-N 119.294 0.952 . . . . 0.0 110.227 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 46.4 tp -68.66 -45.72 71.0 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 119.15 -0.452 . . . . 0.0 111.772 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.5 pt -73.08 -36.77 51.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 119.192 0.905 . . . . 0.0 111.677 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.474 HD13 HG21 ' A' ' 104' ' ' VAL . 93.7 mt -62.03 -53.33 49.23 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.124 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.513 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.451 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 36.3 t70 -62.67 -31.47 72.37 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.517 179.12 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -61.14 -41.42 96.72 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.424 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.1 t -69.36 -35.99 76.4 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.935 175.707 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.451 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 50.9 tpt85 -66.53 -41.82 88.15 Favored 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -174.773 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 71.7 mt -96.06 -14.51 22.86 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 113.952 1.093 . . . . 0.0 113.952 -172.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 82.0 m -101.61 162.48 20.31 Favored Pre-proline 0 CA--C 1.536 0.432 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -170.33 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_exo -55.68 177.49 0.13 Allowed 'Trans proline' 0 N--CA 1.461 -0.431 1 C-N-CA 125.637 4.225 . . . . 0.0 115.188 179.261 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -56.88 -46.2 82.03 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.28 1.032 . . . . 0.0 113.293 -175.37 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 73.1 m -60.87 -26.88 67.72 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 5.5 m80 -81.77 -23.74 36.43 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 119.243 -0.408 . . . . 0.0 110.803 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -73.82 -44.77 54.77 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.877 0.762 . . . . 0.0 109.23 175.272 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.99 -50.09 65.51 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 177.063 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.59 -41.85 93.8 Favored Glycine 0 C--N 1.337 0.619 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.8 t -67.55 -37.76 83.16 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.713 0.756 . . . . 0.0 110.538 179.452 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 32.1 mt -59.79 -36.12 76.07 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 119.522 1.056 . . . . 0.0 110.756 175.362 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -73.08 -32.76 65.2 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 119.485 -0.886 . . . . 0.0 111.644 176.224 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 79.0 mt -67.04 -48.03 80.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 118.819 0.736 . . . . 0.0 109.915 175.213 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 72.1 mt -61.12 -35.9 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 C-N-CA 124.226 1.01 . . . . 0.0 109.431 178.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -66.91 -45.49 77.77 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 118.88 -0.581 . . . . 0.0 110.418 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.405 ' OG ' HG21 ' A' ' 33' ' ' THR . 7.5 t -63.86 -54.52 33.63 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 118.794 0.724 . . . . 0.0 111.336 -178.213 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 55.5 mt -63.16 -33.77 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.22 -51.95 34.96 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-O 119.545 -0.586 . . . . 0.0 112.437 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.646 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -70.51 -31.83 69.08 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 118.056 0.928 . . . . 0.0 110.625 -178.525 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.71 -46.75 71.33 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -61.29 -46.95 88.21 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 176.443 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 66.4 tp -56.91 -45.63 82.53 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.587 0.355 . . . . 0.0 110.483 -177.236 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -66.61 -48.28 70.0 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.761 179.21 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.9 mm-40 -61.87 -27.77 69.03 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -175.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.2 t -97.79 -24.84 15.27 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 36.9 ptt180 . . . . . 0 N--CA 1.462 0.155 0 CA-C-N 119.346 0.976 . . . . 0.0 111.408 177.358 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.405 HG22 HG22 ' A' ' 40' ' ' ILE . 0.6 OUTLIER . . . . . 0 N--CA 1.462 0.152 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.5 p -50.06 -31.54 13.33 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 -173.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.08 -47.52 82.54 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.872 0.76 . . . . 0.0 109.981 176.284 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -67.69 -31.29 71.15 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.3 0.572 . . . . 0.0 110.4 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.37 -45.93 82.16 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.366 -178.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.6 mt -64.72 -42.73 95.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 174.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -59.75 -32.81 70.91 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 122.546 -0.096 . . . . 0.0 111.034 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.9 m -76.39 -41.39 48.07 Favored 'General case' 0 C--O 1.227 -0.08 0 C-N-CA 122.421 0.288 . . . . 0.0 111.162 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 58.4 mt -61.79 -29.26 70.02 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-N 118.867 0.758 . . . . 0.0 109.166 174.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.99 -14.38 31.11 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-O 119.199 -0.779 . . . . 0.0 113.562 178.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -101.84 -3.81 27.36 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 118.806 1.303 . . . . 0.0 112.136 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.474 HG21 HD13 ' A' ' 51' ' ' ILE . 27.4 m -125.86 -17.97 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.03 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.1 tp -48.96 -30.5 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 C-N-CA 123.171 0.588 . . . . 0.0 112.458 -178.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -64.23 -45.42 88.26 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.24 0.473 . . . . 0.0 110.713 178.242 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -74.07 -38.95 63.78 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.282 0.633 . . . . 0.0 110.082 -178.233 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.0 mt -62.92 -53.04 60.2 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.24 -178.048 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.437 ' O ' HG13 ' A' ' 113' ' ' ILE . 81.0 mt -63.82 -59.11 4.96 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.71 -0.662 . . . . 0.0 109.463 177.788 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 77.7 p -48.82 -45.53 40.63 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 119.008 0.822 . . . . 0.0 112.457 -174.441 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 89.5 m-20 -69.13 -44.76 71.72 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 118.852 0.751 . . . . 0.0 110.764 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.05 -44.88 94.39 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 118.306 0.503 . . . . 0.0 111.434 -177.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -74.73 -33.44 31.24 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.13 0 CA-C-N 118.661 0.664 . . . . 0.0 112.138 179.864 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.21 -26.94 65.97 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.572 176.361 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.75 -17.65 57.34 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 125.963 1.705 . . . . 0.0 110.842 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 37.6 m -83.48 155.89 23.15 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -172.124 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 -103.32 -175.94 2.94 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 169.361 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 22.2 tm0? -55.54 -41.2 72.87 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 119.398 0.999 . . . . 0.0 110.982 -178.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.81 -45.85 87.77 Favored 'General case' 0 C--O 1.233 0.206 0 O-C-N 121.583 -0.698 . . . . 0.0 110.891 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 46.6 m170 -73.29 -37.6 66.19 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 118.783 -0.627 . . . . 0.0 111.737 -176.271 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.72 -34.03 76.95 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 119.278 0.945 . . . . 0.0 109.0 176.308 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -66.04 -41.69 90.54 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -65.39 -42.63 92.42 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 176.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.4 -35.87 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 80.1 ttt-85 -67.77 -34.34 76.61 Favored 'General case' 0 N--CA 1.453 -0.316 0 O-C-N 122.31 -0.244 . . . . 0.0 110.708 177.228 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.2 ttt -66.1 -44.37 84.53 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 176.307 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.422 HD23 ' C ' ' A' ' 127' ' ' LEU . 6.4 tt -56.29 -48.9 75.7 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.099 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 79.0 mt -73.03 -26.54 61.34 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -178.429 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 24.6 t70 . . . . . 0 N--CA 1.455 -0.179 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 175.979 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_endo . . . . . 0 N--CA 1.457 -0.675 0 N-CA-C 110.743 -0.522 . . . . 0.0 110.743 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 38.9 t -68.02 152.47 45.47 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 174.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 162' ' ' TYR . . . . . 0.464 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 17.8 t80 -143.81 132.13 22.03 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 29.2 t -127.59 144.36 50.77 Favored Pre-proline 0 N--CA 1.452 -0.365 0 C-N-CA 123.348 0.659 . . . . 0.0 110.619 177.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -65.54 -7.01 14.91 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 122.888 2.392 . . . . 0.0 111.564 175.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 80.6 p . . . . . 0 CA--C 1.531 0.249 0 C-N-CA 123.043 0.537 . . . . 0.0 111.975 179.193 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.406 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 16.4 t70 . . . . . 0 CA--C 1.533 0.299 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.406 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 18.1 t80 -55.54 -16.03 3.47 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.351 0.66 . . . . 0.0 111.636 179.205 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -56.04 -43.43 77.84 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.737 0.415 . . . . 0.0 111.018 177.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -63.4 -36.87 85.17 Favored 'General case' 0 C--O 1.227 -0.118 0 CA-C-N 118.321 0.509 . . . . 0.0 110.542 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -65.85 -54.44 26.77 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 117.812 0.278 . . . . 0.0 110.366 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 63.9 t -60.63 -53.73 44.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.03 -32.81 68.33 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 123.453 0.701 . . . . 0.0 112.162 -177.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 88.1 m -73.71 -40.88 63.27 Favored 'General case' 0 C--N 1.338 0.101 0 CA-C-N 118.557 0.617 . . . . 0.0 110.469 176.55 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.1 tp -66.7 -30.55 70.81 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.957 0.408 . . . . 0.0 110.061 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -72.65 -40.38 66.4 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.03 0.932 . . . . 0.0 109.691 176.483 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.0 t -62.12 -30.4 71.0 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 174.113 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.64 -41.53 68.7 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 122.917 0.487 . . . . 0.0 109.89 175.316 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.412 ' HB2' ' HE3' ' A' ' 18' ' ' LYS . 39.1 ttmt . . . . . 0 CA--C 1.529 0.164 0 C-N-CA 123.821 0.848 . . . . 0.0 111.269 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.8 mm . . . . . 0 CA--C 1.528 0.107 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.2 m -49.9 124.55 10.11 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.025 0.53 . . . . 0.0 111.951 -174.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.86 -19.41 63.19 Favored Glycine 0 CA--C 1.525 0.659 0 CA-C-O 119.584 -0.565 . . . . 0.0 112.301 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.426 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 42.0 t -66.31 -39.2 89.14 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.173 0.987 . . . . 0.0 110.169 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.6 mmp_? -60.09 -45.66 92.19 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 58.3 mt -65.65 -34.51 70.84 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.924 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.7 tmtt? -63.02 -43.75 97.85 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 122.084 -0.385 . . . . 0.0 110.466 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.426 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.4 OUTLIER -65.26 -43.73 90.38 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 118.152 0.433 . . . . 0.0 110.705 176.251 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.5 mt -62.17 -57.93 9.65 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 121.261 -0.176 . . . . 0.0 110.875 -178.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.565 HG21 ' HB2' ' A' ' 71' ' ' SER . 51.5 p -56.29 -48.98 75.55 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 178.641 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.3 t -63.44 -44.86 93.32 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 120.021 -0.672 . . . . 0.0 111.6 -174.229 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -76.78 -21.33 55.31 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.07 -56.66 9.09 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 167.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 46.9 mt -68.97 -17.51 63.94 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.524 1.13 . . . . 0.0 113.075 -175.484 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -59.9 -26.14 65.66 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -178.663 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -149.04 -28.46 0.28 Allowed 'General case' 0 C--N 1.34 0.154 0 N-CA-C 113.84 1.052 . . . . 0.0 113.84 -175.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.575 HG22 HG22 ' A' ' 93' ' ' THR . 37.9 mm 44.87 74.76 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-O 121.923 0.868 . . . . 0.0 111.605 -179.306 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -147.98 22.41 1.1 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.354 1.062 . . . . 0.0 109.234 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.558 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -148.63 38.83 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.116 0 C-N-CA 124.765 1.226 . . . . 0.0 109.251 -171.176 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.53 ' CD ' ' H ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -52.95 -57.13 11.35 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -174.508 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.53 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 88.4 p -72.67 -26.35 61.6 Favored 'General case' 0 CA--C 1.521 -0.144 0 O-C-N 121.489 -0.757 . . . . 0.0 112.37 -173.293 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.682 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.18 -44.35 16.53 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 119.189 -0.434 . . . . 0.0 109.932 -179.074 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 38.0 mt -55.48 -50.85 63.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 171.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 15.9 mm -66.92 -51.81 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -176.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 73.8 m -57.68 -33.59 68.52 Favored 'General case' 0 N--CA 1.458 -0.058 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.324 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.1 tp -69.4 -45.41 69.3 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 118.582 -0.723 . . . . 0.0 112.083 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 38.1 pt -71.35 -34.42 53.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 119.63 1.105 . . . . 0.0 111.699 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.532 HD13 HG21 ' A' ' 104' ' ' VAL . 97.7 mt -63.05 -55.49 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.09 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -64.51 -27.12 68.75 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.308 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -62.78 -45.56 92.1 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 175.354 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.7 t -61.2 -43.37 98.99 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.903 0.382 . . . . 0.0 110.154 175.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 14.7 tpp180 -59.31 -44.86 92.51 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.801 0.84 . . . . 0.0 112.698 -176.411 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 70.2 mt -89.66 -15.04 33.54 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 -173.252 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 72.5 m -100.5 165.28 14.67 Favored Pre-proline 0 CA--C 1.537 0.461 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -172.406 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.68 177.31 0.24 Allowed 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 125.298 3.998 . . . . 0.0 115.036 -178.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -58.78 -41.47 86.74 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.853 0.861 . . . . 0.0 111.875 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.9 m -60.09 -21.3 61.33 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 177.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -93.55 -20.13 20.54 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 118.848 -0.596 . . . . 0.0 111.141 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.8 mptt -64.49 -46.63 82.15 Favored 'General case' 0 C--N 1.342 0.239 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 167.147 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -65.15 -52.46 55.01 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.47 -42.51 93.91 Favored Glycine 0 C--N 1.338 0.641 0 N-CA-C 111.581 -0.608 . . . . 0.0 111.581 -179.17 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.9 t -68.83 -34.81 76.11 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 117.735 0.767 . . . . 0.0 110.493 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.4 mt -62.57 -32.45 73.43 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 119.47 1.032 . . . . 0.0 110.818 174.134 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -73.81 -31.47 63.26 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.845 0.748 . . . . 0.0 111.417 175.062 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 80.7 mt -72.58 -40.43 62.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 118.622 0.646 . . . . 0.0 110.769 175.365 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.7 mt -66.63 -35.05 73.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -67.17 -45.47 76.89 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 119.023 -0.513 . . . . 0.0 110.82 176.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.565 ' HB2' HG21 ' A' ' 33' ' ' THR . 79.3 p -66.03 -57.14 8.42 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 118.534 0.606 . . . . 0.0 110.832 -176.275 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 59.3 mt -64.19 -32.07 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.76 -55.87 17.69 Favored Glycine 0 CA--C 1.527 0.796 0 CA-C-O 119.813 -0.437 . . . . 0.0 112.52 178.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.635 HH11 ' HG3' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -66.6 -30.8 71.17 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-N 117.964 0.882 . . . . 0.0 110.561 -178.929 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.03 -44.93 71.72 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 122.574 -0.078 . . . . 0.0 110.828 176.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -64.05 -48.24 77.02 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 177.085 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 57.5 tp -58.26 -47.52 83.33 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 122.834 0.454 . . . . 0.0 110.08 -176.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -64.12 -43.15 96.18 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.407 -0.183 . . . . 0.0 110.599 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -65.18 -34.58 78.71 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -175.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.5 t -94.6 -18.63 21.2 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -177.075 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? . . . . . 0 N--CA 1.464 0.229 0 CA-C-N 119.027 0.83 . . . . 0.0 112.802 178.231 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.575 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.226 -0.166 0 CA-C-O 119.718 -0.182 . . . . 0.0 110.868 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.6 p -47.37 -31.74 4.27 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -176.38 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.27 -45.61 87.34 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.807 0.73 . . . . 0.0 109.943 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 46.1 t60 -66.87 -29.62 69.57 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 123.482 0.713 . . . . 0.0 109.927 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.17 -43.82 77.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 123.045 0.538 . . . . 0.0 110.548 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.17 -43.58 98.91 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.069 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 174.087 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -59.53 -33.83 71.87 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.682 -0.236 . . . . 0.0 111.13 178.535 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.1 m -73.72 -42.05 61.72 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 122.302 -0.249 . . . . 0.0 111.218 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 48.7 mt -60.39 -30.21 69.44 Favored 'General case' 0 C--N 1.339 0.126 0 O-C-N 121.418 -0.802 . . . . 0.0 109.274 173.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.43 -14.91 22.15 Favored Glycine 0 CA--C 1.531 1.076 0 CA-C-O 119.112 -0.827 . . . . 0.0 113.918 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -100.82 -6.92 24.15 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.016 1.408 . . . . 0.0 112.074 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.532 HG21 HD13 ' A' ' 51' ' ' ILE . 27.1 m -123.42 -17.91 4.42 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -177.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.434 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.0 tp -55.22 -26.08 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 CA-C-N 118.246 0.476 . . . . 0.0 111.527 -177.111 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.402 ' HG2' ' H ' ' A' ' 106' ' ' GLN . 16.9 pt20 -61.54 -53.32 57.86 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.379 0.672 . . . . 0.0 111.65 176.39 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -75.55 -34.48 60.73 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 122.002 -0.436 . . . . 0.0 110.912 -178.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 88.9 mt -62.38 -46.94 86.37 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.554 ' O ' HD12 ' A' ' 113' ' ' ILE . 55.9 mt -71.31 -53.95 12.49 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 118.532 -0.747 . . . . 0.0 111.19 179.245 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 69.2 p -55.06 -35.76 64.86 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 119.033 0.833 . . . . 0.0 111.118 -176.072 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -70.1 -48.62 56.87 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-N 118.798 0.726 . . . . 0.0 110.269 173.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.96 -34.39 65.64 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.984 0.914 . . . . 0.0 113.369 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.554 HD12 ' O ' ' A' ' 109' ' ' LEU . 0.2 OUTLIER -84.5 -38.08 13.27 Favored 'Isoleucine or valine' 0 C--N 1.343 0.288 0 C-N-CA 117.482 -1.687 . . . . 0.0 112.667 170.794 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.27 -22.42 66.94 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.881 0.764 . . . . 0.0 110.85 -178.722 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.04 -17.11 30.02 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.064 0.946 . . . . 0.0 110.995 178.317 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.42 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 53.1 p -85.41 167.57 15.4 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -172.287 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -102.5 177.17 4.94 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 168.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.3 -33.27 63.13 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 118.546 0.612 . . . . 0.0 112.32 -176.747 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -70.63 -49.93 42.36 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 122.03 -0.419 . . . . 0.0 111.312 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.42 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 6.2 m170 -67.56 -34.07 76.31 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-O 119.052 -0.499 . . . . 0.0 110.41 179.454 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.5 ttpt -55.67 -51.94 65.55 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 118.736 0.698 . . . . 0.0 109.204 171.106 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -58.94 -38.96 80.22 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 120.674 -0.411 . . . . 0.0 110.864 -176.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.8 mtpp -63.06 -41.59 99.5 Favored 'General case' 0 N--CA 1.455 -0.187 0 O-C-N 122.338 -0.226 . . . . 0.0 110.955 175.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 97.9 mt -67.65 -36.45 76.13 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 O-C-N 121.863 -0.523 . . . . 0.0 109.595 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -66.26 -32.58 74.08 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 176.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.4 ttt -65.67 -42.68 91.04 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 175.075 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 89.2 mt -58.99 -43.32 91.46 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.119 175.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.1 mt -65.62 -36.1 82.73 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 117.676 0.216 . . . . 0.0 111.315 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.0 t70 . . . . . 0 N--CA 1.454 -0.24 0 CA-C-N 118.05 0.386 . . . . 0.0 110.51 178.313 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo . . . . . 0 N--CA 1.451 -1.001 0 N-CA-C 110.119 -0.762 . . . . 0.0 110.119 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 36.5 t -69.12 156.83 38.02 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 176.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 162' ' ' TYR . . . . . 0.418 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 13.0 t80 -145.99 131.89 19.14 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.575 0.35 . . . . 0.0 110.988 -179.17 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 31.2 t -119.65 128.83 25.69 Favored Pre-proline 0 N--CA 1.452 -0.329 0 C-N-CA 122.95 0.5 . . . . 0.0 110.153 175.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.15 -16.25 48.41 Favored 'Trans proline' 0 N--CA 1.449 -1.091 0 C-N-CA 122.64 2.227 . . . . 0.0 109.696 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 2.1 m . . . . . 0 N--CA 1.453 -0.304 0 C-N-CA 123.972 0.909 . . . . 0.0 112.47 -175.367 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 15.2 t70 . . . . . 0 CA--C 1.536 0.429 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -55.18 -14.38 1.67 Allowed 'General case' 0 C--N 1.339 0.111 0 C-N-CA 123.483 0.713 . . . . 0.0 111.507 178.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -54.56 -42.88 71.5 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.264 0.626 . . . . 0.0 110.481 177.04 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 56.1 m-20 -55.91 -46.35 78.42 Favored 'General case' 0 C--O 1.227 -0.104 0 CA-C-N 118.285 0.493 . . . . 0.0 110.51 177.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -65.98 -50.03 65.74 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 117.777 0.262 . . . . 0.0 110.591 -176.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.8 t -63.72 -54.6 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 -178.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.89 -32.72 67.99 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.069 0.548 . . . . 0.0 111.897 -178.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 80.0 m -73.02 -41.46 64.21 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 118.312 0.505 . . . . 0.0 110.525 177.112 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.2 tp -66.12 -32.7 74.31 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.086 0.47 . . . . 0.0 110.097 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -68.58 -43.49 76.41 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.967 0.907 . . . . 0.0 109.616 175.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 65.4 m -64.39 -26.36 68.43 Favored 'General case' 0 C--O 1.227 -0.105 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 175.231 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.423 ' CE2' HD11 ' A' ' 68' ' ' ILE . 0.1 OUTLIER -71.81 -40.55 69.06 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 175.574 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 87.4 tttt . . . . . 0 N--CA 1.456 -0.157 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 176.123 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 19.7 mm . . . . . 0 CA--C 1.528 0.109 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.0 m -50.56 127.99 19.18 Favored 'General case' 0 CA--C 1.522 -0.099 0 C-N-CA 122.954 0.502 . . . . 0.0 111.641 -174.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.55 -20.11 67.59 Favored Glycine 0 CA--C 1.526 0.758 0 CA-C-O 119.098 -0.834 . . . . 0.0 112.546 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.428 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 40.3 t -66.05 -37.19 85.23 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 118.801 1.3 . . . . 0.0 110.059 -178.653 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.5 mmp_? -61.99 -49.0 77.83 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 176.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.6 mt -61.5 -38.53 80.33 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.883 -179.198 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -65.76 -38.96 90.51 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 118.954 -0.546 . . . . 0.0 111.291 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.1 OUTLIER -66.61 -41.38 88.51 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 119.279 0.945 . . . . 0.0 110.238 175.52 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.2 mt -62.0 -57.47 11.55 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 119.55 -0.262 . . . . 0.0 111.042 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.527 HG21 ' HB2' ' A' ' 71' ' ' SER . 66.6 p -56.85 -42.46 79.74 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 118.228 0.467 . . . . 0.0 111.707 177.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.7 m -55.44 -56.27 22.1 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 119.234 -0.413 . . . . 0.0 110.873 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -69.35 -32.72 71.97 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 118.524 -1.27 . . . . 0.0 111.815 -175.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.29 -58.4 8.78 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 174.267 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.7 mt -71.36 -15.81 62.4 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.711 0.804 . . . . 0.0 112.697 -174.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -61.09 -28.42 69.07 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 25.0 t60 -150.76 -24.37 0.22 Allowed 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -175.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.5 HG22 HG22 ' A' ' 93' ' ' THR . 30.3 mm 46.65 74.67 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-O 121.645 0.736 . . . . 0.0 111.522 -178.923 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -147.62 21.16 1.17 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.898 0.879 . . . . 0.0 109.918 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.555 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.01 37.76 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.087 0 C-N-CA 124.331 1.052 . . . . 0.0 109.365 -171.707 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.467 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -53.2 -54.19 39.67 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -174.676 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 81.0 p -75.22 -28.42 59.92 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -173.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.703 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -79.44 -45.41 19.5 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -179.247 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 24.4 mt -56.11 -51.76 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 172.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.431 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 11.7 mm -66.17 -50.83 65.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-O 119.02 -0.514 . . . . 0.0 112.124 -176.291 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 63.6 m -58.03 -33.55 69.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 119.198 0.908 . . . . 0.0 110.558 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 54.1 tp -70.06 -43.36 71.37 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 36.5 pt -73.24 -35.48 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-N 119.588 1.086 . . . . 0.0 111.927 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.475 HD13 HG21 ' A' ' 104' ' ' VAL . 96.8 mt -64.02 -52.37 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 178.079 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.411 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 37.3 t70 -62.39 -30.53 71.27 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.286 178.252 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -61.37 -42.51 98.82 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 175.216 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.1 t -68.39 -35.73 78.1 Favored 'General case' 0 C--N 1.338 0.098 0 O-C-N 122.097 -0.377 . . . . 0.0 110.701 175.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.411 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 8.3 tpt180 -64.82 -42.24 95.12 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.925 0.89 . . . . 0.0 113.056 -174.762 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 79.6 mt -91.24 -14.31 31.19 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -174.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 71.1 m -106.1 155.53 38.32 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -170.236 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.69 -174.95 0.79 Allowed 'Trans proline' 0 N--CA 1.459 -0.52 1 C-N-CA 125.788 4.325 . . . . 0.0 113.823 -179.422 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -53.77 -45.1 70.54 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 125.732 1.613 . . . . 0.0 114.738 -170.561 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 73.3 m -61.21 -27.33 68.36 Favored 'General case' 0 CA--C 1.523 -0.06 0 CA-C-N 118.484 0.584 . . . . 0.0 110.152 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 24.0 m170 -91.58 -16.99 26.29 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.263 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -66.09 -47.57 73.79 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 169.207 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 58.4 tp -66.86 -48.64 68.17 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.449 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.11 -46.45 92.67 Favored Glycine 0 C--N 1.338 0.643 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.8 t -62.65 -45.22 93.85 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 117.495 0.647 . . . . 0.0 110.069 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 25.2 mt -54.22 -41.18 68.37 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 119.162 0.892 . . . . 0.0 110.774 176.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -68.31 -27.0 65.91 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.028 0.831 . . . . 0.0 111.263 178.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.423 HD11 ' CE2' ' A' ' 17' ' ' PHE . 72.0 mt -75.12 -44.4 43.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 CA-C-N 118.247 0.476 . . . . 0.0 111.23 174.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 1.6 mp -60.33 -34.69 58.49 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 175.437 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.425 ' CG ' HH22 ' A' ' 74' ' ' ARG . 38.3 t70 -71.53 -45.4 62.47 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.744 1.218 . . . . 0.0 111.584 -178.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.527 ' HB2' HG21 ' A' ' 33' ' ' THR . 65.8 p -67.29 -56.04 11.42 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 119.009 0.822 . . . . 0.0 110.478 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 49.2 mt -63.37 -32.27 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.6 -55.68 21.44 Favored Glycine 0 CA--C 1.525 0.677 0 CA-C-O 119.65 -0.528 . . . . 0.0 112.02 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.425 HH22 ' CG ' ' A' ' 70' ' ' ASP . 5.1 ptp85 -67.14 -32.85 74.24 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 118.086 0.943 . . . . 0.0 110.658 -178.653 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.87 -44.7 69.26 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 121.514 -0.074 . . . . 0.0 110.803 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.2 m-30 -62.45 -47.93 81.86 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 176.543 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -59.17 -47.76 84.12 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 123.344 0.402 . . . . 0.0 110.144 -176.513 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -62.27 -47.74 83.01 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 120.515 0.198 . . . . 0.0 110.651 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -66.11 -38.04 87.23 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 121.039 -0.264 . . . . 0.0 111.591 -175.275 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 6.2 t -82.61 -19.42 38.41 Favored 'General case' 0 C--O 1.226 -0.138 0 CA-C-N 118.108 0.413 . . . . 0.0 111.592 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 79.8 ttt-85 . . . . . 0 C--N 1.339 0.133 0 CA-C-N 117.978 0.354 . . . . 0.0 111.351 174.763 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.5 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.307 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.6 p -52.52 -28.88 22.44 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.162 0.985 . . . . 0.0 113.546 -176.219 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.11 -46.17 88.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.819 0.736 . . . . 0.0 109.758 176.274 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 9.4 m170 -73.38 -24.28 60.29 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.506 178.561 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.431 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -63.67 -46.45 85.5 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 175.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.1 mt -64.46 -44.24 96.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.171 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 176.35 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -58.17 -36.39 72.98 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 122.516 -0.115 . . . . 0.0 111.042 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.3 m -74.04 -41.03 62.41 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-O 119.626 -0.226 . . . . 0.0 111.482 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.4 mt -60.36 -30.21 69.41 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.824 0.738 . . . . 0.0 109.348 174.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.0 -15.44 21.13 Favored Glycine 0 CA--C 1.528 0.861 0 CA-C-O 119.222 -0.765 . . . . 0.0 113.967 179.103 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -101.3 -6.02 24.68 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.01 1.405 . . . . 0.0 112.28 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.475 HG21 HD13 ' A' ' 51' ' ' ILE . 35.0 m -123.02 -16.72 5.14 Favored 'Isoleucine or valine' 0 C--N 1.339 0.135 0 C-N-CA 122.941 0.496 . . . . 0.0 112.005 -178.163 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.44 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.6 tp -52.2 -26.34 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 122.884 0.474 . . . . 0.0 111.58 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.2 pt20 -63.89 -48.03 78.25 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.037 0.535 . . . . 0.0 111.57 178.017 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -79.39 -31.39 42.78 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 118.107 0.412 . . . . 0.0 110.721 -178.485 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.0 mp -61.67 -53.3 57.93 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.4 ' O ' HG13 ' A' ' 113' ' ' ILE . 85.5 mt -66.07 -56.72 10.13 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 118.621 -0.704 . . . . 0.0 110.389 178.18 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 80.9 p -54.02 -40.57 67.15 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 119.238 0.926 . . . . 0.0 112.229 -174.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -71.04 -47.04 60.82 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 119.465 1.029 . . . . 0.0 110.357 176.45 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.22 -37.92 72.95 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 118.949 -0.548 . . . . 0.0 111.904 -177.706 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -82.92 -33.93 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 119.058 0.845 . . . . 0.0 111.925 177.041 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.84 -28.22 67.37 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 119.789 -0.764 . . . . 0.0 111.028 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.21 -14.76 45.82 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.466 0.707 . . . . 0.0 111.053 177.368 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.41 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 32.4 p -74.39 159.57 32.16 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 -171.657 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.1 t-20 -96.25 174.39 6.91 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 169.001 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -55.42 -43.58 75.45 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.231 0.923 . . . . 0.0 111.507 -176.477 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -66.01 -40.78 91.38 Favored 'General case' 0 CA--C 1.527 0.093 0 O-C-N 121.856 -0.528 . . . . 0.0 110.529 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.41 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 40.2 m80 -69.94 -38.77 76.28 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.376 -0.345 . . . . 0.0 110.996 -178.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -39.3 90.14 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 174.295 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -66.06 -38.35 88.1 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.563 -178.057 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -64.33 -42.79 96.11 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 121.071 -0.251 . . . . 0.0 111.013 175.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.7 mt -67.17 -34.81 71.8 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -66.54 -36.06 81.76 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 122.75 0.42 . . . . 0.0 110.454 176.637 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.3 ttt -65.56 -42.13 92.16 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 109.668 -0.494 . . . . 0.0 109.668 176.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.41 HD23 ' C ' ' A' ' 127' ' ' LEU . 7.2 tt -58.05 -49.9 75.28 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 176.635 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.79 -30.29 69.69 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 122.264 -0.273 . . . . 0.0 111.715 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 36.7 t70 . . . . . 0 N--CA 1.454 -0.245 0 CA-C-N 118.144 0.429 . . . . 0.0 110.058 177.63 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 160' ' ' PRO . . . . . 0.409 ' HD2' ' N ' ' A' ' 27' ' ' SER . 85.3 Cg_endo . . . . . 0 N--CA 1.456 -0.68 0 N-CA-C 109.509 -0.997 . . . . 0.0 109.509 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 67.9 p -72.83 157.29 37.77 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.675 0.274 . . . . 0.0 111.12 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 162' ' ' TYR . . . . . 0.411 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 4.2 t80 -144.25 129.62 18.87 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 123.338 0.655 . . . . 0.0 109.771 178.318 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 28.8 t -125.65 138.16 31.37 Favored Pre-proline 0 N--CA 1.454 -0.246 0 C-N-CA 123.144 0.577 . . . . 0.0 111.512 -177.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -67.83 -1.59 7.11 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 123.556 2.837 . . . . 0.0 111.44 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 57.2 p . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 118.673 -0.68 . . . . 0.0 112.145 -179.642 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.424 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 27.2 t70 . . . . . 0 CA--C 1.533 0.323 0 N-CA-C 109.182 -0.674 . . . . 0.0 109.182 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.424 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 19.9 t80 -55.79 -14.44 2.34 Favored 'General case' 0 CA--C 1.532 0.28 0 O-C-N 121.721 -0.612 . . . . 0.0 111.484 178.27 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.8 tp60 -54.25 -40.23 67.57 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.678 0.791 . . . . 0.0 110.877 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -63.42 -39.48 94.6 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 118.779 0.718 . . . . 0.0 110.703 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.1 t80 -64.6 -54.3 34.18 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 118.464 0.575 . . . . 0.0 109.795 179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.6 t -59.57 -55.67 22.32 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.145 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 -178.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.1 -33.17 67.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.507 0.723 . . . . 0.0 112.197 -178.021 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 60.2 m -70.73 -44.97 65.74 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.705 0.684 . . . . 0.0 110.33 176.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.7 tp -65.36 -33.72 76.63 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.235 0.54 . . . . 0.0 110.071 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -66.34 -46.87 75.31 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.49 0.716 . . . . 0.0 109.757 177.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 61.6 m -63.86 -26.52 68.65 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -69.54 -45.7 68.17 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 177.123 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 15.7 pttm . . . . . 0 CA--C 1.529 0.167 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -177.594 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.5 mm . . . . . 0 CA--C 1.533 0.317 0 CA-C-O 120.842 0.353 . . . . 0.0 110.408 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.4 t -57.12 136.21 56.38 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.963 0.411 . . . . 0.0 111.146 -177.259 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -71.95 -22.18 78.84 Favored Glycine 0 CA--C 1.524 0.643 0 CA-C-O 119.072 -0.849 . . . . 0.0 114.601 -170.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 79.7 p -64.39 -38.7 91.96 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 119.384 1.592 . . . . 0.0 111.635 -174.379 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.6 mpt_? -65.69 -40.74 92.66 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 42.4 mt -64.89 -36.07 76.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 178.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.3 mmtt -65.35 -39.87 92.89 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.606 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.36 -48.57 77.39 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 118.746 0.703 . . . . 0.0 110.382 174.842 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.1 mt -59.66 -59.16 5.88 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 122.293 -0.255 . . . . 0.0 110.872 -178.238 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 59.4 p -55.67 -47.62 76.4 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.8 t -63.9 -43.04 97.2 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.528 -176.186 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -74.56 -22.78 58.81 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.695 0.68 . . . . 0.0 112.811 -178.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.5 -56.46 9.45 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.895 0.77 . . . . 0.0 109.545 167.461 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 65.6 mt -69.88 -14.89 62.95 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.931 0.892 . . . . 0.0 113.076 -175.187 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -55.81 -30.59 61.61 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -178.555 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.9 t-80 -151.9 -23.61 0.19 Allowed 'General case' 0 C--N 1.34 0.174 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -176.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 41.1 mm 46.18 73.51 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 121.941 0.877 . . . . 0.0 111.446 -178.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -136.63 9.33 3.11 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.272 1.029 . . . . 0.0 109.207 177.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.536 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -142.97 111.77 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 C-N-CA 125.125 1.37 . . . . 0.0 107.692 -177.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.471 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -108.13 -64.05 1.26 Allowed 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.686 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 74.0 p -68.75 -24.15 64.41 Favored 'General case' 0 CA--C 1.521 -0.15 0 C-N-CA 123.096 0.558 . . . . 0.0 111.909 -173.022 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.617 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -74.82 -53.72 8.61 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.995 0.918 . . . . 0.0 109.143 179.715 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.419 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 10.1 mt -57.22 -47.08 84.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 C-N-CA 123.129 0.572 . . . . 0.0 110.165 175.256 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.424 HD13 ' HA ' ' A' ' 47' ' ' ILE . 12.7 mm -69.47 -46.95 74.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-O 119.067 -0.492 . . . . 0.0 111.652 -176.688 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.0 m -61.31 -33.4 73.52 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 119.318 -0.953 . . . . 0.0 109.891 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.6 tp -68.07 -44.97 75.1 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 119.183 -0.437 . . . . 0.0 112.037 -178.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.5 pt -73.51 -35.69 45.86 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-N 119.207 0.912 . . . . 0.0 111.871 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.475 HD13 HG21 ' A' ' 104' ' ' VAL . 96.0 mt -64.29 -49.34 81.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 178.631 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -58.32 -40.8 83.01 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.777 177.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -57.68 -42.46 83.65 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 175.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.0 t -65.41 -47.05 77.61 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -75.48 -24.74 56.96 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -174.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 53.6 mt -81.53 -15.44 54.85 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 178.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.403 ' HB3' ' CG ' ' A' ' 61' ' ' HIS . 74.4 m -120.78 153.77 57.12 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -171.65 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -74.23 -169.54 0.6 Allowed 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 125.178 3.919 . . . . 0.0 114.26 -175.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -35.02 -59.99 0.48 Allowed 'General case' 0 C--O 1.236 0.345 0 C-N-CA 128.258 2.623 . . . . 0.0 115.787 -172.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.8 p -59.79 -26.29 65.61 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 122.309 -0.245 . . . . 0.0 110.987 -175.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.403 ' CG ' ' HB3' ' A' ' 57' ' ' CYS . 40.0 m80 -89.6 -18.87 25.73 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 119.625 -0.226 . . . . 0.0 110.946 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -66.04 -49.1 68.9 Favored 'General case' 0 C--N 1.343 0.322 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 171.119 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.5 mt -67.27 -44.6 78.91 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.502 178.567 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.71 -50.88 61.67 Favored Glycine 0 C--N 1.335 0.504 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.589 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 9.9 t -65.75 -36.88 84.83 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 118.749 -0.644 . . . . 0.0 110.963 -178.303 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 66' ' ' LEU . 36.2 mt -60.99 -39.11 88.38 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 119.655 1.116 . . . . 0.0 111.635 176.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -72.21 -31.67 66.07 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.349 0.977 . . . . 0.0 111.094 177.735 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 64.3 mt -71.91 -47.63 54.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 O-C-N 121.895 -0.503 . . . . 0.0 110.529 177.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.4 mt -59.84 -37.19 70.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.179 0 C-N-CA 124.258 1.023 . . . . 0.0 109.213 176.063 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -66.19 -47.48 73.79 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 118.987 -0.53 . . . . 0.0 110.868 178.11 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.8 t -64.52 -53.73 43.4 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 118.615 0.643 . . . . 0.0 111.129 -176.779 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 57.2 mt -63.27 -34.2 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 179.08 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.06 -51.35 39.78 Favored Glycine 0 CA--C 1.526 0.734 0 CA-C-O 119.823 -0.432 . . . . 0.0 112.492 -178.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.635 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -71.17 -31.46 67.68 Favored 'General case' 0 C--N 1.338 0.085 0 CA-C-N 117.996 0.898 . . . . 0.0 111.008 -178.894 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.87 -43.84 74.51 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 176.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.0 m-30 -62.38 -45.89 91.12 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 175.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.11 -46.57 87.99 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 123.358 0.411 . . . . 0.0 110.287 -176.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -64.18 -45.17 89.56 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.598 0.237 . . . . 0.0 110.565 178.745 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -62.75 -39.51 94.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -175.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.6 t -84.33 -28.08 27.31 Favored 'General case' 0 C--O 1.232 0.148 0 O-C-N 122.093 -0.38 . . . . 0.0 111.8 -177.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 . . . . . 0 C--N 1.341 0.238 0 CA-C-N 118.412 0.551 . . . . 0.0 111.523 175.64 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.408 ' HA ' ' HB3' ' A' ' 43' ' ' GLU . 0.6 OUTLIER . . . . . 0 CA--C 1.533 0.289 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.0 p -50.22 -32.85 17.63 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.475 1.51 . . . . 0.0 114.813 -172.217 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.54 -47.0 87.54 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.225 0.921 . . . . 0.0 109.799 177.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 55.3 m-70 -78.15 -17.37 56.93 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.235 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.75 -44.67 80.87 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 173.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.6 mt -63.61 -44.35 98.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.187 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -57.78 -35.28 70.58 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.981 -0.099 . . . . 0.0 111.154 178.474 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.9 m -74.39 -41.77 60.39 Favored 'General case' 0 C--N 1.339 0.15 0 O-C-N 122.291 -0.256 . . . . 0.0 111.309 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 52.1 mt -60.28 -30.15 69.28 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 174.483 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.44 -14.63 28.31 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-O 119.08 -0.844 . . . . 0.0 113.641 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -100.81 -4.76 27.32 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.95 1.375 . . . . 0.0 112.075 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.475 HG21 HD13 ' A' ' 51' ' ' ILE . 34.5 m -124.48 -21.8 2.68 Favored 'Isoleucine or valine' 0 C--N 1.338 0.086 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -178.092 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.414 ' HA ' HD12 ' A' ' 105' ' ' ILE . 11.0 tp -52.83 -26.67 11.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 123.277 0.631 . . . . 0.0 112.294 -175.832 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.2 pt20 -62.85 -45.2 93.7 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 122.942 0.497 . . . . 0.0 111.255 177.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -74.01 -39.2 63.77 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.091 0.472 . . . . 0.0 110.132 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 68.8 mt -62.05 -50.49 71.77 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.459 -177.087 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.405 ' O ' HG13 ' A' ' 113' ' ' ILE . 66.2 mt -65.63 -56.79 10.32 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.286 176.355 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 87.5 p -50.66 -41.65 55.65 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 119.181 0.9 . . . . 0.0 111.893 -174.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -70.74 -50.79 32.36 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 118.791 0.723 . . . . 0.0 111.148 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.483 ' O ' ' HE3' ' A' ' 115' ' ' LYS . . . -56.24 -32.4 64.42 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.599 0.76 . . . . 0.0 112.855 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -84.85 -38.35 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 CA-C-N 119.673 1.124 . . . . 0.0 111.788 174.772 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.25 -26.44 65.68 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 121.956 -0.465 . . . . 0.0 111.186 -179.362 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.483 ' HE3' ' O ' ' A' ' 112' ' ' ALA . 0.2 OUTLIER -80.73 -21.01 41.54 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.13 0.572 . . . . 0.0 110.075 177.414 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.3 m -80.93 169.86 17.0 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 122.063 0.935 . . . . 0.0 113.494 -173.307 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -105.78 -176.89 3.21 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 114.124 -1.398 . . . . 0.0 107.262 169.187 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' GLN . . . . . 0.42 ' O ' ' HE2' ' A' ' 121' ' ' LYS . 50.4 mm-40 -55.97 -35.91 67.25 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.789 -0.569 . . . . 0.0 112.031 -177.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -71.36 -49.6 40.61 Favored 'General case' 0 N--CA 1.456 -0.173 0 O-C-N 121.932 -0.48 . . . . 0.0 111.475 -177.364 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 49.4 m-70 -69.39 -34.6 74.75 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 122.191 -0.318 . . . . 0.0 110.679 -179.262 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.42 ' HE2' ' O ' ' A' ' 118' ' ' GLN . 4.7 ttpt -56.67 -48.35 77.8 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 108.301 -0.999 . . . . 0.0 108.301 171.349 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -59.56 -39.73 85.0 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.919 -176.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -60.72 -44.37 96.69 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.28 175.366 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.8 mt -68.35 -34.26 64.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-O 120.757 0.313 . . . . 0.0 110.164 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 69.6 ttt-85 -69.66 -35.33 75.08 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.077 0.551 . . . . 0.0 109.908 178.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 62.8 ttp -68.37 -38.8 81.73 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 176.029 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.6 tt -58.95 -45.75 89.7 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 81.6 mt -66.31 -34.27 77.61 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 177.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.9 t70 . . . . . 0 CA--C 1.536 0.411 0 CA-C-N 118.205 0.457 . . . . 0.0 110.446 178.4 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo . . . . . 0 N--CA 1.458 -0.579 0 N-CA-C 110.494 -0.618 . . . . 0.0 110.494 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 50.1 m -63.74 147.32 51.99 Favored 'General case' 0 C--O 1.231 0.096 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 175.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 162' ' ' TYR . . . . . 0.464 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 17.2 t80 -145.93 131.12 18.42 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 178.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 163' ' ' SER . . . . . 0.404 ' HA ' ' HD3' ' B' ' 164' ' ' PRO . 29.4 t -135.44 135.45 22.37 Favored Pre-proline 0 C--O 1.234 0.265 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.878 176.535 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 164' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' B' ' 163' ' ' SER . 52.9 Cg_exo -56.58 -17.34 21.89 Favored 'Trans proline' 0 N--CA 1.451 -1.009 0 C-N-CA 123.23 2.62 . . . . 0.0 112.443 175.227 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 73.3 p . . . . . 0 C--N 1.341 0.227 0 N-CA-C 113.196 0.814 . . . . 0.0 113.196 -174.043 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.437 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 17.3 t70 . . . . . 0 CA--C 1.535 0.367 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.437 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 13.3 t80 -55.62 -14.82 2.36 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.335 0.654 . . . . 0.0 111.036 178.288 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -55.33 -34.56 64.31 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.505 1.122 . . . . 0.0 111.304 176.348 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 40.8 m-20 -66.38 -44.2 83.79 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 119.2 0.909 . . . . 0.0 109.927 178.06 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -64.44 -50.23 68.38 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 -178.331 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 88.1 t -62.53 -57.71 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 -179.102 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.42 -32.32 64.75 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -177.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 78.9 m -72.43 -44.03 62.99 Favored 'General case' 0 C--N 1.338 0.079 0 O-C-N 121.798 -0.564 . . . . 0.0 110.78 176.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.0 tp -65.62 -31.59 72.71 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -69.73 -43.1 73.01 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 124.001 0.921 . . . . 0.0 109.546 176.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.8 t -60.07 -31.47 70.04 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -36.91 68.63 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.231 0.212 . . . . 0.0 110.592 175.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt . . . . . 0 C--N 1.339 0.134 0 C-N-CA 123.808 0.843 . . . . 0.0 111.18 179.186 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 17.4 mm . . . . . 0 CA--C 1.528 0.12 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.4 m -54.21 123.38 12.62 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-O 121.063 0.459 . . . . 0.0 111.481 -175.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -69.77 -14.98 70.82 Favored Glycine 0 CA--C 1.525 0.675 0 CA-C-O 119.13 -0.817 . . . . 0.0 113.288 -177.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.4 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 43.1 t -64.02 -43.63 95.04 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 118.914 1.357 . . . . 0.0 109.816 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 83.6 mtt85 -65.32 -41.42 94.01 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.3 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 53.1 mt -59.01 -41.46 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.103 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 176.271 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.3 tmtt? -60.79 -44.72 96.45 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.772 0.429 . . . . 0.0 111.256 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.4 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.3 OUTLIER -63.66 -40.99 98.23 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 118.72 0.691 . . . . 0.0 110.925 177.909 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 92.2 mt -63.66 -53.4 51.93 Favored 'General case' 0 C--O 1.233 0.202 0 O-C-N 122.534 -0.104 . . . . 0.0 110.782 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 48.4 p -60.94 -39.65 90.27 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.1 m -55.5 -57.7 10.8 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 122.876 0.47 . . . . 0.0 110.572 178.305 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -67.95 -35.09 77.81 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 118.908 -1.117 . . . . 0.0 111.942 -175.084 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.95 -58.3 9.27 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.422 0.556 . . . . 0.0 110.336 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 53.0 mt -72.21 -15.74 61.94 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.847 0.859 . . . . 0.0 112.913 -174.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -61.94 -24.69 67.14 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -150.85 -26.69 0.22 Allowed 'General case' 0 C--N 1.338 0.102 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -175.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 34.9 mm 44.97 73.59 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-O 121.768 0.794 . . . . 0.0 111.283 -178.35 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -137.53 9.26 2.89 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.114 0.966 . . . . 0.0 110.137 178.636 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.537 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.5 pt -143.64 119.62 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 C-N-CA 125.205 1.402 . . . . 0.0 107.837 -178.069 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.409 ' HG2' ' N ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -114.92 -66.89 1.04 Allowed 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -179.192 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.409 ' N ' ' HG2' ' A' ' 43' ' ' GLU . 79.4 p -67.84 -23.19 65.13 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 122.851 0.46 . . . . 0.0 111.774 -173.764 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.621 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -75.46 -52.63 10.25 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.263 1.025 . . . . 0.0 109.399 179.475 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.433 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 7.4 mt -59.72 -44.33 93.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 C-N-CA 123.02 0.528 . . . . 0.0 110.352 176.207 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.426 HD12 HD11 ' A' ' 101' ' ' LEU . 12.3 mm -71.33 -47.63 58.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 O-C-N 122.258 -0.276 . . . . 0.0 111.681 -177.51 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.3 t -57.68 -35.02 70.03 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 176.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.4 tp -68.26 -45.67 72.51 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 118.442 -0.789 . . . . 0.0 112.184 -179.021 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 26.3 pt -73.01 -35.77 49.39 Favored 'Isoleucine or valine' 0 C--N 1.342 0.258 0 CA-C-N 120.03 1.286 . . . . 0.0 112.149 -179.206 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 95.8 mt -66.15 -50.73 66.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-O 121.431 0.634 . . . . 0.0 109.336 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -60.77 -40.38 92.3 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.317 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -55.67 -43.08 76.0 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 175.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.4 ' HB2' ' HB2' ' A' ' 65' ' ' SER . 11.1 p -62.49 -51.5 67.2 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 119.442 -0.314 . . . . 0.0 110.96 -177.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.42 -20.45 66.37 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 118.585 0.63 . . . . 0.0 112.314 -177.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 69.8 mt -79.27 -14.74 58.84 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 173.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 59.6 m -95.17 163.49 21.67 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -173.244 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -74.04 -137.81 0.02 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.62 1 C-N-CA 125.606 4.204 . . . . 0.0 109.25 170.241 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -55.54 -26.89 45.75 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 119.361 0.982 . . . . 0.0 111.966 178.735 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 25.5 m -58.51 -21.27 51.48 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.962 0.505 . . . . 0.0 110.564 175.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -55.21 -72.36 0.07 Allowed 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 174.094 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -59.11 -60.37 3.97 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -175.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 35.1 tp -73.58 -47.47 40.26 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 119.619 -0.832 . . . . 0.0 112.203 -170.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.55 -41.78 93.91 Favored Glycine 0 C--N 1.335 0.479 0 N-CA-C 110.586 -1.005 . . . . 0.0 110.586 -175.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.4 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 11.4 t -68.2 -44.03 76.75 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 117.76 0.78 . . . . 0.0 110.4 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 66' ' ' LEU . 49.6 mt -55.48 -42.04 73.83 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 119.704 -0.799 . . . . 0.0 111.178 178.129 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -71.12 -40.93 71.13 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.327 0.967 . . . . 0.0 112.372 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 89.1 mt -65.56 -45.9 91.19 Favored 'Isoleucine or valine' 0 C--N 1.341 0.228 0 CA-C-N 118.868 0.758 . . . . 0.0 109.847 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.0 mt -59.64 -36.63 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 C-N-CA 123.368 0.667 . . . . 0.0 109.432 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -66.44 -46.52 76.2 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 119.144 -0.455 . . . . 0.0 111.019 -179.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.6 m -67.63 -51.23 52.61 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 118.955 0.798 . . . . 0.0 111.443 -178.441 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 39.4 mt -66.94 -39.1 82.73 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 C-N-CA 120.56 -0.456 . . . . 0.0 109.999 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.48 -39.73 86.92 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 111.926 -0.47 . . . . 0.0 111.926 -179.162 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 42.9 ttm-85 -67.75 -42.25 82.1 Favored 'General case' 0 CA--C 1.523 -0.08 0 CA-C-N 117.52 0.66 . . . . 0.0 110.016 178.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.86 -41.47 82.84 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.324 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -63.7 -45.54 89.55 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 175.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 55.8 tp -59.38 -43.64 92.87 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 123.205 0.316 . . . . 0.0 110.184 -177.11 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -64.26 -46.63 82.89 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 120.776 0.322 . . . . 0.0 110.25 176.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -58.4 -41.84 85.83 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.543 -176.098 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 15.0 t -87.34 -20.48 26.7 Favored 'General case' 0 CA--C 1.528 0.101 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 51.2 tpt85 . . . . . 0 C--O 1.232 0.155 0 CA-C-N 118.503 0.592 . . . . 0.0 110.131 175.634 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.531 0.22 0 N-CA-C 114.36 1.244 . . . . 0.0 114.36 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.5 p -50.65 -31.73 17.03 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.585 1.154 . . . . 0.0 114.114 -173.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.52 -45.36 90.97 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 118.752 0.706 . . . . 0.0 110.006 177.043 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -68.18 -32.32 72.48 Favored 'General case' 0 CA--C 1.52 -0.204 0 C-N-CA 122.904 0.482 . . . . 0.0 110.215 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.79 -43.99 91.42 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.395 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.71 -42.08 91.81 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 175.316 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -59.15 -35.0 72.74 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 122.493 -0.129 . . . . 0.0 110.961 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 62.2 m -76.81 -43.05 38.11 Favored 'General case' 0 CA--C 1.524 -0.049 0 CA-C-O 119.689 -0.196 . . . . 0.0 111.413 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.426 HD11 HD12 ' A' ' 47' ' ' ILE . 51.1 mt -60.96 -27.78 68.51 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.553 -0.717 . . . . 0.0 109.137 174.648 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.1 -15.35 36.2 Favored Glycine 0 CA--C 1.528 0.889 0 CA-C-O 119.228 -0.762 . . . . 0.0 113.458 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -97.82 -5.33 34.97 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.664 1.232 . . . . 0.0 111.652 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.9 m -123.45 -26.81 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.338 0.102 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.429 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.5 tp -55.78 -27.46 22.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 CA-C-N 118.123 0.42 . . . . 0.0 111.588 -178.535 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -60.84 -47.5 86.05 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.262 0.625 . . . . 0.0 110.606 178.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -75.19 -38.71 60.7 Favored 'General case' 0 CA--C 1.522 -0.116 0 C-N-CA 123.022 0.529 . . . . 0.0 110.502 -179.361 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 89.0 mt -59.41 -49.67 76.9 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.409 -178.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.423 ' O ' HG13 ' A' ' 113' ' ' ILE . 58.6 mt -67.73 -51.87 44.17 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-O 118.458 -0.782 . . . . 0.0 110.462 177.235 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 91.2 p -53.52 -49.05 68.4 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 119.227 -0.989 . . . . 0.0 111.313 -176.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -69.65 -35.11 74.88 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 121.882 -0.511 . . . . 0.0 111.467 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.87 -48.26 81.3 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 118.225 0.466 . . . . 0.0 111.17 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -74.88 -33.21 29.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.743 -177.994 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.03 -27.56 65.77 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 119.522 -0.871 . . . . 0.0 110.646 178.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 4.5 ttpt -80.69 -23.81 39.3 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.205 1.002 . . . . 0.0 110.583 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.9 m -78.04 158.72 29.11 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -170.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -100.12 -179.87 4.27 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 170.639 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -36.59 68.08 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.547 1.067 . . . . 0.0 112.858 -175.837 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -69.66 -42.78 73.74 Favored 'General case' 0 N--CA 1.456 -0.166 0 O-C-N 121.618 -0.676 . . . . 0.0 110.698 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 60.6 m80 -73.57 -37.67 65.45 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 119.573 -0.251 . . . . 0.0 111.136 -177.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.421 ' C ' ' HD2' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -64.92 -37.2 86.84 Favored 'General case' 0 C--N 1.34 0.184 0 N-CA-C 108.469 -0.938 . . . . 0.0 108.469 176.321 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -62.3 -43.62 98.4 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 178.166 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -62.35 -38.92 91.38 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 122.119 -0.363 . . . . 0.0 111.424 176.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.6 -43.32 80.46 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 118.526 0.603 . . . . 0.0 111.13 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -70.68 -26.18 63.32 Favored 'General case' 0 C--O 1.225 -0.236 0 O-C-N 121.329 -0.857 . . . . 0.0 110.645 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.1 ttt -68.58 -41.04 80.23 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 174.108 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 33.2 tp -57.19 -49.3 76.42 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.121 0.568 . . . . 0.0 109.609 176.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 85.7 mt -72.92 -31.89 64.94 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -178.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 32.2 t70 . . . . . 0 N--CA 1.452 -0.327 0 CA-C-N 118.274 0.488 . . . . 0.0 109.813 177.743 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo . . . . . 0 N--CA 1.456 -0.734 0 N-CA-C 110.646 -0.559 . . . . 0.0 110.646 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 32.5 t -81.89 164.0 21.86 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 122.521 0.328 . . . . 0.0 110.519 176.004 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -131.5 127.18 36.76 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.841 0.456 . . . . 0.0 110.713 177.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 163' ' ' SER . . . . . 0.409 ' HA ' ' HD3' ' B' ' 164' ' ' PRO . 21.8 t -104.07 131.14 22.22 Favored Pre-proline 0 N--CA 1.453 -0.295 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 174.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 164' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' B' ' 163' ' ' SER . 50.9 Cg_exo -57.48 -10.45 6.8 Favored 'Trans proline' 0 N--CA 1.448 -1.183 0 C-N-CA 122.854 2.369 . . . . 0.0 112.943 176.755 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 52.4 p . . . . . 0 C--N 1.34 0.154 0 CA-C-N 118.865 0.757 . . . . 0.0 112.21 -177.302 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 . . . . . 0 CA--C 1.532 0.28 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -54.79 -14.35 1.37 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.525 0.73 . . . . 0.0 111.053 177.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -53.63 -34.6 59.12 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.367 0.667 . . . . 0.0 110.506 175.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 34.4 m-20 -64.47 -48.5 75.01 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 118.962 0.801 . . . . 0.0 110.16 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -63.1 -49.06 75.93 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 110.466 -0.198 . . . . 0.0 110.466 -177.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 86.2 t -63.45 -57.75 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.22 -29.54 67.58 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 119.395 -0.336 . . . . 0.0 111.802 -177.388 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 61.9 m -71.53 -46.04 60.69 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.35 0.523 . . . . 0.0 110.48 176.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.438 HD11 ' CD2' ' A' ' 53' ' ' TYR . 19.5 tp -65.89 -33.84 76.76 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.077 0.465 . . . . 0.0 110.167 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -68.42 -43.27 77.53 Favored 'General case' 0 CA--C 1.522 -0.108 0 C-N-CA 123.93 0.892 . . . . 0.0 109.648 178.359 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.6 t -62.88 -31.75 72.86 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 174.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.83 -32.86 70.04 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 177.214 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt . . . . . 0 C--O 1.23 0.06 0 C-N-CA 123.019 0.528 . . . . 0.0 111.655 176.675 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 21.3 mm . . . . . 0 CA--C 1.53 0.206 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.7 t -64.24 124.52 21.92 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 120.882 0.372 . . . . 0.0 110.139 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.408 ' C ' ' HD2' ' B' ' 160' ' ' PRO . . . -68.79 -25.79 74.96 Favored Glycine 0 CA--C 1.524 0.604 0 CA-C-O 119.603 -0.554 . . . . 0.0 112.534 -176.132 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 83.1 p -64.22 -33.96 77.0 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 118.549 1.174 . . . . 0.0 111.079 -175.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -69.98 -39.19 76.09 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 54.7 mt -63.98 -38.08 81.47 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.07 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 176.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -60.8 -45.24 95.17 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 118.92 -0.562 . . . . 0.0 110.654 176.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.95 -40.34 97.38 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 119.256 0.934 . . . . 0.0 111.396 178.05 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 99.4 mt -64.52 -58.56 6.05 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 119.709 -0.186 . . . . 0.0 111.044 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.556 HG21 ' HB2' ' A' ' 71' ' ' SER . 44.2 p -54.18 -41.36 68.47 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-N 118.0 0.363 . . . . 0.0 111.693 175.765 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.0 m -55.53 -60.18 3.79 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 119.227 -0.416 . . . . 0.0 111.104 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -67.15 -32.69 73.98 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 119.134 -1.026 . . . . 0.0 111.711 -174.254 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.38 -58.14 9.91 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 122.029 -0.42 . . . . 0.0 110.109 174.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.0 mt -70.45 -17.02 62.99 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.637 0.775 . . . . 0.0 112.47 -175.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -66.9 -21.76 65.98 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -178.759 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.4 t60 -148.17 -30.03 0.3 Allowed 'General case' 0 C--N 1.34 0.169 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -175.424 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.514 HG22 HG22 ' A' ' 93' ' ' THR . 33.4 mm 43.86 73.95 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 121.583 0.706 . . . . 0.0 111.436 -178.274 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -149.49 21.12 0.93 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.705 0.802 . . . . 0.0 109.754 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.595 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.24 36.85 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 C-N-CA 124.539 1.135 . . . . 0.0 109.183 -172.109 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.49 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -50.95 -56.12 13.92 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -175.899 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 79.2 p -75.29 -25.78 58.22 Favored 'General case' 0 CA--C 1.522 -0.129 0 N-CA-C 112.33 0.492 . . . . 0.0 112.33 -173.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.676 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -83.07 -42.3 17.6 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -179.3 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 21.0 mt -57.61 -52.77 53.21 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.123 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 171.478 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 13.3 mm -65.81 -47.05 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 CA-C-O 119.494 -0.288 . . . . 0.0 111.514 -176.621 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.6 t -56.21 -40.1 73.52 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 120.034 -0.667 . . . . 0.0 109.859 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.7 tp -68.3 -41.72 80.53 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 118.834 -0.603 . . . . 0.0 112.543 -176.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.7 pt -74.67 -36.4 40.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 CA-C-N 119.688 1.131 . . . . 0.0 111.946 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.454 HD13 HG21 ' A' ' 104' ' ' VAL . 96.0 mt -63.97 -48.59 85.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 177.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -59.47 -43.72 93.17 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.778 177.544 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.438 ' CD2' HD11 ' A' ' 14' ' ' LEU . 31.6 t80 -55.73 -40.1 72.02 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 177.268 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.7 t -65.34 -55.41 18.36 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -69.15 -21.17 64.02 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -173.671 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 50.2 mt -81.55 -14.8 56.41 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 179.212 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 78.8 m -125.04 163.73 35.9 Favored Pre-proline 0 CA--C 1.539 0.546 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 -169.325 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -59.11 174.26 1.0 Allowed 'Trans proline' 0 C--N 1.348 0.549 1 C-N-CA 126.041 4.494 . . . . 0.0 114.645 -179.231 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.567 ' HB3' ' HE2' ' A' ' 115' ' ' LYS . 4.6 p-10 -59.42 -30.18 68.29 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -174.366 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 25.3 t -63.53 -36.88 85.25 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -78.49 -28.13 46.3 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.034 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -63.05 -45.31 92.83 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-N 119.013 0.824 . . . . 0.0 109.104 173.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.7 tp -63.32 -48.27 78.73 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.76 -41.86 96.14 Favored Glycine 0 C--N 1.336 0.579 0 N-CA-C 111.111 -0.796 . . . . 0.0 111.111 178.503 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.2 m -63.63 -43.97 95.26 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 117.043 0.422 . . . . 0.0 110.443 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 81.6 mt -62.34 -37.02 84.04 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 118.086 0.403 . . . . 0.0 110.749 179.127 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -70.81 -33.28 70.54 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.64 0.654 . . . . 0.0 111.344 177.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 69.9 mt -71.3 -41.38 74.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 176.083 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 66.8 mt -65.25 -33.72 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 123.516 0.726 . . . . 0.0 109.412 177.306 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -75.18 -42.48 55.74 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 119.606 -0.235 . . . . 0.0 111.361 -178.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.556 ' HB2' HG21 ' A' ' 33' ' ' THR . 10.9 p -68.42 -49.77 57.53 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-N 118.592 0.633 . . . . 0.0 110.731 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 54.8 mt -67.4 -42.67 87.6 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.096 0 CA-C-N 117.725 0.239 . . . . 0.0 110.466 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.22 -39.66 94.54 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 -178.494 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.0 ttm-85 -70.1 -40.02 75.19 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.181 0.592 . . . . 0.0 110.314 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.92 -40.38 83.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 178.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -62.36 -49.43 75.59 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 175.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.6 tp -57.61 -48.39 79.54 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.017 0.527 . . . . 0.0 110.25 -176.617 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -64.51 -43.86 92.74 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.808 -0.178 . . . . 0.0 110.811 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -67.9 -39.25 83.65 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 121.127 -0.229 . . . . 0.0 111.506 -175.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.1 t -80.17 -24.28 40.45 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.872 -178.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 . . . . . 0 C--N 1.341 0.212 0 CA-C-N 118.438 0.563 . . . . 0.0 111.621 172.456 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.514 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.316 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.2 p -53.0 -30.17 33.65 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.034 0.934 . . . . 0.0 113.434 -175.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.74 -46.32 90.13 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 118.97 0.804 . . . . 0.0 109.859 175.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -73.78 -23.04 59.65 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.897 178.208 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.75 -45.89 84.5 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 175.699 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.6 mt -64.45 -43.0 96.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 176.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -60.18 -34.12 73.15 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 121.309 -0.156 . . . . 0.0 111.33 178.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.6 m -74.92 -41.29 59.96 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-O 119.517 -0.278 . . . . 0.0 111.342 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.2 mt -61.39 -30.5 70.59 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 174.105 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.68 -14.92 31.38 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 119.277 -0.735 . . . . 0.0 113.637 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.78 -6.92 24.23 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.701 1.25 . . . . 0.0 111.959 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.454 HG21 HD13 ' A' ' 51' ' ' ILE . 27.3 m -121.18 -20.29 4.36 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -178.287 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.416 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.5 tp -51.42 -27.66 7.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 C-N-CA 123.027 0.531 . . . . 0.0 112.099 -177.385 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -64.1 -56.22 16.42 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 122.765 0.426 . . . . 0.0 110.81 177.42 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -66.31 -40.32 89.9 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 73.5 mt -58.59 -55.68 31.94 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 119.05 -0.5 . . . . 0.0 110.946 -177.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.3 mt -69.45 -51.8 32.78 Favored 'General case' 0 N--CA 1.457 -0.08 0 CA-C-N 118.581 0.628 . . . . 0.0 111.565 -177.145 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 80.4 p -55.06 -49.82 70.66 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 120.116 -0.634 . . . . 0.0 111.706 -178.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -69.69 -45.76 67.58 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 118.897 0.772 . . . . 0.0 111.513 -178.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -51.91 -55.88 17.51 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 118.11 0.414 . . . . 0.0 110.955 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 25.7 mt -69.19 -37.28 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 O-C-N 122.955 0.159 . . . . 0.0 110.821 -178.103 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.61 -21.46 61.84 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.143 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.567 ' HE2' ' HB3' ' A' ' 59' ' ' ASP . 0.1 OUTLIER -98.39 -15.17 19.79 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.649 0.38 . . . . 0.0 111.929 -175.736 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 87.8 p -84.34 167.99 16.03 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -174.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -86.72 174.42 8.85 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 49.9 mm-40 -55.89 -40.31 72.81 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.558 0.617 . . . . 0.0 112.04 -175.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -71.42 -42.6 68.08 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.514 0.597 . . . . 0.0 111.001 -179.205 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 7.5 m80 -71.17 -42.42 69.1 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.149 -0.345 . . . . 0.0 110.543 -178.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.4 ttpt -51.36 -49.88 60.6 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 169.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -61.12 -37.82 84.14 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 120.93 -0.308 . . . . 0.0 111.33 -175.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -63.03 -43.33 98.99 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 122.365 -0.209 . . . . 0.0 111.483 175.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 69.4 mt -69.59 -34.24 60.58 Favored 'Isoleucine or valine' 0 C--N 1.338 0.096 0 C-N-CA 119.869 -0.733 . . . . 0.0 109.05 178.255 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -35.75 81.95 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 177.788 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 19.9 ttt -66.27 -43.72 85.6 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 123.132 0.573 . . . . 0.0 110.316 175.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.41 -41.29 84.62 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 176.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 75.9 mt -70.43 -31.23 68.33 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 178.568 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.2 t70 . . . . . 0 N--CA 1.455 -0.178 0 CA-C-N 117.941 0.337 . . . . 0.0 110.135 178.394 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 160' ' ' PRO . . . . . 0.408 ' HD2' ' C ' ' A' ' 26' ' ' GLY . 44.5 Cg_endo . . . . . 0 N--CA 1.455 -0.764 0 N-CA-C 110.854 -0.479 . . . . 0.0 110.854 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 18.8 t 62.82 171.56 0.14 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.901 1.28 . . . . 0.0 112.108 -171.445 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -144.52 148.53 34.58 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.753 0.821 . . . . 0.0 110.306 -178.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 16.1 t -124.44 130.51 24.29 Favored Pre-proline 0 N--CA 1.45 -0.43 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.72 -10.8 4.19 Favored 'Trans proline' 0 N--CA 1.452 -0.952 0 C-N-CA 123.292 2.661 . . . . 0.0 113.054 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 67.2 p . . . . . 0 CA--C 1.53 0.201 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -177.333 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 . . . . . 0 CA--C 1.534 0.34 0 CA-C-O 120.77 0.319 . . . . 0.0 110.282 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -54.28 -15.06 1.37 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.928 0.891 . . . . 0.0 111.957 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.4 tp60 -55.64 -41.8 74.1 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.191 0.596 . . . . 0.0 111.13 177.614 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -65.47 -38.75 90.72 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 118.637 0.653 . . . . 0.0 110.521 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -64.44 -55.13 22.96 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 120.726 0.298 . . . . 0.0 110.235 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 96.6 t -59.16 -54.65 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.52 -32.1 68.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.938 0.495 . . . . 0.0 112.08 -177.116 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 58.9 m -72.56 -44.44 62.08 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 118.45 0.568 . . . . 0.0 110.707 177.371 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.9 tp -67.72 -33.38 74.76 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.424 0.631 . . . . 0.0 109.854 -179.287 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -65.15 -45.45 84.9 Favored 'General case' 0 CA--C 1.521 -0.159 0 C-N-CA 123.842 0.857 . . . . 0.0 109.216 176.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.3 t -61.6 -32.13 72.23 Favored 'General case' 0 N--CA 1.457 -0.079 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 175.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -61.58 -49.92 74.7 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 176.709 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt . . . . . 0 C--N 1.339 0.129 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 179.731 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.5 mm . . . . . 0 CA--C 1.532 0.278 0 CA-C-O 120.688 0.28 . . . . 0.0 110.71 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.6 m -54.95 128.51 33.78 Favored 'General case' 0 C--N 1.339 0.134 0 O-C-N 121.959 -0.463 . . . . 0.0 110.241 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.81 -15.27 62.03 Favored Glycine 0 C--N 1.337 0.584 0 CA-C-O 119.166 -0.796 . . . . 0.0 113.761 -174.267 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.1 p -62.38 -40.08 95.27 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 119.155 1.478 . . . . 0.0 110.823 -177.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -68.16 -42.72 79.64 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 56.1 mt -63.77 -36.04 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.209 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.3 mmtt -66.5 -42.21 87.73 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 118.743 -0.646 . . . . 0.0 110.864 179.167 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.13 -41.77 94.51 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.213 0.915 . . . . 0.0 111.039 175.715 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.2 mt -61.81 -57.28 12.47 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 122.563 -0.086 . . . . 0.0 110.929 -179.491 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.563 HG21 ' HB2' ' A' ' 71' ' ' SER . 41.3 p -55.67 -43.97 76.85 Favored 'General case' 0 CA--C 1.523 -0.071 0 O-C-N 122.152 -0.343 . . . . 0.0 111.641 177.185 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 m -55.38 -58.8 6.23 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 122.396 0.278 . . . . 0.0 110.799 -178.71 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -78.59 -14.62 59.24 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -172.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.42 -58.51 3.65 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 166.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.4 mt -65.62 -20.69 66.41 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.901 0.88 . . . . 0.0 112.284 -176.41 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -72.59 -14.89 61.72 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -133.71 -46.11 0.81 Allowed 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 119.011 0.823 . . . . 0.0 112.964 -176.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.512 HG22 HG22 ' A' ' 93' ' ' THR . 39.8 mm 40.27 66.32 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 122.304 1.05 . . . . 0.0 111.529 -174.536 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -150.34 21.62 0.84 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.663 1.185 . . . . 0.0 108.655 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.577 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -148.8 35.52 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 C-N-CA 125.069 1.347 . . . . 0.0 109.063 -170.562 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.442 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -51.45 -52.81 43.17 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -175.044 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 83.5 p -76.57 -24.06 53.54 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -173.045 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.645 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -86.2 -41.76 14.39 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -179.584 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 48.8 mt -56.27 -52.77 47.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 118.259 0.481 . . . . 0.0 109.817 170.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 14.8 mm -67.09 -48.12 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.139 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.582 -177.31 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 48.4 t -55.76 -37.64 68.8 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 120.001 -0.68 . . . . 0.0 109.722 178.229 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.4 tp -69.31 -43.12 74.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.551 -0.738 . . . . 0.0 112.613 -177.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 31.3 pt -72.41 -35.53 52.05 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 120.047 1.294 . . . . 0.0 111.781 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.505 HD13 HG21 ' A' ' 104' ' ' VAL . 94.9 mt -64.24 -49.66 80.13 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-O 121.593 0.711 . . . . 0.0 109.257 178.072 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -57.92 -41.97 83.83 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.474 177.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -56.45 -41.07 75.88 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 176.074 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.4 t -66.22 -48.42 70.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 112.135 0.421 . . . . 0.0 112.135 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -73.21 -23.97 60.45 Favored 'General case' 0 C--O 1.231 0.081 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -175.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 51.4 mt -80.49 -15.1 57.55 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 178.246 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.408 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 73.4 m -119.87 157.36 52.74 Favored Pre-proline 0 CA--C 1.536 0.434 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -171.416 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 90.5 Cg_endo -72.62 -170.79 0.64 Allowed 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 125.045 3.83 . . . . 0.0 113.642 -176.709 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -50.67 -44.98 57.83 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.42 1.888 . . . . 0.0 114.462 -170.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.0 p -60.12 -31.4 70.03 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.403 ' CG ' ' HB3' ' A' ' 57' ' ' CYS . 65.1 m-70 -86.32 -14.7 42.84 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 118.921 -0.561 . . . . 0.0 111.136 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.411 ' HB2' ' HE2' ' A' ' 115' ' ' LYS . 75.1 mmtt -69.85 -43.47 71.87 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 171.187 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 57.2 tp -66.44 -49.12 67.76 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.08 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.3 -38.32 93.15 Favored Glycine 0 C--N 1.336 0.552 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 178.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.1 t -60.94 -51.07 70.82 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 177.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 49.5 mt -58.59 -34.58 71.27 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.736 -0.65 . . . . 0.0 111.605 179.372 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -72.41 -33.53 67.21 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.389 0.995 . . . . 0.0 111.783 177.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 75.9 mt -75.69 -40.42 40.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 118.607 0.639 . . . . 0.0 110.378 178.125 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 84.6 mt -63.63 -36.68 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 174.505 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -67.8 -43.68 79.1 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.998 -0.525 . . . . 0.0 111.057 178.587 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.563 ' HB2' HG21 ' A' ' 33' ' ' THR . 89.3 p -67.17 -57.13 7.33 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 118.627 0.649 . . . . 0.0 111.289 -177.269 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 54.1 mt -64.88 -30.5 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 178.365 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.09 -54.67 19.81 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-O 119.851 -0.416 . . . . 0.0 112.541 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.64 HH11 ' HG3' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -66.49 -34.13 77.24 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 118.162 0.981 . . . . 0.0 110.754 -179.678 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.79 -45.96 76.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 110.318 -0.253 . . . . 0.0 110.318 177.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -63.71 -46.76 83.96 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 177.181 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 60.5 tp -55.93 -45.38 78.78 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 122.802 0.441 . . . . 0.0 110.507 -177.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -67.41 -46.94 71.7 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 120.775 -0.37 . . . . 0.0 110.811 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -64.68 -24.95 67.74 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -175.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.3 t -99.09 -27.77 13.68 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 118.798 0.726 . . . . 0.0 112.237 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 . . . . . 0 CA--C 1.531 0.231 0 O-C-N 121.948 -0.47 . . . . 0.0 111.882 -179.587 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.512 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.312 0 N-CA-C 114.093 1.145 . . . . 0.0 114.093 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.6 p -53.58 -28.46 32.14 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.153 0.981 . . . . 0.0 113.549 -174.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.74 -46.16 86.61 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 118.921 0.782 . . . . 0.0 109.952 176.202 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 3.2 m80 -73.96 -22.32 59.68 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.462 178.212 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.79 -46.57 78.18 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 175.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 94.9 mt -63.05 -41.69 93.8 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 175.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -63.51 -33.87 76.53 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 179.411 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.6 m -73.12 -39.7 65.55 Favored 'General case' 0 C--O 1.227 -0.126 0 O-C-N 122.342 -0.224 . . . . 0.0 110.654 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.1 mt -62.34 -31.58 72.24 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 173.157 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.46 -15.4 24.36 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-O 119.0 -0.889 . . . . 0.0 113.463 179.206 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -100.29 -4.74 28.68 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 119.263 1.531 . . . . 0.0 111.856 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.505 HG21 HD13 ' A' ' 51' ' ' ILE . 28.7 m -124.52 -20.55 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 122.823 0.449 . . . . 0.0 112.024 -179.282 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.416 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.8 tp -54.4 -23.4 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 C-N-CA 123.358 0.663 . . . . 0.0 112.222 -176.299 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -59.4 -54.01 51.56 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.623 0.369 . . . . 0.0 111.602 178.007 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -78.34 -29.16 47.42 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 121.124 -0.23 . . . . 0.0 110.795 -177.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.2 mt -63.16 -52.16 63.54 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 64.3 mt -64.79 -59.81 3.8 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 118.478 -0.773 . . . . 0.0 110.369 176.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 90.7 p -52.77 -42.32 64.89 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 118.97 -1.092 . . . . 0.0 111.857 -172.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -69.44 -47.49 63.88 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 119.16 0.891 . . . . 0.0 111.175 178.121 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.84 -34.58 65.53 Favored 'General case' 0 N--CA 1.458 -0.068 0 C-N-CA 123.503 0.721 . . . . 0.0 112.323 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -81.92 -39.75 16.92 Favored 'Isoleucine or valine' 0 C--N 1.337 0.041 0 CA-C-N 119.471 1.032 . . . . 0.0 112.048 175.889 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.64 -25.95 64.17 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.344 -178.151 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.411 ' HE2' ' HB2' ' A' ' 62' ' ' LYS . 0.1 OUTLIER -81.94 -17.39 47.22 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.256 0.623 . . . . 0.0 110.731 178.406 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 13.3 m -80.88 160.85 24.62 Favored 'General case' 0 N--CA 1.457 -0.079 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -174.433 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -96.27 -179.2 4.57 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 170.337 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -55.47 -43.5 75.56 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.931 0.787 . . . . 0.0 111.828 -177.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -68.6 -41.39 79.66 Favored 'General case' 0 N--CA 1.453 -0.285 0 O-C-N 121.555 -0.715 . . . . 0.0 111.05 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -72.15 -38.27 69.24 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 122.158 -0.339 . . . . 0.0 111.176 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.73 -34.94 78.95 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.103 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -63.14 -42.51 99.48 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 178.112 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -61.59 -42.71 99.26 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 110.556 -0.165 . . . . 0.0 110.556 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.0 mt -65.89 -37.74 80.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 39.4 ttt180 -63.35 -33.26 75.13 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 176.247 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 62.4 ttp -67.79 -41.45 83.19 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 176.008 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 88.3 mt -58.76 -45.7 89.14 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.197 176.187 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.3 mt -67.33 -35.25 79.03 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 111.571 0.212 . . . . 0.0 111.571 -179.316 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.5 t70 . . . . . 0 CA--C 1.529 0.156 0 CA-C-N 117.999 0.363 . . . . 0.0 110.176 178.321 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo . . . . . 0 N--CA 1.456 -0.72 0 N-CA-C 110.37 -0.666 . . . . 0.0 110.37 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 36.6 m -76.6 163.71 26.61 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 120.819 0.343 . . . . 0.0 110.898 176.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 162' ' ' TYR . . . . . 0.464 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 7.9 t80 -143.22 138.22 29.51 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.116 0.566 . . . . 0.0 110.307 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 35.9 t -124.88 142.31 40.63 Favored Pre-proline 0 N--CA 1.454 -0.267 0 C-N-CA 122.976 0.51 . . . . 0.0 111.46 177.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -66.87 -5.93 14.54 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 123.388 2.725 . . . . 0.0 111.523 175.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 66.9 p . . . . . 0 N--CA 1.456 -0.172 0 C-N-CA 122.826 0.45 . . . . 0.0 111.642 179.583 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.421 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 12.9 t70 . . . . . 0 CA--C 1.536 0.436 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.421 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 13.5 t80 -55.58 -14.29 2.03 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.498 0.719 . . . . 0.0 111.142 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -51.4 -43.94 62.08 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.173 0.989 . . . . 0.0 110.609 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 44.7 m-20 -62.05 -44.2 97.2 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 118.042 0.383 . . . . 0.0 110.806 -179.125 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -64.88 -51.27 62.87 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 117.795 0.271 . . . . 0.0 110.566 -177.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.7 t -62.54 -55.09 26.08 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.05 -31.5 65.25 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.15 0.58 . . . . 0.0 111.802 -178.381 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 54.4 m -73.49 -43.0 61.14 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 118.387 0.54 . . . . 0.0 110.68 177.115 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.442 HD11 ' CD2' ' A' ' 53' ' ' TYR . 15.6 tp -66.72 -30.46 70.7 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -70.63 -43.83 68.44 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.167 0.987 . . . . 0.0 109.652 175.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -62.93 -26.77 68.97 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 175.302 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.49 -41.75 62.71 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 174.637 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.6 tttt . . . . . 0 CA--C 1.529 0.162 0 C-N-CA 123.087 0.555 . . . . 0.0 111.222 178.613 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.1 mm . . . . . 0 CA--C 1.531 0.224 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.3 m -49.89 127.25 15.9 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.401 0.68 . . . . 0.0 112.103 -174.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.56 -15.08 63.47 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-O 119.012 -0.882 . . . . 0.0 113.705 -176.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.41 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 46.5 t -62.46 -42.86 99.77 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 118.966 1.383 . . . . 0.0 110.301 -178.586 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -66.99 -40.87 87.48 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.288 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 46.0 mt -60.98 -37.58 77.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 176.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -60.74 -49.23 78.34 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.042 0.537 . . . . 0.0 110.783 177.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.41 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.5 OUTLIER -61.25 -43.51 98.76 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 118.366 0.53 . . . . 0.0 110.971 179.036 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.67 -61.92 2.09 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 122.356 -0.215 . . . . 0.0 110.635 -179.435 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 64.1 p -55.94 -46.02 78.65 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.3 t -63.32 -44.06 96.01 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.742 -176.488 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -68.19 -36.22 79.24 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 118.816 -1.153 . . . . 0.0 111.209 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.42 -56.29 24.08 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 174.705 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.9 mt -70.32 -17.89 63.08 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.477 0.711 . . . . 0.0 112.586 -175.199 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -63.76 -24.46 67.77 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -150.24 -26.15 0.24 Allowed 'General case' 0 C--N 1.342 0.253 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -176.341 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.525 HG22 HG22 ' A' ' 93' ' ' THR . 32.6 mm 45.42 74.68 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 123.307 0.643 . . . . 0.0 111.484 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -148.49 21.63 1.04 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.661 0.784 . . . . 0.0 109.964 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.574 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.13 36.69 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.134 0 C-N-CA 124.439 1.095 . . . . 0.0 109.566 -171.785 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.457 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -51.11 -55.27 18.58 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 -175.701 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 80.7 p -75.76 -25.76 56.79 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -173.035 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.664 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -83.03 -44.23 15.44 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.342 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 22.2 mt -56.23 -53.82 35.08 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 CA-C-N 118.178 0.445 . . . . 0.0 109.973 172.056 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.9 mm -65.33 -48.32 83.72 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.161 0 CA-C-O 119.209 -0.424 . . . . 0.0 111.523 -175.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 44.4 t -56.22 -40.43 74.05 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.167 178.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.2 tp -68.45 -41.46 80.21 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.4 pt -74.52 -35.0 37.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 CA-C-N 119.325 0.966 . . . . 0.0 111.906 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.435 HD13 HG21 ' A' ' 104' ' ' VAL . 97.4 mt -63.77 -50.68 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 177.494 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -58.14 -43.52 87.35 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.761 178.252 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.442 ' CD2' HD11 ' A' ' 14' ' ' LEU . 24.0 t80 -56.23 -41.65 76.05 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 176.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.7 t -64.69 -53.84 41.07 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -70.9 -23.7 62.34 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -173.296 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 51.2 mt -82.92 -15.95 49.34 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 76.3 m -118.55 159.15 45.07 Favored Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 -169.257 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 57' ' ' CYS . 49.9 Cg_exo -59.16 -171.5 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 1 C-N-CA 126.544 4.83 . . . . 0.0 116.582 -179.375 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -47.37 -58.79 3.75 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 126.719 2.008 . . . . 0.0 114.725 -175.136 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.2 p -58.81 -22.78 59.33 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.391 0.139 . . . . 0.0 110.668 -177.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 42.0 m-70 -88.84 -27.58 20.97 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 118.72 -0.657 . . . . 0.0 110.985 -178.457 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -66.52 -46.53 75.86 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 119.568 1.077 . . . . 0.0 108.215 172.5 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.0 tp -65.67 -48.89 70.55 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.853 0.359 . . . . 0.0 110.126 178.26 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.01 -40.19 95.2 Favored Glycine 0 C--N 1.336 0.553 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.4 m -65.68 -43.38 89.45 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 117.676 0.738 . . . . 0.0 110.564 178.584 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 72.1 mt -59.62 -35.46 74.4 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.866 0.757 . . . . 0.0 110.877 177.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -73.73 -35.34 65.06 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.516 0.598 . . . . 0.0 111.345 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 73.7 mt -70.09 -48.01 64.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 O-C-N 121.528 -0.732 . . . . 0.0 109.831 177.346 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 77.8 mt -59.1 -38.39 73.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 C-N-CA 124.283 1.033 . . . . 0.0 109.18 178.32 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -66.52 -46.81 74.94 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 118.676 -0.678 . . . . 0.0 111.084 177.001 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.0 t -62.37 -52.72 62.5 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 118.988 0.813 . . . . 0.0 110.887 -175.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 43.4 mt -63.8 -34.76 70.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.249 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.09 -51.24 46.38 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-O 119.739 -0.478 . . . . 0.0 112.665 -178.59 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.671 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -71.4 -32.34 68.31 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 117.994 0.897 . . . . 0.0 110.228 -178.055 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.66 -45.08 72.71 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 176.712 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.3 m-30 -61.57 -49.9 74.79 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 176.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.1 tp -60.75 -43.79 97.51 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.783 0.433 . . . . 0.0 110.931 -174.412 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -67.27 -45.24 77.22 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.471 178.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -64.32 -39.59 94.2 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 111.509 0.189 . . . . 0.0 111.509 -175.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.0 t -80.93 -33.79 33.83 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 118.037 0.38 . . . . 0.0 111.313 -179.13 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.7 ttt85 . . . . . 0 C--N 1.339 0.122 0 CA-C-N 118.406 0.548 . . . . 0.0 110.405 177.013 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.525 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.34 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 23.3 p -50.88 -30.34 14.33 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -175.05 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.82 -44.75 88.84 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.597 -0.689 . . . . 0.0 110.046 176.606 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -68.02 -30.29 69.5 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.931 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.49 -45.8 85.74 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 123.287 0.635 . . . . 0.0 110.143 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.6 mt -64.46 -42.23 94.65 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 175.17 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 44.6 t-20 -60.99 -33.62 73.52 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 121.255 -0.178 . . . . 0.0 110.725 178.473 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.8 m -73.54 -40.58 63.87 Favored 'General case' 0 N--CA 1.457 -0.097 0 CA-C-O 119.492 -0.29 . . . . 0.0 110.884 179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.1 mt -62.29 -29.65 70.58 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 173.464 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.69 -14.92 31.46 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 118.994 -0.892 . . . . 0.0 113.919 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -100.12 -6.24 26.58 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.016 1.408 . . . . 0.0 111.966 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.435 HG21 HD13 ' A' ' 51' ' ' ILE . 27.6 m -122.16 -18.57 4.74 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.163 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -178.605 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.7 tp -50.89 -28.46 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 CA-C-N 118.426 0.557 . . . . 0.0 111.602 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -59.35 -53.49 57.66 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.67 0.388 . . . . 0.0 110.849 177.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -80.72 -27.91 36.78 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 119.605 -0.236 . . . . 0.0 111.476 -177.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 82.0 mt -65.28 -50.84 64.18 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 178.371 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.465 ' O ' HG13 ' A' ' 113' ' ' ILE . 83.7 mt -64.37 -64.8 0.79 Allowed 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 175.474 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.2 t -34.4 -55.44 0.53 Allowed 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 179.066 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -73.12 -39.29 65.86 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-N 119.359 0.981 . . . . 0.0 112.054 -177.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.418 ' O ' ' HE2' ' A' ' 115' ' ' LYS . . . -57.56 -49.46 76.3 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.847 0.749 . . . . 0.0 110.216 179.766 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.2 OUTLIER -76.04 -32.57 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -179.119 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.35 -28.76 67.42 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.542 0.61 . . . . 0.0 109.841 179.083 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.418 ' HE2' ' O ' ' A' ' 112' ' ' ALA . 0.4 OUTLIER -79.21 -23.04 44.06 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.833 0.853 . . . . 0.0 110.374 175.12 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.408 ' HB3' ' HB2' ' A' ' 120' ' ' HIS . 35.5 m -76.87 154.95 33.28 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 113.75 1.018 . . . . 0.0 113.75 -172.37 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -92.1 -178.35 4.95 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 170.177 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -55.61 -43.82 76.44 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.094 0.407 . . . . 0.0 111.396 -178.151 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -66.71 -43.02 85.4 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 121.716 -0.615 . . . . 0.0 110.85 -178.284 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.408 ' HB2' ' HB3' ' A' ' 116' ' ' SER . 55.7 m80 -70.25 -36.08 74.22 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 119.628 -0.225 . . . . 0.0 110.777 -178.791 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.08 -39.48 92.56 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 174.389 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -67.41 -38.65 84.95 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.689 -177.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -63.04 -44.47 95.8 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 121.209 -0.196 . . . . 0.0 111.169 175.558 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 97.5 mt -66.94 -35.92 75.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.567 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 80.0 ttt-85 -66.4 -32.19 73.42 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 122.079 -0.388 . . . . 0.0 110.181 176.196 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 58.3 ttp -67.19 -42.47 84.15 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 175.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 64.7 tp -57.34 -47.81 80.63 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.95 0.405 . . . . 0.0 110.221 176.697 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 84.1 mt -70.79 -27.79 64.16 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.443 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.6 t70 . . . . . 0 N--CA 1.454 -0.258 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 175.947 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo . . . . . 0 N--CA 1.455 -0.759 0 N-CA-C 110.103 -0.768 . . . . 0.0 110.103 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 38.1 m -68.4 154.9 40.91 Favored 'General case' 0 N--CA 1.457 -0.109 0 CA-C-O 120.679 0.276 . . . . 0.0 110.616 176.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 162' ' ' TYR . . . . . 0.423 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 3.2 t80 -150.58 138.53 20.04 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.911 0.484 . . . . 0.0 110.671 -179.145 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.4 t -133.46 134.67 24.07 Favored Pre-proline 0 N--CA 1.455 -0.195 0 C-N-CA 123.26 0.624 . . . . 0.0 111.4 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -58.42 -12.58 14.07 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.531 2.821 . . . . 0.0 112.593 174.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 2.8 m . . . . . 0 CA--C 1.531 0.247 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 -173.414 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.43 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 18.3 t70 . . . . . 0 CA--C 1.534 0.331 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.43 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 7.1 t80 -55.92 -13.65 1.99 Allowed 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.724 -0.61 . . . . 0.0 110.772 177.214 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -53.06 -37.98 62.09 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 124.367 1.067 . . . . 0.0 111.127 175.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -62.91 -45.02 94.46 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 119.217 0.917 . . . . 0.0 110.164 179.176 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -64.04 -51.34 64.6 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 117.693 0.224 . . . . 0.0 110.613 -178.496 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.2 t -64.72 -50.82 73.71 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.129 0 C-N-CA 121.002 -0.279 . . . . 0.0 110.773 -177.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.31 -29.47 69.89 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 119.537 -0.268 . . . . 0.0 111.683 -179.094 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 57.5 m -73.84 -43.55 58.34 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 118.456 0.571 . . . . 0.0 110.389 176.775 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.501 ' HG ' ' CD2' ' A' ' 53' ' ' TYR . 21.3 tp -66.32 -28.47 68.71 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.163 0.506 . . . . 0.0 109.741 179.228 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -70.64 -46.71 62.78 Favored 'General case' 0 C--N 1.337 0.035 0 C-N-CA 123.773 0.829 . . . . 0.0 109.35 175.654 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 64.8 m -63.4 -22.77 67.08 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.059 175.36 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -76.72 -39.56 51.49 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.484 0.314 . . . . 0.0 110.28 175.721 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.1 ttpp . . . . . 0 CA--C 1.531 0.216 0 C-N-CA 123.264 0.625 . . . . 0.0 111.05 175.938 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 29.9 mt . . . . . 0 CA--C 1.532 0.261 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.0 t -140.06 125.1 18.56 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 175.854 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -61.39 -31.22 76.56 Favored Glycine 0 CA--C 1.524 0.615 0 CA-C-O 119.26 -0.744 . . . . 0.0 112.805 -175.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 88.8 p -63.47 -35.5 80.64 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 118.795 1.298 . . . . 0.0 110.879 -174.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.0 mmt-85 -68.39 -45.5 72.51 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 177.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 41.4 mt -62.59 -35.15 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.1 mmtt -71.22 -37.85 72.02 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 118.998 -0.525 . . . . 0.0 111.25 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.58 -42.73 91.4 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.065 0.848 . . . . 0.0 110.183 175.062 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.8 mt -64.15 -59.68 4.14 Favored 'General case' 0 N--CA 1.456 -0.156 0 O-C-N 122.611 -0.056 . . . . 0.0 111.149 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 56.3 p -56.26 -46.38 79.67 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 178.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 t -63.47 -44.69 93.69 Favored 'General case' 0 CA--C 1.521 -0.142 0 C-N-CA 119.814 -0.754 . . . . 0.0 111.295 -177.154 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -67.34 -35.95 80.43 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 118.928 -1.109 . . . . 0.0 111.12 -178.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.92 -57.56 12.51 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.743 0.306 . . . . 0.0 110.434 174.092 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 63.9 mt -70.51 -16.59 62.91 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.927 0.891 . . . . 0.0 113.045 -174.706 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -61.92 -29.56 70.3 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -178.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.5 p80 -152.62 -17.01 0.16 Allowed 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 115.243 1.572 . . . . 0.0 115.243 -177.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.565 HG22 HG22 ' A' ' 93' ' ' THR . 27.5 mm 44.82 77.07 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 121.662 0.744 . . . . 0.0 112.084 178.05 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -147.32 21.13 1.21 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.406 0.682 . . . . 0.0 110.367 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.546 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -147.41 37.62 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 C-N-CA 124.407 1.083 . . . . 0.0 109.362 -171.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.47 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -51.11 -57.6 8.29 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -175.47 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 85.2 p -74.38 -25.85 59.75 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -173.512 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.664 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.04 -45.07 15.79 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 18.9 mt -55.58 -50.87 63.73 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 172.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.436 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 14.9 mm -67.99 -48.04 76.44 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -176.3 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.2 t -55.47 -42.81 74.86 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 119.96 -0.696 . . . . 0.0 109.96 179.218 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 73.9 mt -61.27 -62.02 2.14 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.021 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.5 pt -58.77 -35.49 56.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 119.621 1.1 . . . . 0.0 112.144 -174.091 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.48 HD13 HG21 ' A' ' 104' ' ' VAL . 76.2 mt -60.83 -59.18 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 178.336 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -63.98 -31.88 73.22 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.769 -178.641 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.501 ' CD2' ' HG ' ' A' ' 14' ' ' LEU . 3.7 m-85 -66.16 -34.23 77.56 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 122.092 -0.38 . . . . 0.0 110.162 178.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 29.5 t -68.89 -46.76 67.54 Favored 'General case' 0 C--O 1.231 0.087 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 173.159 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.6 tpp180 -56.14 -37.76 69.91 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 124.959 1.303 . . . . 0.0 112.519 -177.142 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 69.6 mt -78.35 -14.28 59.48 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 115.068 1.507 . . . . 0.0 115.068 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.463 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 82.4 m -115.18 160.08 35.42 Favored Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -169.277 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.463 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 93.9 Cg_endo -70.89 179.79 4.03 Favored 'Trans proline' 0 C--N 1.348 0.531 1 C-N-CA 125.344 4.029 . . . . 0.0 113.028 -179.234 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.549 ' HB3' ' HE3' ' A' ' 115' ' ' LYS . 5.0 p-10 -55.53 -34.51 64.74 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 114.53 1.308 . . . . 0.0 114.53 -171.152 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.2 t -63.77 -35.3 80.13 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.902 0.774 . . . . 0.0 109.452 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 62.8 t-80 -83.99 -31.1 25.68 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.078 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -58.71 -44.97 90.52 Favored 'General case' 0 C--N 1.341 0.219 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 53.5 tp -66.92 -52.05 47.83 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 122.757 0.423 . . . . 0.0 111.187 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.83 -39.63 97.75 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 -179.132 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.0 t -70.51 -33.52 71.29 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 117.322 0.561 . . . . 0.0 110.061 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.4 mt -64.82 -33.65 76.5 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.511 173.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -66.42 -39.15 88.78 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 119.331 0.969 . . . . 0.0 109.697 174.464 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 83.9 mt -64.12 -50.29 77.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 O-C-N 122.146 -0.346 . . . . 0.0 111.116 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 60.1 mt -62.1 -34.95 66.07 Favored 'Isoleucine or valine' 0 C--O 1.231 0.115 0 C-N-CA 123.712 0.805 . . . . 0.0 109.681 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -67.76 -42.76 81.27 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.985 -0.531 . . . . 0.0 110.442 177.487 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.42 ' HA ' ' NH1' ' A' ' 74' ' ' ARG . 8.0 t -66.93 -50.65 61.7 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 119.25 -0.98 . . . . 0.0 111.338 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 47.0 mt -64.89 -35.74 76.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.201 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.0 -54.31 25.31 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.966 -0.454 . . . . 0.0 111.966 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.42 ' NH1' ' HA ' ' A' ' 71' ' ' SER . 4.0 mtp-105 -61.74 -37.53 84.57 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-N 117.294 0.547 . . . . 0.0 110.817 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.02 -44.44 72.73 Favored 'General case' 0 N--CA 1.451 -0.375 0 O-C-N 122.46 -0.15 . . . . 0.0 111.004 179.592 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.2 m-30 -61.8 -45.57 93.27 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 176.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.6 tt -58.83 -52.95 63.53 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -177.156 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -58.21 -44.97 88.4 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 121.154 -0.218 . . . . 0.0 110.556 179.616 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -63.61 -43.02 98.08 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -174.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.453 HG23 HH11 ' A' ' 81' ' ' ARG . 14.6 t -82.16 -26.36 33.52 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -176.667 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.453 HH11 HG23 ' A' ' 80' ' ' THR . 9.5 mpt_? . . . . . 0 C--N 1.339 0.147 0 CA-C-N 118.694 0.679 . . . . 0.0 110.206 175.128 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.565 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.243 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.0 p -51.13 -27.26 8.07 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -177.127 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.3 -39.07 82.17 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.253 -0.904 . . . . 0.0 110.126 176.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 -68.55 -34.48 75.91 Favored 'General case' 0 CA--C 1.519 -0.227 0 C-N-CA 122.981 0.512 . . . . 0.0 109.801 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.436 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -63.74 -43.75 95.57 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.349 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.5 -42.89 94.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 175.142 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -59.98 -33.98 72.68 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 121.393 -0.123 . . . . 0.0 111.022 179.265 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.7 m -76.0 -41.47 51.03 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-O 119.535 -0.269 . . . . 0.0 111.346 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 62.6 mt -61.7 -29.74 70.29 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 119.782 -0.767 . . . . 0.0 108.985 173.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.88 -14.87 39.67 Favored Glycine 0 CA--C 1.529 0.948 0 CA-C-O 119.171 -0.794 . . . . 0.0 113.672 179.625 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.67 -6.16 25.54 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.591 1.196 . . . . 0.0 111.562 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.48 HG21 HD13 ' A' ' 51' ' ' ILE . 32.2 m -124.02 -18.12 4.05 Favored 'Isoleucine or valine' 0 C--N 1.338 0.094 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.14 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.449 HD12 ' HA ' ' A' ' 105' ' ' ILE . 11.1 tp -53.15 -31.1 17.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 CA-C-N 118.751 0.705 . . . . 0.0 111.28 -177.563 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -60.83 -55.08 37.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.884 0.474 . . . . 0.0 110.829 178.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -75.94 -31.56 59.15 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.684 0.394 . . . . 0.0 111.773 -177.434 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 58.6 mt -64.81 -50.53 66.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 97.4 mt -70.29 -50.41 39.67 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.643 -178.701 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 88.9 p -52.21 -50.19 62.44 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 118.545 0.611 . . . . 0.0 111.852 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -68.29 -46.38 70.48 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 118.662 0.664 . . . . 0.0 111.167 -178.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -54.11 -54.12 43.9 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.844 0.458 . . . . 0.0 110.499 -179.26 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 10.8 mt -65.47 -46.0 91.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 CA-C-N 118.005 0.366 . . . . 0.0 110.801 -178.411 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.01 -21.47 66.4 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 119.74 -0.171 . . . . 0.0 111.292 -176.443 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.549 ' HE3' ' HB3' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -94.88 -13.68 25.25 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 117.69 0.223 . . . . 0.0 111.432 179.831 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.441 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 50.1 p -90.11 165.9 13.72 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -172.814 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -83.55 174.08 10.88 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.137 0.975 . . . . 0.0 109.894 179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.7 tt0 -55.55 -44.39 76.73 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.906 0.482 . . . . 0.0 111.851 -178.173 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -68.44 -37.46 80.26 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 121.964 -0.46 . . . . 0.0 110.606 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.441 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 56.4 m80 -71.51 -52.54 17.78 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 119.001 -0.523 . . . . 0.0 110.969 -177.773 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -36.99 65.74 Favored 'General case' 0 C--N 1.342 0.258 0 CA-C-N 119.238 0.927 . . . . 0.0 110.922 173.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.69 -43.57 98.47 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.566 178.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -64.7 -36.16 83.39 Favored 'General case' 0 C--O 1.227 -0.109 0 CA-C-O 119.549 -0.262 . . . . 0.0 111.685 177.513 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.4 mt -68.58 -40.5 81.96 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 178.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 15.4 ttp180 -60.55 -47.04 87.95 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.701 0.401 . . . . 0.0 110.766 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.72 -30.69 64.39 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.278 -178.139 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.415 HD23 ' C ' ' A' ' 127' ' ' LEU . 7.6 tt -60.98 -47.67 85.36 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.621 0.646 . . . . 0.0 109.481 175.388 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 87.9 mt -70.09 -32.08 69.97 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.772 -0.194 . . . . 0.0 111.062 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.0 t70 . . . . . 0 N--CA 1.454 -0.256 0 N-CA-C 110.391 -0.225 . . . . 0.0 110.391 177.991 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 160' ' ' PRO . . . . . 0.467 ' HG2' ' H ' ' B' ' 161' ' ' SER . 61.1 Cg_endo . . . . . 0 N--CA 1.457 -0.62 0 N-CA-C 111.23 -0.335 . . . . 0.0 111.23 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 161' ' ' SER . . . . . 0.467 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 68.2 p -169.0 156.18 7.14 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 124.115 0.966 . . . . 0.0 109.377 176.037 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -158.33 139.43 13.19 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.63 0.252 . . . . 0.0 111.618 173.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 27.0 t -140.44 142.66 30.09 Favored Pre-proline 0 N--CA 1.454 -0.26 0 C-N-CA 123.749 0.82 . . . . 0.0 110.78 178.65 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.85 -7.71 2.55 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 123.776 2.984 . . . . 0.0 112.975 173.453 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 38.0 m . . . . . 0 CA--C 1.53 0.184 0 C-N-CA 122.967 0.507 . . . . 0.0 110.977 -179.382 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.1 t70 . . . . . 0 CA--C 1.531 0.249 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -55.64 -16.55 4.25 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 118.438 0.563 . . . . 0.0 111.077 175.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.7 tp60 -55.32 -40.1 70.77 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 123.106 0.563 . . . . 0.0 110.81 176.806 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -60.96 -40.59 93.93 Favored 'General case' 0 N--CA 1.458 -0.072 0 CA-C-N 118.516 0.598 . . . . 0.0 110.781 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -64.57 -55.73 18.56 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 57.6 t -59.09 -53.97 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.123 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -178.225 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.03 -33.07 70.33 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.165 0.586 . . . . 0.0 111.95 -177.588 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 56.3 m -70.26 -44.95 67.41 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 118.784 0.72 . . . . 0.0 110.047 177.174 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.6 tp -65.72 -34.51 78.35 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.385 0.612 . . . . 0.0 109.983 -179.262 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -67.57 -42.89 81.83 Favored 'General case' 0 CA--C 1.52 -0.2 0 C-N-CA 123.866 0.866 . . . . 0.0 109.763 178.298 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.0 m -63.94 -30.19 71.3 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 175.318 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.29 -36.27 76.88 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 176.483 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.9 tttm . . . . . 0 N--CA 1.456 -0.169 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 177.032 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.1 mm . . . . . 0 CA--C 1.53 0.186 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.3 m -50.53 127.94 18.98 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.836 0.454 . . . . 0.0 111.735 -175.732 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.22 -14.59 64.21 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-O 119.043 -0.865 . . . . 0.0 113.548 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 66.3 p -64.42 -42.25 96.14 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 119.272 1.536 . . . . 0.0 111.082 -177.376 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -64.3 -40.63 96.33 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 177.52 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 55.5 mt -64.03 -37.37 79.65 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.24 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -60.39 -47.44 86.07 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 122.722 0.409 . . . . 0.0 110.231 178.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.01 -46.53 88.79 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 118.025 0.375 . . . . 0.0 111.02 177.271 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 99.4 mt -61.6 -59.4 5.26 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 122.196 -0.315 . . . . 0.0 110.806 -177.681 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 67.3 p -56.36 -46.41 80.03 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.3 t -64.14 -44.28 92.65 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.182 -176.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -75.25 -18.56 60.07 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 120.205 -0.598 . . . . 0.0 112.349 -179.042 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.37 -59.25 3.56 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.699 0.681 . . . . 0.0 109.288 167.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.5 mp -70.92 -13.42 62.01 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -176.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -55.41 -26.64 42.92 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -153.08 -24.04 0.15 Allowed 'General case' 0 C--N 1.339 0.143 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -178.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.529 HG22 HG22 ' A' ' 93' ' ' THR . 35.8 mm 45.44 72.45 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-O 121.837 0.827 . . . . 0.0 111.446 -177.729 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -146.6 21.69 1.31 Allowed 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.48 1.112 . . . . 0.0 109.229 179.804 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.573 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.57 33.24 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.231 0 C-N-CA 124.574 1.15 . . . . 0.0 109.209 -170.89 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.513 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.2 OUTLIER -49.12 -55.67 11.54 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -177.062 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 80.4 p -74.66 -27.15 60.3 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -173.838 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.653 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.48 -43.17 17.54 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 -179.306 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 39.2 mt -55.75 -51.77 55.7 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.414 HD13 ' HA ' ' A' ' 47' ' ' ILE . 14.9 mm -67.43 -49.3 72.68 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -176.709 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 72.2 m -57.53 -35.33 70.16 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 119.277 -0.969 . . . . 0.0 110.404 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.5 tp -70.0 -43.87 70.52 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 118.909 -0.567 . . . . 0.0 112.261 -178.457 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 36.8 pt -73.37 -33.21 39.89 Favored 'Isoleucine or valine' 0 C--N 1.34 0.187 0 CA-C-N 119.304 0.956 . . . . 0.0 111.809 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.485 HD13 HG21 ' A' ' 104' ' ' VAL . 97.3 mt -65.66 -52.59 48.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.646 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -63.06 -29.09 70.54 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.356 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 33.3 t80 -62.75 -47.71 82.34 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 174.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.9 t -62.23 -33.07 73.89 Favored 'General case' 0 C--N 1.338 0.087 0 CA-C-O 120.581 0.229 . . . . 0.0 110.567 176.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -69.23 -40.91 77.64 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.866 0.866 . . . . 0.0 112.597 -177.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.2 mt -91.92 -14.81 28.98 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -174.418 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.406 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 78.7 m -100.72 159.45 29.56 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -170.622 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 57' ' ' CYS . 50.7 Cg_exo -57.94 -178.66 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.367 1 C-N-CA 126.153 4.569 . . . . 0.0 115.406 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -62.84 -46.3 88.55 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.459 1.104 . . . . 0.0 112.766 -177.037 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 50.6 m -62.54 -30.53 71.37 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 20.6 m80 -79.17 -20.58 48.1 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 119.026 -0.512 . . . . 0.0 110.756 176.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.7 tppt? -67.63 -45.86 74.13 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 173.717 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.4 tp -63.91 -44.48 92.83 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.404 176.366 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.63 -40.96 95.38 Favored Glycine 0 C--N 1.339 0.712 0 N-CA-C 110.353 -1.099 . . . . 0.0 110.353 177.426 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 71.0 m -60.74 -44.15 97.05 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.93 -0.557 . . . . 0.0 109.792 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 20.8 mt -57.87 -42.29 84.22 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.586 0.63 . . . . 0.0 111.477 178.107 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -68.6 -34.99 76.73 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.026 0.83 . . . . 0.0 111.328 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 71.3 mt -69.98 -50.96 44.1 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 O-C-N 122.026 -0.421 . . . . 0.0 110.385 178.006 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 74.9 mt -60.11 -35.16 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.105 0 C-N-CA 124.211 1.004 . . . . 0.0 109.546 178.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -68.2 -45.99 71.85 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.848 -0.596 . . . . 0.0 110.871 178.18 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.5 t -64.57 -53.39 48.52 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 118.569 0.622 . . . . 0.0 110.955 -178.003 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 47.3 mt -63.68 -34.32 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.32 -52.79 37.18 Favored Glycine 0 CA--C 1.524 0.64 0 CA-C-O 119.927 -0.374 . . . . 0.0 112.43 -178.804 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.651 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -70.27 -33.79 72.01 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 117.961 0.88 . . . . 0.0 111.001 -178.857 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.42 -48.17 70.89 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 177.265 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 -60.02 -45.68 91.99 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 176.301 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -57.05 -46.19 82.64 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 119.363 -0.351 . . . . 0.0 110.601 -176.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -68.84 -41.7 78.15 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 119.732 -0.787 . . . . 0.0 111.005 178.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -65.77 -23.71 66.78 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -176.656 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.9 t -99.94 -21.71 15.56 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 118.583 0.629 . . . . 0.0 111.231 175.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 . . . . . 0 C--N 1.339 0.14 0 CA-C-N 117.908 0.322 . . . . 0.0 110.64 175.7 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.529 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.269 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.3 p -49.91 -30.09 9.5 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.194 0.906 . . . . 0.0 113.28 -177.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.56 -45.62 82.61 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.397 -0.814 . . . . 0.0 110.193 175.447 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -65.45 -31.61 72.78 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 123.579 0.752 . . . . 0.0 110.179 177.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.25 -45.29 81.07 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.617 0.767 . . . . 0.0 110.572 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.4 mt -64.31 -41.74 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 174.751 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -61.55 -33.48 73.92 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 120.476 0.179 . . . . 0.0 110.873 179.326 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.3 m -74.14 -41.75 61.07 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 122.085 -0.384 . . . . 0.0 110.928 179.467 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 61.2 mt -61.42 -30.89 70.85 Favored 'General case' 0 C--O 1.228 -0.074 0 CA-C-N 118.859 0.754 . . . . 0.0 109.014 173.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.93 -14.39 23.52 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-O 119.018 -0.879 . . . . 0.0 113.424 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -100.43 -3.94 29.94 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 118.961 1.38 . . . . 0.0 111.785 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.485 HG21 HD13 ' A' ' 51' ' ' ILE . 33.1 m -127.14 -19.98 2.24 Favored 'Isoleucine or valine' 0 C--N 1.339 0.15 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.833 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.1 tp -54.78 -28.39 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 C-N-CA 123.157 0.583 . . . . 0.0 111.891 -175.582 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -58.85 -58.23 9.56 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 120.739 0.304 . . . . 0.0 111.095 -179.058 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -78.05 -26.03 48.08 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 122.401 0.281 . . . . 0.0 111.219 -178.336 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.0 tt -66.45 -50.3 63.83 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.337 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 75.7 mt -69.7 -52.63 23.87 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.995 -0.526 . . . . 0.0 109.901 176.885 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.4 t -40.28 -49.39 2.73 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.073 0.397 . . . . 0.0 112.056 175.469 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -72.06 -48.48 43.97 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-N 118.222 0.465 . . . . 0.0 111.596 -178.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.04 -29.98 61.24 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 123.314 0.646 . . . . 0.0 112.277 179.21 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 2.5 mt -85.59 -41.18 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 118.855 0.752 . . . . 0.0 111.272 173.377 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.13 -25.93 67.21 Favored 'General case' 0 N--CA 1.454 -0.235 0 O-C-N 121.903 -0.498 . . . . 0.0 111.075 -177.061 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.21 -19.4 43.34 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.119 0.968 . . . . 0.0 110.93 177.808 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.48 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 24.4 p -83.44 163.13 20.72 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -172.125 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -94.62 175.45 6.66 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.676 1.191 . . . . 0.0 108.444 173.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -55.86 -38.96 70.8 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.831 0.741 . . . . 0.0 112.603 -176.292 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -73.29 -37.47 66.21 Favored 'General case' 0 C--O 1.232 0.132 0 O-C-N 121.526 -0.734 . . . . 0.0 110.514 -179.536 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.48 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 43.3 m170 -72.24 -44.12 63.34 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.856 -0.592 . . . . 0.0 110.857 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.401 ' C ' ' HD2' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -58.25 -38.66 77.33 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 119.573 1.079 . . . . 0.0 109.535 175.199 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -61.21 -44.11 97.81 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.129 177.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -64.17 -35.78 81.91 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 177.522 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 94.2 mt -74.59 -37.7 44.17 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.067 0 CA-C-N 118.359 0.527 . . . . 0.0 110.108 -178.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -63.68 -39.73 95.05 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 176.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 58.4 ttp -66.34 -42.43 88.14 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.369 0.268 . . . . 0.0 110.289 175.885 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.2 tt -59.93 -44.7 94.19 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 -178.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -69.36 -37.31 77.54 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 119.151 -0.452 . . . . 0.0 111.319 178.238 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 24.6 t70 . . . . . 0 N--CA 1.457 -0.102 0 CA-C-N 118.431 0.559 . . . . 0.0 110.119 177.897 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo . . . . . 0 N--CA 1.454 -0.852 0 N-CA-C 110.359 -0.67 . . . . 0.0 110.359 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 73.5 p -71.31 160.38 32.91 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 122.447 0.299 . . . . 0.0 111.229 178.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 162' ' ' TYR . . . . . 0.43 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 16.0 t80 -146.06 138.78 25.6 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.451 0.3 . . . . 0.0 111.477 -179.112 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.9 t -130.72 139.44 35.62 Favored Pre-proline 0 CA--C 1.53 0.197 0 C-N-CA 123.411 0.684 . . . . 0.0 110.619 176.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -58.77 -11.25 11.35 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.293 2.662 . . . . 0.0 112.318 173.518 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.535 0.371 0 C-N-CA 123.706 0.802 . . . . 0.0 111.872 -175.206 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.408 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 22.5 t70 . . . . . 0 CA--C 1.534 0.343 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.408 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 18.1 t80 -55.11 -14.65 1.7 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.227 1.011 . . . . 0.0 111.254 176.776 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.6 tp60 -54.59 -40.53 68.93 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.315 0.646 . . . . 0.0 111.15 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -58.1 -46.62 85.22 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 118.924 0.784 . . . . 0.0 110.811 177.072 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -63.96 -50.48 68.44 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 117.964 0.347 . . . . 0.0 110.803 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 62.1 t -62.69 -54.46 33.63 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 -178.6 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.12 -29.79 67.64 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.288 0.635 . . . . 0.0 111.819 -177.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 72.6 m -75.12 -41.36 58.68 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.255 0.479 . . . . 0.0 110.534 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.4 tp -65.85 -33.52 76.03 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -67.42 -42.91 82.43 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.915 0.886 . . . . 0.0 109.819 175.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.7 t -60.69 -31.16 70.42 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 174.619 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.456 ' CE2' HD11 ' A' ' 68' ' ' ILE . 0.1 OUTLIER -70.88 -38.04 73.05 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 176.479 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.8 tttm . . . . . 0 N--CA 1.455 -0.186 0 C-N-CA 122.501 0.32 . . . . 0.0 111.565 177.147 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 20.8 mm . . . . . 0 C--O 1.231 0.105 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.1 t -124.66 127.56 47.5 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 117.902 0.319 . . . . 0.0 110.203 -176.525 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.73 -32.44 78.09 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-O 119.497 -0.613 . . . . 0.0 112.468 -175.402 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 80.0 p -62.23 -39.28 92.29 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.404 1.102 . . . . 0.0 110.703 -175.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.4 mpt_? -68.71 -44.66 73.44 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.147 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 77.0 mt -59.91 -41.7 86.82 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.098 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -67.59 -36.97 81.89 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 118.9 -0.571 . . . . 0.0 111.569 -179.194 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.62 -41.41 88.39 Favored 'General case' 0 C--N 1.338 0.097 0 CA-C-N 119.534 1.061 . . . . 0.0 110.495 175.838 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.3 mt -62.14 -52.07 65.31 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 122.395 -0.191 . . . . 0.0 110.568 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 44.0 p -60.87 -42.01 97.08 Favored 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 122.087 -0.383 . . . . 0.0 110.753 179.506 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.9 m -55.41 -57.52 11.51 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 122.965 0.506 . . . . 0.0 111.101 179.549 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 63.9 m-85 -76.16 -18.65 59.01 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -173.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.43 -57.76 4.86 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 118.859 0.754 . . . . 0.0 109.141 168.221 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.5 mt -70.44 -15.2 62.8 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.851 0.86 . . . . 0.0 112.949 -175.196 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -55.6 -31.41 62.22 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -178.474 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.2 t-80 -152.74 -20.81 0.16 Allowed 'General case' 0 C--N 1.34 0.171 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.481 HG22 HG22 ' A' ' 93' ' ' THR . 35.9 mm 46.8 73.78 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-O 121.82 0.819 . . . . 0.0 111.514 -178.067 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -143.97 22.65 1.74 Allowed 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.053 1.341 . . . . 0.0 108.656 178.726 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.557 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.8 pt -147.17 33.42 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 C-N-CA 124.679 1.192 . . . . 0.0 109.778 -170.117 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.455 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -50.45 -54.41 22.27 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 -176.313 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 32.6 t -74.23 -32.6 63.06 Favored 'General case' 0 C--O 1.225 -0.193 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -174.575 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.707 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -76.77 -45.6 28.34 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -178.617 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 9.6 mm -56.44 -51.73 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 173.245 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 15.4 mm -66.84 -50.83 61.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -176.01 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.8 m -59.06 -33.54 70.91 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 119.635 -0.826 . . . . 0.0 110.762 179.259 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.1 tp -70.02 -43.29 71.63 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 33.1 pt -73.58 -35.13 43.91 Favored 'Isoleucine or valine' 0 C--N 1.341 0.226 0 CA-C-N 119.427 1.012 . . . . 0.0 111.481 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.46 HD13 HG21 ' A' ' 104' ' ' VAL . 97.6 mt -64.2 -52.53 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.213 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.424 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 38.8 t70 -63.44 -31.65 72.87 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.068 179.706 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -60.18 -46.13 90.77 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 175.001 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -64.64 -37.07 86.33 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-O 120.796 0.331 . . . . 0.0 110.578 177.154 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.424 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 52.3 tpt85 -67.15 -34.75 78.24 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 124.207 1.003 . . . . 0.0 112.834 -176.728 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 71.7 mt -92.25 -14.67 28.56 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -176.464 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 66.6 m -110.65 150.84 42.31 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -170.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -74.76 -170.67 0.8 Allowed 'Trans proline' 0 CA--C 1.536 0.617 1 C-N-CA 125.65 4.234 . . . . 0.0 114.303 -177.273 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -34.72 -64.38 0.26 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 128.122 2.569 . . . . 0.0 115.027 -175.044 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 37.5 m -58.09 -28.18 64.36 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 122.505 0.322 . . . . 0.0 110.896 -174.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -90.32 -16.73 28.66 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 118.522 -0.751 . . . . 0.0 111.923 -179.059 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -70.95 -42.32 69.95 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 169.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 59.9 tp -66.93 -47.49 71.53 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 176.763 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.64 -46.04 93.86 Favored Glycine 0 C--N 1.338 0.662 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 178.566 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 92.2 p -63.07 -41.45 99.44 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 117.574 0.687 . . . . 0.0 110.163 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 31.4 mt -61.68 -40.25 94.3 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 119.06 0.845 . . . . 0.0 111.487 177.917 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -67.84 -34.47 76.77 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 119.721 1.146 . . . . 0.0 111.147 177.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.456 HD11 ' CE2' ' A' ' 17' ' ' PHE . 69.3 mt -68.3 -49.05 70.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 O-C-N 121.72 -0.613 . . . . 0.0 110.497 177.172 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.25 -34.6 64.79 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.077 0 C-N-CA 124.13 0.972 . . . . 0.0 109.39 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -67.95 -44.17 77.41 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.162 0.585 . . . . 0.0 110.505 177.554 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 14.3 m -67.64 -49.88 60.71 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 119.725 -0.79 . . . . 0.0 111.038 -177.588 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 67.5 mt -67.11 -38.13 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 179.528 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.15 -46.7 78.2 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 -178.163 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.4 mtp-105 -69.22 -36.72 77.52 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 117.257 0.528 . . . . 0.0 110.773 178.384 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.16 -40.08 86.59 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 177.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.4 m-30 -64.99 -48.2 74.82 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 175.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.3 tp -56.9 -43.42 81.35 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 123.367 0.417 . . . . 0.0 109.968 -177.447 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -67.3 -42.43 83.75 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 122.523 -0.111 . . . . 0.0 110.874 178.198 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -62.8 -40.9 98.8 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 111.444 0.164 . . . . 0.0 111.444 -176.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.5 t -84.02 -26.99 28.68 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.409 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 13.7 tpp180 . . . . . 0 C--N 1.34 0.193 0 CA-C-N 118.26 0.482 . . . . 0.0 110.807 175.938 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.481 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.237 0 CA-C-O 119.034 -0.508 . . . . 0.0 109.883 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 23.0 p -48.61 -30.62 5.57 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.107 0.867 . . . . 0.0 113.248 -178.354 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.64 -46.62 81.77 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.313 -0.867 . . . . 0.0 109.922 175.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 41.0 t60 -65.81 -32.05 73.36 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.949 -0.568 . . . . 0.0 109.955 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.27 -45.35 88.43 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 123.686 0.794 . . . . 0.0 110.597 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.4 mt -63.01 -42.72 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.171 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 174.528 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -59.83 -35.31 74.48 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 121.232 -0.187 . . . . 0.0 111.156 179.125 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.6 m -72.49 -41.33 66.1 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-O 119.588 -0.244 . . . . 0.0 111.235 178.833 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 55.3 mt -60.97 -29.62 69.77 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 119.459 -0.896 . . . . 0.0 108.955 174.805 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.8 -14.45 16.02 Favored Glycine 0 CA--C 1.533 1.159 0 CA-C-O 118.928 -0.929 . . . . 0.0 113.923 178.131 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -104.64 -3.73 23.39 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.261 1.531 . . . . 0.0 112.135 -178.809 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.46 HG21 HD13 ' A' ' 51' ' ' ILE . 35.5 m -123.61 -17.06 4.66 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.149 0 C-N-CA 122.784 0.433 . . . . 0.0 111.949 -178.837 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -48.3 -28.64 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -58.73 -59.05 6.03 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 117.917 0.326 . . . . 0.0 111.497 -178.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -70.97 -30.71 67.06 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 117.841 0.291 . . . . 0.0 110.711 -177.171 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.1 mp -63.02 -55.14 28.24 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.497 -0.287 . . . . 0.0 110.44 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 62.3 mt -71.36 -49.18 44.9 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 118.137 0.426 . . . . 0.0 110.965 -178.105 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 66.0 p -49.94 -52.04 36.5 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 119.003 -0.522 . . . . 0.0 112.327 178.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -72.53 -41.99 65.24 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 119.187 0.903 . . . . 0.0 111.709 -177.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.69 -41.76 82.29 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.575 0.625 . . . . 0.0 111.221 -178.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 10.5 mt -78.55 -35.14 18.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 118.822 0.737 . . . . 0.0 111.12 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.01 -30.14 70.63 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 120.316 -0.554 . . . . 0.0 111.119 -178.228 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.42 -19.89 48.89 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.141 0.576 . . . . 0.0 110.303 176.353 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 40.3 m -78.16 156.14 30.05 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -173.38 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.1 t-20 -88.75 176.48 7.06 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 169.562 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -55.65 -38.47 69.61 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.916 0.78 . . . . 0.0 111.433 -178.073 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -66.62 -43.51 84.57 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.662 -0.649 . . . . 0.0 111.01 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -72.74 -35.01 67.43 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 119.493 -0.289 . . . . 0.0 110.683 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -41.57 87.98 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 118.828 0.74 . . . . 0.0 109.139 172.698 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -66.45 -39.21 88.74 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.222 -178.272 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -61.81 -39.95 93.53 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 119.372 -0.347 . . . . 0.0 111.196 175.433 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.2 mt -73.36 -34.97 44.93 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.11 0 CA-C-N 118.437 0.562 . . . . 0.0 109.709 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -66.65 -39.32 88.17 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 122.224 -0.298 . . . . 0.0 110.52 177.563 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 25.6 ttt -64.19 -46.28 84.63 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 176.426 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.5 tt -55.88 -47.45 77.34 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.942 0.497 . . . . 0.0 110.663 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.1 mt -75.51 -30.9 59.96 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -177.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.6 t70 . . . . . 0 N--CA 1.45 -0.436 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 177.782 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo . . . . . 0 N--CA 1.454 -0.819 0 N-CA-C 110.251 -0.711 . . . . 0.0 110.251 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 31.9 t -66.57 137.96 57.14 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -146.5 141.22 26.84 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 122.813 0.445 . . . . 0.0 111.44 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 16.4 t -133.8 145.69 57.08 Favored Pre-proline 0 C--O 1.233 0.213 0 C-N-CA 123.617 0.767 . . . . 0.0 111.093 -175.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.32 1.98 2.17 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 123.476 2.784 . . . . 0.0 111.341 177.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 24.2 p . . . . . 0 CA--C 1.529 0.171 0 CA-C-O 118.711 -0.661 . . . . 0.0 112.011 176.649 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.1 t70 . . . . . 0 CA--C 1.535 0.39 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -55.77 -13.05 1.51 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.546 0.739 . . . . 0.0 111.557 177.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -52.93 -44.53 67.11 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.512 0.725 . . . . 0.0 110.94 177.209 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -58.13 -41.74 84.33 Favored 'General case' 0 C--O 1.227 -0.095 0 CA-C-N 118.542 0.61 . . . . 0.0 111.523 177.609 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -64.86 -53.17 50.95 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 118.166 0.439 . . . . 0.0 110.302 -178.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.1 t -61.69 -53.73 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -178.472 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.51 -32.31 68.71 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 123.236 0.614 . . . . 0.0 111.916 -178.113 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 55.7 m -72.59 -44.95 61.34 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 118.403 0.547 . . . . 0.0 110.444 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.9 tp -65.47 -32.45 74.08 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.115 0.416 . . . . 0.0 109.975 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -67.81 -45.64 74.17 Favored 'General case' 0 N--CA 1.458 -0.058 0 C-N-CA 123.876 0.871 . . . . 0.0 109.777 176.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.0 t -63.43 -27.9 69.6 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.225 176.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.25 -43.57 70.28 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 175.646 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt . . . . . 0 CA--C 1.53 0.202 0 C-N-CA 124.014 0.926 . . . . 0.0 112.359 -179.982 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.8 mm . . . . . 0 CA--C 1.532 0.285 0 CA-C-O 121.13 0.49 . . . . 0.0 111.082 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.3 t -57.98 132.74 54.35 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.785 0.434 . . . . 0.0 111.01 -178.674 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.89 -27.62 71.5 Favored Glycine 0 C--N 1.339 0.697 0 C-N-CA 123.582 0.61 . . . . 0.0 113.177 -175.066 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.431 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 39.6 t -59.08 -43.84 91.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 117.901 0.851 . . . . 0.0 111.515 -174.725 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -65.5 -42.32 92.27 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -179.199 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 52.9 mt -62.53 -41.34 91.64 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.183 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.2 mmtt -64.59 -35.68 81.76 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 119.327 -0.368 . . . . 0.0 111.383 -179.495 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.431 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -65.93 -46.25 78.91 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 118.712 0.687 . . . . 0.0 110.115 174.025 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.22 -56.28 23.53 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 121.237 -0.185 . . . . 0.0 110.627 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.433 HG21 ' OG ' ' A' ' 71' ' ' SER . 77.3 p -58.13 -48.29 80.69 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.455 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 t -63.02 -44.0 97.16 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 120.084 -0.646 . . . . 0.0 111.389 -176.469 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -73.57 -22.48 60.05 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.652 0.66 . . . . 0.0 112.418 -178.855 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.82 -56.45 9.1 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 118.991 0.814 . . . . 0.0 109.172 168.421 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 55.7 mt -68.89 -15.84 63.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.157 0.983 . . . . 0.0 112.666 -175.449 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -59.81 -25.81 65.26 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.6 t-160 -150.23 -27.81 0.24 Allowed 'General case' 0 C--N 1.34 0.16 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -176.331 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.489 HG22 HG22 ' A' ' 93' ' ' THR . 42.2 mm 45.21 74.18 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-O 121.815 0.817 . . . . 0.0 111.899 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -149.41 22.84 0.92 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.435 1.094 . . . . 0.0 109.61 179.383 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.541 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -147.7 39.54 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 124.69 1.196 . . . . 0.0 109.131 -170.413 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.427 ' HB3' ' HA ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -52.33 -54.87 26.08 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -174.002 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.405 ' N ' ' HG2' ' A' ' 43' ' ' GLU . 78.9 p -75.77 -27.06 57.9 Favored 'General case' 0 CA--C 1.521 -0.166 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -172.29 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.699 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -81.49 -43.83 18.26 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.146 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 36.7 mt -55.91 -53.5 37.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 171.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' A' ' 47' ' ' ILE . 16.0 mm -66.58 -47.87 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 CA-C-O 119.078 -0.487 . . . . 0.0 112.027 -176.084 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 73.6 m -59.15 -35.5 73.62 Favored 'General case' 0 C--O 1.23 0.054 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.153 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.3 tp -68.53 -43.49 76.62 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 119.17 -0.443 . . . . 0.0 112.055 -178.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 33.2 pt -74.03 -33.33 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 119.217 0.917 . . . . 0.0 112.265 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.482 HD13 HG21 ' A' ' 104' ' ' VAL . 97.1 mt -66.3 -50.32 68.99 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 177.807 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -57.86 -42.1 83.81 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.266 178.153 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -58.39 -41.09 84.08 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 175.467 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.5 t -63.31 -46.22 87.73 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -178.527 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -80.47 -23.14 40.39 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -175.572 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.3 mt -84.87 -19.51 32.25 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 179.163 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.4 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 72.9 m -104.2 156.22 36.07 Favored Pre-proline 0 CA--C 1.534 0.339 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -170.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 57' ' ' CYS . 85.4 Cg_exo -50.74 176.36 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.537 1 C-N-CA 126.498 4.798 . . . . 0.0 115.997 175.067 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.454 ' HB2' ' HE3' ' A' ' 115' ' ' LYS . 10.4 p-10 -56.18 -49.61 73.53 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 125.905 1.682 . . . . 0.0 114.069 -174.019 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 52.8 m -62.75 -27.55 69.36 Favored 'General case' 0 CA--C 1.522 -0.101 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -81.95 -18.68 42.7 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 118.688 -0.673 . . . . 0.0 111.057 178.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -74.72 -40.2 61.44 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 119.381 0.991 . . . . 0.0 108.525 171.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 61.5 tp -64.35 -51.49 63.08 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 174.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.5 -36.82 90.81 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.765 -0.934 . . . . 0.0 110.765 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.7 t -60.58 -48.4 81.94 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.976 0.388 . . . . 0.0 110.137 177.012 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 31.1 mt -59.88 -35.55 75.06 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 118.55 0.614 . . . . 0.0 111.357 178.115 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -67.68 -37.23 82.04 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.117 0.872 . . . . 0.0 110.789 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 66.8 mt -70.31 -47.97 63.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 O-C-N 121.683 -0.635 . . . . 0.0 110.219 178.603 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 85.6 mt -59.98 -38.85 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 C-N-CA 123.993 0.917 . . . . 0.0 109.279 178.162 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -65.99 -42.97 89.12 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 118.787 -0.625 . . . . 0.0 110.555 178.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.433 ' OG ' HG21 ' A' ' 33' ' ' THR . 6.6 t -65.66 -54.6 25.37 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.621 0.646 . . . . 0.0 111.74 -177.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 55.8 mt -62.82 -33.48 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.532 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.18 -50.99 41.53 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-O 119.612 -0.549 . . . . 0.0 112.451 -179.449 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.634 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -70.82 -33.6 70.85 Favored 'General case' 0 CA--C 1.523 -0.07 0 CA-C-N 118.184 0.992 . . . . 0.0 110.72 -178.475 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.79 -44.49 77.26 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 177.34 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -62.83 -47.02 85.23 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 176.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.5 tp -57.42 -46.57 83.37 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 123.38 0.425 . . . . 0.0 110.379 -176.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -68.61 -44.45 74.27 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.094 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -68.9 -21.65 64.22 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -176.443 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 6.9 t -96.55 -28.01 14.58 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-N 118.675 0.67 . . . . 0.0 111.978 178.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 . . . . . 0 C--N 1.341 0.215 0 CA-C-N 118.657 0.662 . . . . 0.0 111.58 176.555 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.489 HG22 HG22 ' A' ' 40' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--O 1.227 -0.094 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 23.1 p -50.29 -32.03 15.89 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.058 1.343 . . . . 0.0 113.758 -172.266 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.14 -48.04 81.87 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.648 0.658 . . . . 0.0 109.973 176.525 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -75.34 -21.42 58.39 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.586 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.0 -44.88 83.49 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.469 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.2 mt -64.26 -43.7 97.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 174.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -58.97 -33.74 70.99 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.48 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.8 m -73.75 -42.6 60.88 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-O 119.301 -0.381 . . . . 0.0 110.887 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 56.8 mt -60.83 -29.55 69.56 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-N 119.053 0.842 . . . . 0.0 109.233 174.136 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.21 -14.31 25.17 Favored Glycine 0 CA--C 1.531 1.038 0 CA-C-O 119.104 -0.831 . . . . 0.0 113.635 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.8 -4.58 27.72 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.873 1.337 . . . . 0.0 112.044 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.482 HG21 HD13 ' A' ' 51' ' ' ILE . 27.0 m -126.18 -18.44 2.97 Favored 'Isoleucine or valine' 0 C--N 1.337 0.056 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -178.611 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.0 tp -49.62 -27.84 3.33 Favored 'Isoleucine or valine' 0 C--N 1.339 0.15 0 C-N-CA 123.753 0.821 . . . . 0.0 112.293 -175.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.9 pt20 -61.97 -49.69 75.1 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 117.764 0.256 . . . . 0.0 110.709 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -70.12 -36.51 74.86 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 -177.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.5 mt -63.81 -53.41 51.26 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.612 -177.099 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.432 ' O ' HG13 ' A' ' 113' ' ' ILE . 65.2 mt -66.05 -64.41 0.86 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.536 -0.745 . . . . 0.0 109.358 177.572 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 84.6 p -39.91 -49.69 2.44 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -71.66 -44.41 64.33 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 119.496 1.044 . . . . 0.0 111.404 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.13 -43.02 82.0 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.717 0.689 . . . . 0.0 110.874 -178.54 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.1 OUTLIER -76.88 -32.92 20.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 CA-C-N 119.01 0.823 . . . . 0.0 111.953 178.661 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.95 -30.05 68.41 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.34 0.518 . . . . 0.0 110.902 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.454 ' HE3' ' HB2' ' A' ' 59' ' ' ASP . 0.8 OUTLIER -77.62 -19.46 55.47 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.328 0.651 . . . . 0.0 110.227 175.577 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 56.0 m -81.29 153.96 26.81 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -173.23 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -92.35 177.61 6.09 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 170.07 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -55.36 -36.33 66.21 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.001 0.819 . . . . 0.0 111.608 -177.582 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -67.27 -47.13 71.58 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.779 -0.576 . . . . 0.0 110.382 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -70.11 -33.48 71.9 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 119.474 -0.298 . . . . 0.0 110.519 -179.404 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -42.25 93.21 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 118.591 0.632 . . . . 0.0 109.325 173.553 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -66.44 -40.25 89.37 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.149 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp -61.74 -43.83 98.08 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 119.661 -0.209 . . . . 0.0 110.996 176.452 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 95.6 mt -69.81 -38.38 75.77 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -63.95 -40.89 97.48 Favored 'General case' 0 CA--C 1.523 -0.091 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 60.9 ttp -63.27 -43.92 96.58 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 177.562 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 8.2 tt -58.76 -45.01 90.73 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 97.1 mt -73.19 -32.9 65.09 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.4 t70 . . . . . 0 N--CA 1.458 -0.051 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 177.455 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 160' ' ' PRO . . . . . 0.442 ' HG2' ' H ' ' B' ' 161' ' ' SER . 59.4 Cg_endo . . . . . 0 N--CA 1.453 -0.902 0 N-CA-C 110.868 -0.474 . . . . 0.0 110.868 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 161' ' ' SER . . . . . 0.442 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 34.2 t -175.53 168.3 3.21 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 125.14 1.376 . . . . 0.0 108.079 178.369 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 162' ' ' TYR . . . . . 0.415 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 48.4 t80 -152.02 132.92 14.17 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.187 -0.321 . . . . 0.0 111.804 171.551 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.1 t -135.29 140.98 36.07 Favored Pre-proline 0 N--CA 1.455 -0.224 0 C-N-CA 123.181 0.592 . . . . 0.0 110.791 177.495 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -65.71 -6.56 14.22 Favored 'Trans proline' 0 N--CA 1.45 -1.052 0 C-N-CA 122.734 2.29 . . . . 0.0 111.302 177.115 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 71.1 p . . . . . 0 C--O 1.233 0.2 0 N-CA-C 113.345 0.868 . . . . 0.0 113.345 -177.73 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.436 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 14.1 t70 . . . . . 0 CA--C 1.535 0.382 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.436 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 10.6 t80 -55.59 -14.49 2.15 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.863 0.865 . . . . 0.0 111.297 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -55.27 -35.25 64.83 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.908 0.883 . . . . 0.0 111.485 176.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.6 m-20 -61.82 -45.46 93.72 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.359 0.981 . . . . 0.0 109.292 178.582 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -66.18 -48.39 70.87 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 110.557 -0.164 . . . . 0.0 110.557 -177.295 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.6 t -65.92 -54.67 24.82 Favored 'Isoleucine or valine' 0 C--N 1.339 0.118 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 -178.363 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.59 -31.76 69.76 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.828 0.451 . . . . 0.0 111.737 -178.192 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 69.5 m -73.63 -40.35 63.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 120.214 -0.595 . . . . 0.0 110.336 176.8 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.9 tp -66.28 -31.86 72.93 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.009 0.433 . . . . 0.0 109.852 179.093 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -69.74 -44.19 70.78 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.787 0.835 . . . . 0.0 109.683 175.155 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.2 t -63.26 -26.06 68.61 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 175.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.506 ' CE2' HD11 ' A' ' 68' ' ' ILE . 0.2 OUTLIER -71.19 -45.81 62.61 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 174.992 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt . . . . . 0 N--CA 1.455 -0.199 0 C-N-CA 122.865 0.466 . . . . 0.0 110.783 177.454 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.8 mt . . . . . 0 CA--C 1.53 0.205 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.5 m -139.3 123.88 18.38 Favored 'General case' 0 CA--C 1.523 -0.093 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 176.143 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.14 -26.96 73.35 Favored Glycine 0 CA--C 1.525 0.714 0 CA-C-O 119.489 -0.617 . . . . 0.0 112.682 -174.172 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.425 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 83.4 p -65.28 -35.22 80.34 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 118.398 1.099 . . . . 0.0 109.87 -179.173 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.6 mmt-85 -68.08 -46.0 72.23 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 73.0 mt -60.87 -36.38 71.29 Favored 'Isoleucine or valine' 0 C--O 1.231 0.1 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.104 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.9 mmtt -69.26 -40.86 77.58 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 119.009 -0.52 . . . . 0.0 111.504 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.39 -38.48 87.61 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.188 0.904 . . . . 0.0 110.953 176.153 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.7 mt -63.32 -57.84 9.06 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 122.161 0.184 . . . . 0.0 110.797 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.417 HG21 ' HB2' ' A' ' 71' ' ' SER . 33.4 p -56.27 -42.12 76.95 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 118.074 0.397 . . . . 0.0 111.272 177.028 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.0 m -55.65 -55.08 36.38 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 119.01 -0.519 . . . . 0.0 110.913 -179.571 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -67.86 -37.18 81.5 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.326 -0.949 . . . . 0.0 111.584 -176.513 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.09 -58.66 7.22 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 118.063 0.392 . . . . 0.0 110.978 177.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.45 HD21 ' HB1' ' A' ' 75' ' ' ALA . 8.2 mp -67.95 -25.09 65.28 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -178.034 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -71.71 -19.15 62.1 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 117.857 0.299 . . . . 0.0 111.091 176.31 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -146.74 52.83 1.1 Allowed 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.36 0.264 . . . . 0.0 111.456 -175.123 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.534 HG22 HG22 ' A' ' 93' ' ' THR . 33.3 mm -65.06 76.18 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-O 121.757 0.789 . . . . 0.0 109.908 171.133 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -144.13 10.96 1.53 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.597 1.559 . . . . 0.0 109.063 174.108 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.464 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -146.15 95.26 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 C-N-CA 125.68 1.592 . . . . 0.0 107.935 -176.572 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.561 ' CD ' ' H ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -91.76 -79.27 0.38 Allowed 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -177.18 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.561 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 46.1 m -57.72 -21.31 40.14 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 123.554 0.741 . . . . 0.0 112.96 -174.896 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.558 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -76.02 -54.07 7.41 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.349 0.659 . . . . 0.0 110.346 178.632 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 6.2 mt -56.36 -44.25 79.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 173.869 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.5 mm -67.14 -47.38 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.166 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.082 -179.185 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 42.7 t -58.95 -34.49 71.83 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-N 118.406 0.548 . . . . 0.0 109.968 178.486 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.9 tp -68.71 -45.42 71.64 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.811 -179.437 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.9 pt -72.3 -34.93 50.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 119.415 1.007 . . . . 0.0 112.183 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.494 HD13 HG21 ' A' ' 104' ' ' VAL . 96.3 mt -64.55 -51.71 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 178.655 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -64.91 -27.92 69.18 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.078 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -61.94 -46.81 87.68 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 175.009 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.7 t -61.86 -38.8 89.63 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.39 175.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -61.24 -42.77 99.19 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.621 0.769 . . . . 0.0 112.602 -176.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 83.7 mt -86.23 -14.76 42.9 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 -175.599 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.421 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 76.0 m -105.21 155.74 37.31 Favored Pre-proline 0 CA--C 1.533 0.309 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -170.569 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.421 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 92.3 Cg_endo -69.17 -176.44 1.32 Allowed 'Trans proline' 0 N--CA 1.459 -0.532 1 C-N-CA 125.431 4.088 . . . . 0.0 113.142 -178.882 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -54.82 -44.32 73.75 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.382 1.473 . . . . 0.0 113.98 -171.638 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.0 m -58.03 -29.32 65.25 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -92.86 -14.48 27.63 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 118.892 -0.575 . . . . 0.0 111.672 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -65.85 -49.0 69.73 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 169.472 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 44.5 tp -67.74 -48.21 67.1 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.346 179.334 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -56.84 -43.64 92.27 Favored Glycine 0 C--N 1.337 0.598 0 N-CA-C 110.73 -0.948 . . . . 0.0 110.73 179.397 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.2 t -67.5 -35.46 79.18 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.699 -0.667 . . . . 0.0 110.91 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 35.9 mt -60.9 -34.58 74.87 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 119.649 1.113 . . . . 0.0 110.66 173.687 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -71.67 -32.47 67.91 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.887 0.767 . . . . 0.0 111.347 175.719 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.506 HD11 ' CE2' ' A' ' 17' ' ' PHE . 92.6 mt -70.7 -44.07 76.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 CA-C-N 118.798 0.726 . . . . 0.0 110.413 176.163 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.1 mt -63.65 -35.41 72.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 177.631 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -70.07 -39.49 75.6 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 119.057 -0.496 . . . . 0.0 111.252 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.417 ' HB2' HG21 ' A' ' 33' ' ' THR . 95.8 p -69.72 -55.33 10.23 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 118.907 0.776 . . . . 0.0 110.5 -176.418 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 39.3 mt -64.75 -33.42 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.279 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.42 -52.21 45.59 Favored Glycine 0 CA--C 1.524 0.622 0 CA-C-O 119.846 -0.419 . . . . 0.0 112.239 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.651 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -72.06 -31.24 65.94 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 118.061 0.931 . . . . 0.0 111.115 -178.703 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.45 ' HB1' HD21 ' A' ' 37' ' ' LEU . . . -70.49 -41.89 72.08 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 177.732 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -62.84 -48.49 78.82 Favored 'General case' 0 CA--C 1.519 -0.22 0 O-C-N 122.153 -0.342 . . . . 0.0 110.094 175.052 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 55.1 tp -58.04 -44.03 87.18 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 123.312 0.383 . . . . 0.0 110.277 -176.679 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -66.12 -46.02 79.06 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 110.598 -0.149 . . . . 0.0 110.598 179.254 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -64.39 -34.8 79.0 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -176.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.4 t -85.93 -23.7 26.86 Favored 'General case' 0 CA--C 1.527 0.082 0 CA-C-N 118.147 0.43 . . . . 0.0 112.022 -178.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.5 tpp180 . . . . . 0 C--O 1.232 0.157 0 CA-C-N 118.328 0.513 . . . . 0.0 112.003 176.852 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.534 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.296 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.6 p -52.53 -29.08 23.41 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -175.593 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.65 -44.57 85.97 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 118.842 0.746 . . . . 0.0 109.802 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -67.58 -30.44 70.05 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 120.99 0.424 . . . . 0.0 110.041 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.5 -43.63 80.42 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.344 -178.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.0 mt -63.66 -43.06 97.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 108.741 -0.836 . . . . 0.0 108.741 173.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -60.71 -32.76 71.99 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-O 120.572 0.225 . . . . 0.0 110.774 178.237 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.9 m -74.18 -40.25 62.65 Favored 'General case' 0 C--N 1.338 0.087 0 O-C-N 121.851 -0.531 . . . . 0.0 110.837 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 44.2 mt -61.56 -30.67 70.81 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 119.637 -0.825 . . . . 0.0 108.884 172.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.12 -14.6 18.7 Favored Glycine 0 CA--C 1.531 1.065 0 CA-C-O 119.027 -0.874 . . . . 0.0 114.019 178.334 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -102.48 -3.87 26.24 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 118.921 1.36 . . . . 0.0 112.307 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.494 HG21 HD13 ' A' ' 51' ' ' ILE . 27.8 m -123.9 -18.98 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.508 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.2 tp -49.99 -27.46 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 123.846 0.859 . . . . 0.0 112.796 -178.455 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -63.38 -46.54 86.02 Favored 'General case' 0 N--CA 1.453 -0.289 0 O-C-N 122.008 -0.433 . . . . 0.0 110.988 178.097 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -74.26 -39.04 63.27 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -178.212 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 97.1 mt -62.4 -51.02 69.22 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.419 -177.209 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.424 ' O ' HG13 ' A' ' 113' ' ' ILE . 78.5 mt -66.3 -59.15 3.99 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.391 -0.814 . . . . 0.0 109.806 177.559 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.1 p -48.5 -46.04 37.85 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.526 1.057 . . . . 0.0 112.361 -175.6 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 -70.97 -45.57 63.85 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 119.192 0.906 . . . . 0.0 111.0 179.016 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.93 -37.83 74.8 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 119.02 -0.514 . . . . 0.0 112.035 -178.148 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -82.51 -32.29 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.154 0 C-N-CA 119.312 -0.955 . . . . 0.0 111.888 176.901 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.9 -29.45 66.64 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.469 -179.421 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.9 -16.56 53.26 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 122.853 0.461 . . . . 0.0 110.754 176.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 15.7 m -77.52 157.91 30.17 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -172.395 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -95.02 178.7 5.47 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 169.341 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -55.66 -39.58 71.1 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.64 -0.663 . . . . 0.0 111.949 -177.345 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -69.84 -37.25 76.12 Favored 'General case' 0 N--CA 1.456 -0.154 0 O-C-N 121.792 -0.567 . . . . 0.0 110.842 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -77.0 -39.15 51.44 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.169 -0.444 . . . . 0.0 111.322 -176.666 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.66 -34.35 78.0 Favored 'General case' 0 CA--C 1.522 -0.118 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 174.644 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -63.42 -45.06 92.72 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.478 176.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -61.95 -41.25 97.76 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.994 0.361 . . . . 0.0 111.436 177.294 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 95.6 mt -68.04 -40.58 83.37 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.117 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.6 tmm_? -62.51 -43.2 99.39 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 178.258 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -61.61 -45.68 93.04 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.387 0.675 . . . . 0.0 110.681 179.037 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.0 tt -60.49 -46.23 90.89 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.462 0.305 . . . . 0.0 110.458 177.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 98.1 mt -69.19 -29.98 68.07 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 119.796 -0.145 . . . . 0.0 111.363 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 29.1 t70 . . . . . 0 N--CA 1.453 -0.276 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 177.215 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 160' ' ' PRO . . . . . 0.425 ' HD2' ' N ' ' A' ' 27' ' ' SER . 67.1 Cg_endo . . . . . 0 N--CA 1.455 -0.785 0 N-CA-C 109.167 -1.128 . . . . 0.0 109.167 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 79.5 p -63.46 152.78 37.41 Favored 'General case' 0 N--CA 1.455 -0.186 0 O-C-N 121.983 -0.448 . . . . 0.0 110.451 179.147 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 162' ' ' TYR . . . . . 0.469 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 10.1 t80 -141.78 136.99 31.25 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.41 0.284 . . . . 0.0 111.439 -178.556 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 31.3 t -133.15 143.96 50.62 Favored Pre-proline 0 N--CA 1.455 -0.214 0 C-N-CA 123.262 0.625 . . . . 0.0 110.815 178.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -58.6 -11.29 11.07 Favored 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 123.251 2.634 . . . . 0.0 112.653 173.139 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 69.9 p . . . . . 0 CA--C 1.529 0.153 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.199 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.445 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 17.5 t70 . . . . . 0 CA--C 1.535 0.394 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.445 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 10.9 t80 -55.34 -15.1 2.22 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 121.712 -0.618 . . . . 0.0 111.386 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -55.27 -36.39 66.06 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 123.392 0.677 . . . . 0.0 110.681 175.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 42.9 m-20 -66.55 -44.86 81.21 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 118.952 0.796 . . . . 0.0 109.999 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -65.95 -47.85 73.3 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 117.903 0.32 . . . . 0.0 110.719 -176.65 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 98.6 t -65.27 -55.57 19.66 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -179.278 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.64 -31.07 65.91 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -178.375 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 62.3 m -74.6 -42.01 59.42 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 118.11 0.414 . . . . 0.0 111.051 177.51 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.7 tp -67.62 -31.08 70.86 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.476 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -68.76 -42.34 77.63 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.852 0.861 . . . . 0.0 109.653 174.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.0 t -62.84 -29.36 70.68 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 174.292 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.471 ' CD2' HD11 ' A' ' 68' ' ' ILE . 0.1 OUTLIER -72.75 -36.61 67.74 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.182 0.193 . . . . 0.0 110.538 176.232 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt . . . . . 0 CA--C 1.529 0.161 0 C-N-CA 122.435 0.294 . . . . 0.0 110.217 175.653 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.2 mm . . . . . 0 CA--C 1.528 0.098 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.8 m -136.84 138.07 40.4 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.806 0.336 . . . . 0.0 110.588 179.68 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.76 -21.55 65.35 Favored Glycine 0 CA--C 1.523 0.538 0 CA-C-O 119.11 -0.828 . . . . 0.0 112.751 -178.175 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.417 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 59.6 p -66.19 -45.67 80.0 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.838 1.319 . . . . 0.0 110.907 -175.32 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.43 ' HB3' ' CD2' ' A' ' 17' ' ' PHE . 8.4 mpt_? -68.06 -41.47 81.95 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.9 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 74.3 mt -61.68 -39.49 83.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.2 mmtt -63.57 -45.55 89.92 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.556 0.742 . . . . 0.0 110.759 179.01 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.59 -39.09 91.21 Favored 'General case' 0 C--N 1.339 0.125 0 CA-C-N 118.226 0.466 . . . . 0.0 111.715 179.325 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 93.0 mt -65.79 -53.86 34.71 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 119.408 -0.33 . . . . 0.0 111.249 -179.54 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.427 HG21 ' HB2' ' A' ' 71' ' ' SER . 41.1 p -57.81 -41.25 81.79 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 118.491 0.587 . . . . 0.0 110.959 177.056 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.1 m -55.85 -57.78 10.63 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.307 179.5 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -68.67 -31.29 70.3 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 118.993 -1.083 . . . . 0.0 111.777 -175.753 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.84 -59.2 5.59 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.304 0.502 . . . . 0.0 109.739 174.472 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.469 HD21 ' HB1' ' A' ' 75' ' ' ALA . 8.7 mp -72.06 -14.35 61.84 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -177.152 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -57.76 -26.73 62.27 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -179.411 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -151.97 -24.4 0.18 Allowed 'General case' 0 C--N 1.339 0.135 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -177.288 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.542 HG22 HG22 ' A' ' 93' ' ' THR . 25.8 mm 44.2 73.06 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-O 121.708 0.766 . . . . 0.0 111.186 -177.813 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -147.89 22.19 1.11 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.936 0.894 . . . . 0.0 109.556 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.549 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.3 pt -148.51 35.46 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 C-N-CA 124.562 1.145 . . . . 0.0 109.354 -170.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.425 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -50.99 -55.5 17.05 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 123.887 0.875 . . . . 0.0 113.262 -176.015 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 57.5 p -75.61 -28.32 58.82 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -173.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.673 ' H ' ' CD ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -79.51 -45.82 18.59 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -179.833 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 14.8 mt -55.69 -50.26 68.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 118.019 0.372 . . . . 0.0 110.169 172.358 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.443 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 12.9 mm -66.74 -50.2 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.225 0 CA-C-O 119.341 -0.361 . . . . 0.0 111.894 -176.634 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.4 m -57.07 -34.28 68.12 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 118.962 0.801 . . . . 0.0 110.491 178.416 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.3 tp -70.06 -45.02 67.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -179.187 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 38.2 pt -72.01 -32.57 44.37 Favored 'Isoleucine or valine' 0 C--N 1.341 0.202 0 CA-C-N 119.472 1.033 . . . . 0.0 111.848 -179.512 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.481 HD13 HG21 ' A' ' 104' ' ' VAL . 92.7 mt -66.53 -48.46 80.42 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.329 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -63.8 -25.81 68.34 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.876 177.227 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -66.37 -43.57 85.6 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 173.672 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.5 m -59.36 -38.07 79.48 Favored 'General case' 0 C--N 1.341 0.229 0 O-C-N 122.15 -0.344 . . . . 0.0 110.645 174.738 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -68.17 -43.17 78.79 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.35 1.06 . . . . 0.0 112.859 -177.109 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 73.4 mt -89.55 -15.26 33.3 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -173.507 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 86.2 m -104.11 159.13 30.33 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -171.632 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -57.11 177.45 0.19 Allowed 'Trans proline' 0 N--CA 1.46 -0.468 1 C-N-CA 125.524 4.149 . . . . 0.0 115.071 179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.446 ' HB3' ' HE3' ' A' ' 115' ' ' LYS . 72.3 m-20 -58.06 -47.26 83.68 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.19 1.396 . . . . 0.0 112.873 -178.024 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.9 m -60.06 -25.14 65.13 Favored 'General case' 0 N--CA 1.457 -0.096 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.308 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 6.2 m80 -86.92 -14.8 40.81 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.707 -0.663 . . . . 0.0 111.172 178.626 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -72.87 -43.53 62.45 Favored 'General case' 0 C--N 1.342 0.245 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 170.51 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.2 tp -65.61 -45.4 83.28 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.869 174.753 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.93 -42.37 98.22 Favored Glycine 0 C--N 1.336 0.534 0 N-CA-C 111.294 -0.723 . . . . 0.0 111.294 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 89.3 p -67.18 -35.55 79.88 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 117.623 0.712 . . . . 0.0 110.292 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 33.7 mt -60.65 -39.01 86.75 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 119.267 -0.973 . . . . 0.0 110.285 173.898 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -67.31 -35.72 80.01 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.476 1.035 . . . . 0.0 111.772 176.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.471 HD11 ' CD2' ' A' ' 17' ' ' PHE . 87.2 mt -69.03 -45.68 79.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 O-C-N 121.705 -0.622 . . . . 0.0 111.144 176.841 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 72.9 mt -63.24 -32.94 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 C-N-CA 123.619 0.768 . . . . 0.0 109.263 177.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -71.42 -40.43 70.46 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.188 0.595 . . . . 0.0 110.44 177.304 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.427 ' HB2' HG21 ' A' ' 33' ' ' THR . 98.6 p -69.45 -54.37 14.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 119.165 0.893 . . . . 0.0 110.523 -177.336 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 39.7 mt -65.07 -33.83 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 117.76 0.255 . . . . 0.0 110.555 176.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.57 -53.01 38.01 Favored Glycine 0 C--N 1.337 0.626 0 N-CA-C 111.909 -0.476 . . . . 0.0 111.909 -179.346 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.3 mtp-105 -66.49 -36.13 81.98 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 117.308 0.554 . . . . 0.0 110.445 178.397 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.469 ' HB1' HD21 ' A' ' 37' ' ' LEU . . . -65.45 -45.95 81.79 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 178.549 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.8 m-30 -62.94 -44.87 94.89 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 175.558 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.1 tp -55.96 -44.89 78.92 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 -177.361 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -69.64 -39.98 76.8 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.806 178.315 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -70.26 -15.02 62.85 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -178.134 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.6 t -107.48 -19.09 13.68 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.876 0.762 . . . . 0.0 111.928 173.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 . . . . . 0 C--N 1.34 0.193 0 C-N-CA 123.026 0.53 . . . . 0.0 111.697 177.72 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.542 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.262 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.8 p -50.49 -29.49 10.59 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -176.064 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.22 -45.73 86.95 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.851 0.75 . . . . 0.0 109.872 175.799 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 27.8 m80 -68.4 -28.6 67.24 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.311 177.509 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.443 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -65.25 -46.26 81.26 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 178.187 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 95.0 mt -63.32 -42.73 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.077 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 175.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -61.81 -33.0 73.35 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 122.359 -0.213 . . . . 0.0 111.261 179.115 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.8 m -74.35 -41.09 61.63 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.552 -0.261 . . . . 0.0 110.96 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 45.5 mt -60.87 -31.05 70.52 Favored 'General case' 0 C--O 1.226 -0.158 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 173.357 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.8 -14.4 9.89 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-O 119.021 -0.877 . . . . 0.0 113.813 178.342 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -103.41 -4.93 23.44 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.177 1.488 . . . . 0.0 112.371 -179.637 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.481 HG21 HD13 ' A' ' 51' ' ' ILE . 32.4 m -123.18 -18.18 4.43 Favored 'Isoleucine or valine' 0 C--N 1.339 0.141 0 C-N-CA 122.824 0.45 . . . . 0.0 111.964 -179.168 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.8 tp -50.94 -25.2 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 C-N-CA 123.984 0.913 . . . . 0.0 112.601 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -64.86 -49.15 71.67 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 118.079 0.399 . . . . 0.0 111.52 178.419 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -69.6 -39.85 77.0 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 -177.611 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 10.7 mp -66.33 -50.91 61.98 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.189 -176.156 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 65.8 mt -63.99 -60.75 2.87 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 118.767 -0.635 . . . . 0.0 109.78 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 89.4 p -54.88 -41.91 71.45 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 118.622 -1.231 . . . . 0.0 112.318 -172.388 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -69.79 -40.68 75.86 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-N 119.413 1.006 . . . . 0.0 111.385 178.217 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.34 -42.62 96.06 Favored 'General case' 0 N--CA 1.457 -0.102 0 CA-C-N 118.531 0.605 . . . . 0.0 110.618 -179.217 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -38.57 53.53 Favored 'Isoleucine or valine' 0 C--N 1.338 0.093 0 C-N-CA 120.003 -0.679 . . . . 0.0 111.636 178.58 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.99 -25.36 66.27 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 119.607 -0.837 . . . . 0.0 110.094 178.45 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.446 ' HE3' ' HB3' ' A' ' 59' ' ' ASP . 7.8 tmtt? -75.32 -23.12 57.25 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 125.018 1.327 . . . . 0.0 111.144 175.401 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.401 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 55.7 p -86.14 159.68 19.46 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -170.151 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.7 p30 -102.33 -175.02 2.71 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 170.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -55.75 -39.01 70.57 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.996 0.816 . . . . 0.0 112.445 -177.228 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -70.73 -46.4 63.1 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 121.54 -0.725 . . . . 0.0 110.45 -178.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.401 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 35.9 m170 -72.37 -32.49 66.48 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 119.106 -0.474 . . . . 0.0 111.257 -178.085 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -37.65 82.79 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 176.157 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -62.67 -41.94 99.35 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 110.248 -0.279 . . . . 0.0 110.248 177.122 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -61.79 -41.5 97.81 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 117.827 0.285 . . . . 0.0 111.072 176.222 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.5 mt -69.51 -39.02 78.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 CA-C-N 118.004 0.366 . . . . 0.0 110.196 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 37.9 ttt180 -63.86 -40.74 97.27 Favored 'General case' 0 C--O 1.23 0.068 0 C-N-CA 122.56 0.344 . . . . 0.0 110.47 178.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 16.0 tmm? -68.01 -41.97 81.38 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 122.701 0.4 . . . . 0.0 110.253 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.1 tt -60.34 -43.62 96.27 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 176.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 86.2 mt -70.8 -30.27 66.68 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 119.524 -0.274 . . . . 0.0 111.468 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.6 t70 . . . . . 0 N--CA 1.452 -0.342 0 CA-C-N 118.334 0.515 . . . . 0.0 109.96 177.007 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 160' ' ' PRO . . . . . 0.417 ' HD2' ' N ' ' A' ' 27' ' ' SER . 58.6 Cg_endo . . . . . 0 N--CA 1.456 -0.687 0 N-CA-C 110.452 -0.634 . . . . 0.0 110.452 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 161' ' ' SER . . . . . 0.406 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 36.8 t -171.55 141.13 1.46 Allowed 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.695 1.198 . . . . 0.0 108.415 174.718 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -156.54 133.31 10.26 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 118.362 0.528 . . . . 0.0 112.12 174.117 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 25.8 t -134.67 144.63 51.53 Favored Pre-proline 0 N--CA 1.454 -0.228 0 C-N-CA 123.765 0.826 . . . . 0.0 110.76 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -66.65 -1.62 6.12 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.257 2.638 . . . . 0.0 111.638 177.504 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 34.9 p . . . . . 0 C--N 1.338 0.093 0 O-C-N 121.845 -0.534 . . . . 0.0 112.042 177.804 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 32.8 t70 . . . . . 0 CA--C 1.531 0.232 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -57.11 -17.81 12.21 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.109 0.413 . . . . 0.0 111.196 176.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.4 tp60 -56.61 -45.31 81.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.218 -0.42 . . . . 0.0 110.31 175.657 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -57.51 -39.98 77.71 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.306 176.527 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -64.35 -54.04 39.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.888 0.767 . . . . 0.0 110.766 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 59.4 t -63.5 -50.44 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.179 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 -178.295 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.72 -32.26 69.03 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 123.268 0.627 . . . . 0.0 111.432 -179.019 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 52.3 m -72.27 -43.91 63.6 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 122.025 -0.422 . . . . 0.0 110.145 176.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 21.0 tp -64.73 -29.33 70.31 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 120.426 -0.51 . . . . 0.0 109.999 179.279 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -70.44 -41.81 72.35 Favored 'General case' 0 C--N 1.338 0.074 0 C-N-CA 123.667 0.787 . . . . 0.0 110.57 175.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.9 p -63.96 -29.0 70.2 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.067 174.624 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -33.41 63.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.316 0.647 . . . . 0.0 110.241 174.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt . . . . . 0 C--N 1.339 0.123 0 C-N-CA 123.384 0.674 . . . . 0.0 110.514 178.291 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.4 mm . . . . . 0 CA--C 1.533 0.306 0 CA-C-O 120.8 0.333 . . . . 0.0 110.699 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.0 t -59.5 137.73 57.92 Favored 'General case' 0 C--O 1.23 0.073 0 CA-C-O 120.968 0.413 . . . . 0.0 111.719 -175.638 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.95 -23.1 67.3 Favored Glycine 0 CA--C 1.526 0.721 0 CA-C-O 119.27 -0.739 . . . . 0.0 113.715 -173.582 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.465 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 38.5 t -59.01 -40.82 86.12 Favored 'General case' 0 N--CA 1.458 -0.065 0 CA-C-N 118.658 1.229 . . . . 0.0 110.633 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -69.45 -39.05 78.01 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -178.005 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 69.4 mt -65.61 -36.19 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -69.17 -36.06 76.97 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 119.459 -0.305 . . . . 0.0 111.369 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.465 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -65.85 -44.48 85.37 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 118.332 0.514 . . . . 0.0 110.342 174.626 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.7 mt -62.56 -52.33 63.86 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 122.291 -0.256 . . . . 0.0 110.957 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.431 HG21 ' HB2' ' A' ' 71' ' ' SER . 27.3 p -59.77 -50.72 72.7 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 118.413 0.552 . . . . 0.0 111.936 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.3 t -61.26 -45.13 95.76 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 120.092 -0.643 . . . . 0.0 111.623 -174.649 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -75.63 -21.46 57.7 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -178.398 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.06 -57.12 8.45 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 119.172 0.897 . . . . 0.0 109.031 167.699 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.3 mp -69.05 -14.75 63.21 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -177.005 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -64.94 -16.83 63.78 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.991 0.814 . . . . 0.0 113.065 178.59 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -140.4 -41.63 0.42 Allowed 'General case' 0 C--N 1.34 0.185 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -178.541 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.541 HG22 HG22 ' A' ' 93' ' ' THR . 44.8 mm 43.06 67.0 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-O 122.352 1.072 . . . . 0.0 111.07 -172.358 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -147.34 20.65 1.21 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 114.709 -1.132 . . . . 0.0 108.865 179.149 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.603 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.38 33.85 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 C-N-CA 125.157 1.383 . . . . 0.0 109.456 -171.471 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.519 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.3 OUTLIER -49.57 -55.64 12.77 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -177.131 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 83.6 p -75.38 -24.73 57.28 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -173.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.638 ' HD3' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -84.95 -42.72 14.68 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 -179.511 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 30.8 mt -56.21 -52.82 46.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 118.277 0.489 . . . . 0.0 109.752 171.344 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.439 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 15.4 mm -66.17 -48.94 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 CA-C-O 119.335 -0.364 . . . . 0.0 111.643 -177.22 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.0 t -56.53 -37.15 70.08 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 119.891 -0.724 . . . . 0.0 110.101 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.3 tp -70.55 -40.19 73.51 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 118.624 -0.703 . . . . 0.0 112.782 -177.501 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.8 pt -73.67 -37.52 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 119.775 1.17 . . . . 0.0 111.965 178.771 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.432 HD13 HG21 ' A' ' 104' ' ' VAL . 93.9 mt -63.4 -49.2 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.099 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.418 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -59.41 -41.43 89.48 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.855 177.587 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -55.73 -40.12 72.04 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 176.645 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.6 t -68.0 -53.63 24.53 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 179.375 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -68.63 -24.6 64.58 Favored 'General case' 0 C--O 1.228 -0.074 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -172.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 47.1 mt -80.56 -15.89 55.54 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 83.1 m -121.74 164.26 26.07 Favored Pre-proline 0 CA--C 1.536 0.426 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -169.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_exo -55.57 -177.83 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.407 1 C-N-CA 126.001 4.467 . . . . 0.0 116.072 -179.383 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -56.19 -40.44 73.97 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 125.611 1.565 . . . . 0.0 113.427 -176.291 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 74.9 m -61.5 -23.1 65.67 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 19.3 m80 -87.59 -23.63 24.24 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 118.906 -0.568 . . . . 0.0 110.928 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -67.18 -42.21 84.61 Favored 'General case' 0 C--N 1.343 0.321 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 169.633 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.7 tp -66.84 -51.99 48.92 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 120.915 0.388 . . . . 0.0 110.365 177.699 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.43 -39.65 90.91 Favored Glycine 0 C--N 1.336 0.574 0 N-CA-C 110.246 -1.142 . . . . 0.0 110.246 178.839 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 40.1 t -63.24 -45.65 90.6 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 117.483 0.641 . . . . 0.0 110.767 178.336 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 33.9 mt -57.93 -38.2 75.5 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 118.854 0.752 . . . . 0.0 111.403 178.146 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -74.45 -31.51 62.29 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 119.492 -0.883 . . . . 0.0 112.16 178.383 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 81.0 mt -73.47 -41.65 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 118.92 0.782 . . . . 0.0 110.669 176.398 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.8 mt -62.71 -40.06 87.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 176.401 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -66.8 -42.77 85.42 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 119.278 -0.391 . . . . 0.0 110.959 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.431 ' HB2' HG21 ' A' ' 33' ' ' THR . 84.1 p -66.93 -56.52 9.88 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 118.338 0.517 . . . . 0.0 111.148 -174.789 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 38.3 mt -65.19 -31.17 52.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 176.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.89 -52.92 37.64 Favored Glycine 0 CA--C 1.522 0.489 0 CA-C-O 119.751 -0.471 . . . . 0.0 112.191 -179.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.661 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -72.28 -31.1 65.44 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 117.992 0.896 . . . . 0.0 110.824 -179.242 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.74 -46.61 74.87 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 176.314 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -62.32 -45.23 94.15 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 175.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -57.34 -43.08 83.12 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -178.316 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -67.16 -41.17 86.45 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 121.38 -0.128 . . . . 0.0 110.902 178.584 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -64.58 -40.41 95.48 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 119.51 -0.281 . . . . 0.0 111.227 -178.184 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.3 t -82.78 -18.85 39.14 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 118.192 0.451 . . . . 0.0 111.496 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 56.6 ttp180 . . . . . 0 N--CA 1.455 -0.194 0 O-C-N 122.078 -0.389 . . . . 0.0 110.417 171.78 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.541 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.195 0 CA-C-O 119.718 -0.182 . . . . 0.0 110.528 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 26.7 p -47.91 -32.64 6.57 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 -176.204 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.76 -46.9 80.2 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.582 -0.699 . . . . 0.0 110.137 176.794 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 67.2 m80 -67.24 -28.78 68.33 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.299 0.639 . . . . 0.0 110.202 177.795 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.439 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -66.22 -45.45 80.64 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 122.434 0.294 . . . . 0.0 110.546 177.681 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 93.3 mt -62.89 -42.41 96.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 175.839 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -61.48 -33.69 74.2 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.779 -0.191 . . . . 0.0 111.389 178.871 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.3 m -73.21 -42.29 62.81 Favored 'General case' 0 C--O 1.227 -0.084 0 C-N-CA 122.332 0.253 . . . . 0.0 111.185 179.177 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 44.9 mt -60.85 -30.78 70.32 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 173.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.17 -14.65 19.22 Favored Glycine 0 CA--C 1.534 1.237 0 CA-C-O 118.826 -0.986 . . . . 0.0 113.81 178.095 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -100.59 -6.92 24.6 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 119.061 1.431 . . . . 0.0 111.805 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.432 HG21 HD13 ' A' ' 51' ' ' ILE . 35.3 m -121.15 -18.31 5.35 Favored 'Isoleucine or valine' 0 C--N 1.338 0.108 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.422 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.7 tp -53.69 -26.03 12.74 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 C-N-CA 122.92 0.488 . . . . 0.0 111.817 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.4 pt20 -59.49 -61.42 2.64 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 122.77 0.428 . . . . 0.0 110.614 176.199 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -71.13 -28.27 64.17 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.929 -0.482 . . . . 0.0 111.332 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.51 -55.67 25.25 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.38 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 59.9 mt -62.95 -58.14 8.36 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 118.44 -0.791 . . . . 0.0 110.428 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 91.1 p -55.27 -43.13 74.43 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 118.857 -1.137 . . . . 0.0 112.133 -172.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -70.69 -41.67 71.7 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 119.237 0.926 . . . . 0.0 111.077 177.687 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.17 -37.25 71.82 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 119.157 -0.449 . . . . 0.0 111.359 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -80.91 -35.31 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.101 0 C-N-CA 119.572 -0.851 . . . . 0.0 112.135 175.583 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.09 -25.4 65.31 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 119.813 -0.755 . . . . 0.0 111.125 -178.191 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.52 -14.3 38.08 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.293 0.637 . . . . 0.0 111.225 177.008 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.435 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 46.3 p -71.42 156.49 39.41 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -170.462 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 68.4 m-20 -96.36 177.89 5.55 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 106.908 -1.515 . . . . 0.0 106.908 168.564 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -56.26 -45.1 80.19 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.738 0.699 . . . . 0.0 111.149 -177.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -64.99 -41.13 95.68 Favored 'General case' 0 CA--C 1.53 0.173 0 O-C-N 121.974 -0.454 . . . . 0.0 110.481 -179.651 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.435 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 31.6 m170 -69.42 -37.35 77.41 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 119.295 -0.383 . . . . 0.0 110.882 -178.792 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -41.16 96.83 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 174.551 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -64.4 -39.54 94.06 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.568 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -64.21 -41.08 97.21 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 121.15 -0.22 . . . . 0.0 111.19 176.191 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.9 mt -69.8 -37.39 73.34 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.087 0 CA-C-N 118.281 0.492 . . . . 0.0 109.719 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 80.5 ttt-85 -64.8 -38.1 89.84 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 177.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 65.6 ttp -66.05 -40.76 91.23 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 55.1 tp -60.4 -44.62 95.51 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 110.53 -0.174 . . . . 0.0 110.53 178.503 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.9 mt -68.06 -35.59 78.47 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 122.094 0.158 . . . . 0.0 111.028 179.039 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.8 t70 . . . . . 0 N--CA 1.455 -0.199 0 N-CA-C 110.332 -0.248 . . . . 0.0 110.332 178.567 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo . . . . . 0 N--CA 1.454 -0.84 0 N-CA-C 109.806 -0.882 . . . . 0.0 109.806 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 47.5 m -68.01 155.18 40.07 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 174.368 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 162' ' ' TYR . . . . . 0.416 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 15.8 t80 -139.95 127.42 21.5 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 120.574 0.225 . . . . 0.0 110.938 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.9 t -124.17 124.54 25.88 Favored Pre-proline 0 C--O 1.234 0.276 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.543 177.316 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.18 -12.66 35.8 Favored 'Trans proline' 0 N--CA 1.449 -1.143 0 C-N-CA 122.386 2.057 . . . . 0.0 109.828 -179.371 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 22.5 m . . . . . 0 C--N 1.34 0.178 0 C-N-CA 123.536 0.735 . . . . 0.0 111.853 -174.914 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 . . . . . 0 CA--C 1.532 0.274 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -55.41 -15.42 2.62 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.179 0.592 . . . . 0.0 111.714 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 34.3 tp60 -55.27 -41.26 71.99 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.137 0.575 . . . . 0.0 110.362 176.369 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -63.96 -37.89 89.08 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 118.246 0.475 . . . . 0.0 110.615 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -64.72 -55.38 20.29 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.536 0.607 . . . . 0.0 109.899 179.19 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 66.5 t -60.72 -53.08 53.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -177.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.53 -35.73 70.66 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.118 0.567 . . . . 0.0 111.627 -178.228 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 77.5 m -69.12 -44.95 71.36 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-N 118.352 0.524 . . . . 0.0 110.452 177.281 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 20.7 tp -66.46 -29.16 69.23 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.487 -179.237 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.4 -45.16 66.52 Favored 'General case' 0 CA--C 1.523 -0.079 0 C-N-CA 123.787 0.835 . . . . 0.0 109.85 177.692 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 72.8 m -61.44 -29.35 69.89 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 173.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.86 -32.47 61.9 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 120.601 0.238 . . . . 0.0 110.623 175.494 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt . . . . . 0 N--CA 1.456 -0.126 0 C-N-CA 123.348 0.659 . . . . 0.0 110.57 179.531 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.6 mm . . . . . 0 C--O 1.231 0.108 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 42.9 t -138.98 121.67 16.37 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.266 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.72 -20.08 63.64 Favored Glycine 0 CA--C 1.523 0.562 0 CA-C-O 119.229 -0.762 . . . . 0.0 112.208 -176.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.445 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 47.7 t -65.42 -42.34 92.58 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 118.611 1.205 . . . . 0.0 109.853 177.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.4 mmp_? -60.42 -48.16 82.94 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 176.902 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.5 mt -63.15 -34.33 66.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.201 -177.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 23.0 mmtp -69.1 -39.67 78.85 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 118.83 -0.605 . . . . 0.0 110.777 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.445 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.3 OUTLIER -65.22 -42.58 93.29 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.359 0.982 . . . . 0.0 110.225 175.296 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.5 mt -62.45 -56.91 13.65 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 122.487 -0.133 . . . . 0.0 110.82 -178.872 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.555 HG21 ' HB2' ' A' ' 71' ' ' SER . 41.6 p -55.29 -42.97 74.34 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 121.986 -0.447 . . . . 0.0 111.593 176.469 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.9 m -55.37 -55.92 26.06 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 119.279 -0.391 . . . . 0.0 111.131 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -79.07 -18.54 53.24 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -173.006 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.26 -56.0 8.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 119.041 0.837 . . . . 0.0 109.15 167.356 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 50.0 mt -72.92 -14.58 61.5 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.913 0.885 . . . . 0.0 113.154 -174.875 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -55.37 -30.33 60.14 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -178.622 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -153.1 -20.78 0.15 Allowed 'General case' 0 C--N 1.341 0.214 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 -178.267 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.491 HG22 HG22 ' A' ' 93' ' ' THR . 35.0 mm 45.75 74.15 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-O 121.837 0.827 . . . . 0.0 111.173 -177.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -134.52 6.74 3.53 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.177 0.991 . . . . 0.0 109.835 178.299 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.491 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -142.5 108.64 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 124.888 1.275 . . . . 0.0 108.359 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.57 ' CD ' ' H ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -102.13 -82.77 0.47 Allowed 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -178.54 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.57 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 99.2 p -55.86 -24.48 37.09 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 123.504 0.722 . . . . 0.0 112.569 -174.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.641 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -70.86 -56.42 6.33 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 177.812 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.432 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 6.5 mt -57.52 -40.64 75.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 123.179 0.591 . . . . 0.0 110.556 175.495 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 14.8 mm -69.68 -51.71 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-O 119.275 -0.393 . . . . 0.0 111.481 -178.441 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.4 m -60.63 -27.13 67.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 118.821 0.737 . . . . 0.0 110.03 177.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.9 tp -70.39 -45.01 66.83 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 118.72 -0.657 . . . . 0.0 111.778 178.265 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 25.7 pt -74.91 -33.83 31.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 119.581 1.082 . . . . 0.0 111.437 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.41 HD13 HG21 ' A' ' 104' ' ' VAL . 96.2 mt -65.63 -52.19 53.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.772 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -65.18 -29.46 70.28 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.071 178.082 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -59.13 -42.54 90.87 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 173.349 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.6 m -58.33 -49.36 77.47 Favored 'General case' 0 C--N 1.338 0.093 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 174.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 52.5 tpt85 -56.15 -30.55 62.35 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.803 0.841 . . . . 0.0 112.486 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 80.3 mt -90.59 -14.59 32.15 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -179.065 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 50.7 m -97.05 159.01 32.38 Favored Pre-proline 0 CA--C 1.531 0.231 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -171.509 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -75.79 -139.54 0.02 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.707 1 C-N-CA 125.723 4.282 . . . . 0.0 109.063 172.581 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -56.12 -19.6 13.96 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.002 0.819 . . . . 0.0 112.125 178.713 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.8 m -59.46 -25.69 64.61 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.755 0.422 . . . . 0.0 109.961 173.833 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -55.28 -64.64 0.78 Allowed 'General case' 0 C--N 1.341 0.204 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 172.543 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.3 ttpt -50.44 -75.68 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.871 -179.305 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 33.0 tp -74.27 -43.14 58.14 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 119.102 -1.039 . . . . 0.0 111.639 -168.674 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.57 -48.32 44.28 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -174.18 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.9 m -70.66 -38.61 73.8 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 118.504 -1.278 . . . . 0.0 110.041 -178.304 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 66' ' ' LEU . 60.7 mt -58.26 -42.08 85.69 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 118.293 -1.363 . . . . 0.0 110.826 177.32 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -68.66 -40.03 80.38 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.324 0.966 . . . . 0.0 112.168 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 79.0 mt -66.89 -42.09 88.52 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-N 118.395 0.543 . . . . 0.0 111.15 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.2 mt -66.89 -29.94 47.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.537 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -76.75 -37.85 55.2 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-O 119.041 -0.504 . . . . 0.0 111.975 178.872 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.555 ' HB2' HG21 ' A' ' 33' ' ' THR . 61.2 p -70.78 -52.68 19.09 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 119.286 0.948 . . . . 0.0 110.324 178.297 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 53.1 mt -67.81 -36.21 75.05 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 178.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.9 -46.79 64.45 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 -178.679 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 28.2 mtt-85 -63.05 -43.51 98.44 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 117.623 0.711 . . . . 0.0 109.942 176.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.33 -40.54 93.82 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.769 -0.196 . . . . 0.0 110.694 -178.35 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -63.96 -45.62 88.3 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 175.584 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.8 tp -57.88 -41.62 82.91 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 -177.669 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -67.94 -41.36 82.66 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 117.725 0.238 . . . . 0.0 110.397 177.373 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -60.07 -39.72 87.02 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.877 -0.147 . . . . 0.0 111.074 -177.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 9.3 t -87.31 -20.34 26.94 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 117.995 0.362 . . . . 0.0 111.702 178.532 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 67.2 ttp85 . . . . . 0 CA--C 1.529 0.166 0 CA-C-N 118.371 0.532 . . . . 0.0 110.185 174.047 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.491 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.393 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 28.6 p -49.3 -30.31 7.25 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -175.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.4 -46.69 79.03 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 118.787 0.722 . . . . 0.0 110.073 177.147 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 43.0 t60 -69.52 -27.53 65.26 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 121.038 0.447 . . . . 0.0 110.21 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.09 -42.69 79.97 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.185 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.3 mt -64.77 -41.78 93.14 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.163 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 173.293 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -59.82 -33.3 71.57 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 110.782 -0.081 . . . . 0.0 110.782 178.502 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 88.6 m -75.57 -42.72 51.41 Favored 'General case' 0 N--CA 1.457 -0.075 0 CA-C-O 119.526 -0.273 . . . . 0.0 111.026 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 49.6 mt -60.54 -29.02 68.87 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 173.308 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.4 -15.38 31.28 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-O 119.154 -0.803 . . . . 0.0 113.563 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -98.28 -6.28 31.36 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.961 1.38 . . . . 0.0 111.684 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.41 HG21 HD13 ' A' ' 51' ' ' ILE . 31.1 m -123.71 -22.68 2.66 Favored 'Isoleucine or valine' 0 C--O 1.23 0.027 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -178.84 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.42 HD12 ' HA ' ' A' ' 105' ' ' ILE . 11.0 tp -55.87 -26.49 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 C-N-CA 122.935 0.494 . . . . 0.0 111.44 -177.237 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -61.93 -59.08 5.65 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.144 0.578 . . . . 0.0 111.198 178.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -73.75 -29.87 62.47 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 122.168 0.187 . . . . 0.0 110.766 -179.107 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.0 tt -63.03 -56.64 15.21 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.41 ' O ' HG13 ' A' ' 113' ' ' ILE . 49.5 mt -61.2 -57.98 10.2 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 118.695 -0.669 . . . . 0.0 110.261 176.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 55.9 p -54.84 -44.26 73.76 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 119.605 -0.838 . . . . 0.0 112.053 -172.067 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -69.04 -42.46 76.31 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-N 119.13 0.877 . . . . 0.0 110.794 177.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.28 -50.89 70.1 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.85 0.46 . . . . 0.0 111.603 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -69.94 -35.46 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 O-C-N 121.781 -0.575 . . . . 0.0 111.224 179.253 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.65 -24.6 64.56 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.05 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.62 -14.21 38.04 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.071 0.548 . . . . 0.0 110.827 178.387 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.436 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 29.5 p -79.46 157.4 27.51 Favored 'General case' 0 N--CA 1.457 -0.102 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 -171.274 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -90.16 173.42 8.18 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 172.163 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 85.2 mt-30 -55.56 -45.78 77.26 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.772 0.714 . . . . 0.0 111.679 -176.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -63.99 -39.03 93.21 Favored 'General case' 0 N--CA 1.454 -0.244 0 O-C-N 121.719 -0.613 . . . . 0.0 110.404 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.436 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 31.7 m170 -70.83 -45.43 64.56 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.125 -178.148 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -35.95 71.69 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-N 118.839 0.745 . . . . 0.0 109.984 174.542 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.31 -41.99 88.91 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.237 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.6 mtpp -61.57 -44.26 97.35 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.349 175.5 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 98.0 mt -65.28 -38.23 82.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 43.7 ttt85 -62.26 -39.34 92.57 Favored 'General case' 0 CA--C 1.521 -0.145 0 C-N-CA 122.693 0.397 . . . . 0.0 109.932 177.286 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 51.1 ttp -66.09 -44.03 85.56 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.547 -0.168 . . . . 0.0 110.547 178.625 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.3 mp -57.83 -46.34 84.86 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 177.581 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.9 mt -73.66 -32.7 64.13 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -177.052 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.0 t70 . . . . . 0 N--CA 1.455 -0.195 0 CA-C-N 118.673 0.67 . . . . 0.0 110.029 179.028 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo . . . . . 0 N--CA 1.458 -0.59 0 CA-C-O 120.797 0.249 . . . . 0.0 112.233 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 13.0 t -107.26 173.79 6.17 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.876 0.87 . . . . 0.0 111.713 -178.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -131.92 143.06 49.86 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 124.577 1.151 . . . . 0.0 109.265 176.037 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 26.7 t -121.25 137.07 26.32 Favored Pre-proline 0 N--CA 1.451 -0.386 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 176.728 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -66.47 -9.74 25.21 Favored 'Trans proline' 0 N--CA 1.447 -1.253 0 C-N-CA 122.912 2.408 . . . . 0.0 111.205 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 71.7 p . . . . . 0 C--N 1.34 0.166 0 CA-C-O 118.801 -0.619 . . . . 0.0 111.76 -178.251 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 . . . . . 0 N--CA 1.453 -0.311 0 N-CA-C 110.536 -0.172 . . . . 0.0 110.536 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -54.16 -14.49 1.13 Allowed 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.477 0.711 . . . . 0.0 110.58 175.402 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -54.7 -36.29 64.52 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 123.041 0.537 . . . . 0.0 110.352 174.315 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -56.76 -48.56 77.57 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-N 119.138 0.881 . . . . 0.0 109.812 176.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -65.3 -50.32 66.15 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 120.408 0.147 . . . . 0.0 111.2 -177.023 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 62.1 t -64.56 -53.08 46.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 O-C-N 122.368 -0.208 . . . . 0.0 110.488 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.65 -31.54 70.76 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 119.588 -0.244 . . . . 0.0 111.441 -178.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 53.3 m -71.46 -40.97 69.96 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.487 177.123 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.9 tp -66.37 -33.38 75.59 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.629 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -67.4 -42.62 83.0 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.894 0.878 . . . . 0.0 110.079 175.271 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 66.3 m -63.8 -27.47 69.21 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 174.206 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.425 ' CE2' HD11 ' A' ' 68' ' ' ILE . 0.1 OUTLIER -68.99 -39.59 79.26 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 175.199 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt . . . . . 0 C--N 1.341 0.227 0 C-N-CA 122.614 0.366 . . . . 0.0 111.02 175.144 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 17.1 mm . . . . . 0 CA--C 1.53 0.198 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.3 t -145.1 137.78 26.19 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 118.099 0.409 . . . . 0.0 111.067 -178.646 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -61.89 -37.97 95.24 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-O 119.267 -0.74 . . . . 0.0 112.793 -176.178 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.427 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 35.6 t -56.2 -44.06 79.08 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 118.438 1.119 . . . . 0.0 111.419 -173.417 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? -69.42 -44.85 70.55 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 -178.714 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 91.1 mt -58.52 -38.49 70.84 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.199 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.2 mmtp -73.39 -35.65 65.91 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-O 118.605 -0.712 . . . . 0.0 111.849 -178.467 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.427 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.1 OUTLIER -65.18 -38.47 90.61 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-N 119.516 1.053 . . . . 0.0 110.095 174.646 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.0 mt -64.06 -55.7 20.3 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 119.386 -0.34 . . . . 0.0 110.802 178.786 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.409 HG21 ' HB2' ' A' ' 71' ' ' SER . 41.3 p -58.01 -42.42 85.18 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 118.622 0.646 . . . . 0.0 111.066 177.765 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.3 m -55.65 -58.14 9.05 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 119.101 -0.476 . . . . 0.0 111.057 -179.071 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -69.12 -31.64 70.47 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 118.74 -1.184 . . . . 0.0 111.367 -175.432 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.54 -59.81 4.78 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.994 177.359 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.487 HD21 ' HB1' ' A' ' 75' ' ' ALA . 6.8 mp -68.93 -23.24 64.14 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 122.268 0.227 . . . . 0.0 111.525 -177.577 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -72.38 -18.77 61.71 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 122.205 -0.309 . . . . 0.0 111.26 176.023 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -148.6 52.53 0.99 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 117.758 0.254 . . . . 0.0 111.648 -175.142 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.508 HG22 HG22 ' A' ' 93' ' ' THR . 35.8 mm -62.84 80.96 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 121.494 0.664 . . . . 0.0 110.425 172.075 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -153.28 20.21 0.56 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.421 1.489 . . . . 0.0 108.541 175.773 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.579 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -148.94 34.89 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 C-N-CA 125.343 1.457 . . . . 0.0 109.114 -171.284 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.5 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -49.28 -55.28 13.22 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -176.408 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 86.6 p -75.97 -24.27 55.4 Favored 'General case' 0 CA--C 1.522 -0.106 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -173.621 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.644 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -86.0 -39.16 17.15 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 119.286 -0.388 . . . . 0.0 110.108 -179.686 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 24.3 mt -59.11 -51.65 70.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.096 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 170.684 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.436 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 11.5 mm -65.55 -47.26 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-O 119.281 -0.39 . . . . 0.0 111.187 -178.122 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 48.3 t -55.82 -38.29 69.82 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.232 176.88 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.6 tp -68.54 -43.6 76.34 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 118.954 -0.546 . . . . 0.0 112.458 -177.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 38.5 pt -73.09 -37.31 52.77 Favored 'Isoleucine or valine' 0 C--N 1.343 0.286 0 CA-C-N 119.495 1.043 . . . . 0.0 111.993 -179.105 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.0 mt -64.26 -50.42 76.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.469 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 38.9 t70 -63.72 -31.05 72.1 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.451 178.791 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -58.98 -45.19 91.18 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 173.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.9 t -67.94 -31.3 70.94 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 111.656 0.243 . . . . 0.0 111.656 177.824 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.469 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 53.0 tpt85 -71.12 -36.29 72.08 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.911 0.884 . . . . 0.0 112.716 -177.708 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 78.5 mt -93.77 -14.71 25.93 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 -176.072 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 92.1 m -104.73 155.85 36.85 Favored Pre-proline 0 C--N 1.331 -0.206 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -171.725 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -66.11 -176.69 0.66 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 1 C-N-CA 125.349 4.033 . . . . 0.0 114.004 -178.825 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.405 ' HB3' ' HE3' ' A' ' 115' ' ' LYS . 53.0 m-20 -56.44 -44.44 80.45 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 125.654 1.582 . . . . 0.0 114.367 -172.289 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.4 p -57.45 -30.27 64.88 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 178.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -86.94 -13.4 44.79 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-O 118.472 -0.775 . . . . 0.0 111.62 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -74.19 -37.5 63.91 Favored 'General case' 0 C--N 1.342 0.252 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 169.31 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.3 mt -65.07 -51.77 59.52 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.145 173.241 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.38 -39.28 90.21 Favored Glycine 0 C--N 1.337 0.635 0 N-CA-C 110.323 -1.111 . . . . 0.0 110.323 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.5 t -55.71 -59.21 5.18 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 176.421 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 32.5 mt -49.39 -43.47 44.33 Favored 'General case' 0 C--O 1.228 -0.054 0 CA-C-O 118.837 -0.601 . . . . 0.0 111.625 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -66.96 -34.11 77.06 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 119.24 -0.984 . . . . 0.0 111.471 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.425 HD11 ' CE2' ' A' ' 17' ' ' PHE . 69.3 mt -72.13 -48.63 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 O-C-N 122.003 -0.436 . . . . 0.0 111.19 178.069 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 1.8 mp -59.46 -37.18 68.56 Favored 'Isoleucine or valine' 0 C--N 1.339 0.119 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -71.33 -39.42 71.37 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 119.414 -0.327 . . . . 0.0 111.285 -177.482 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.447 ' HB3' ' CE2' ' B' ' 162' ' ' TYR . 89.9 p -69.34 -52.96 22.2 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.527 0.603 . . . . 0.0 111.012 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 35.1 mt -66.47 -36.31 77.0 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 CA-C-N 118.166 0.439 . . . . 0.0 110.205 179.286 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.91 -44.6 91.49 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.651 -0.579 . . . . 0.0 111.651 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 32.6 ttm105 -67.39 -40.12 85.63 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 117.107 0.453 . . . . 0.0 110.528 178.078 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.487 ' HB1' HD21 ' A' ' 37' ' ' LEU . . . -68.78 -41.29 78.99 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.43 -179.018 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -64.15 -49.2 73.04 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 175.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.45 -46.51 83.54 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -62.49 -44.68 95.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 122.439 -0.163 . . . . 0.0 110.797 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -64.89 -40.1 94.57 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -176.175 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.7 t -84.61 -20.15 31.86 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -177.601 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 25.9 mmm180 . . . . . 0 C--N 1.339 0.151 0 CA-C-N 118.775 0.716 . . . . 0.0 111.651 174.483 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.508 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.267 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 28.4 p -47.81 -31.55 5.08 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -177.24 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.43 -44.23 91.84 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.272 -0.892 . . . . 0.0 110.244 176.681 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -72.26 -25.58 61.67 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 122.612 0.365 . . . . 0.0 110.225 177.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.436 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -65.24 -45.36 84.94 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.026 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.14 -43.13 98.71 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.28 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -60.57 -33.51 72.81 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.803 -0.181 . . . . 0.0 111.344 178.56 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.4 m -74.76 -40.75 61.02 Favored 'General case' 0 C--N 1.338 0.072 0 CA-C-O 119.686 -0.197 . . . . 0.0 110.974 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 48.7 mt -61.94 -29.45 70.24 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 173.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.76 -14.54 16.01 Favored Glycine 0 CA--C 1.53 1.027 0 CA-C-O 118.911 -0.939 . . . . 0.0 113.829 178.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -102.2 -6.6 23.0 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.085 1.442 . . . . 0.0 112.002 -179.666 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 35.4 m -121.29 -16.78 6.13 Favored 'Isoleucine or valine' 0 C--N 1.338 0.079 0 C-N-CA 122.917 0.487 . . . . 0.0 111.904 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.6 tp -52.79 -27.34 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 C-N-CA 123.039 0.536 . . . . 0.0 111.642 179.262 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -60.6 -58.45 8.44 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 122.598 0.359 . . . . 0.0 110.965 178.797 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -74.53 -29.36 61.35 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 122.403 0.281 . . . . 0.0 111.092 -177.685 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 49.2 tp -63.92 -54.87 27.82 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 179.521 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.451 ' O ' HG13 ' A' ' 113' ' ' ILE . 87.0 mt -63.0 -63.86 1.08 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.51 -0.757 . . . . 0.0 109.156 176.959 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 87.5 p -40.49 -49.48 2.9 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -177.633 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -73.6 -38.74 65.02 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 119.821 1.191 . . . . 0.0 112.109 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.52 -48.14 82.8 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.802 0.728 . . . . 0.0 110.706 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.2 OUTLIER -76.01 -34.62 27.39 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 117.963 0.347 . . . . 0.0 111.774 -179.69 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.72 -27.51 67.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 119.585 -0.846 . . . . 0.0 109.81 179.204 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.405 ' HE3' ' HB3' ' A' ' 59' ' ' ASP . 3.3 tmtt? -78.43 -26.94 46.44 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.308 0.643 . . . . 0.0 110.986 175.679 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.436 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 53.6 p -69.05 153.17 44.23 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -168.217 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -89.58 175.76 7.15 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 125.045 1.338 . . . . 0.0 108.439 172.5 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -55.84 -41.96 75.07 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 119.253 0.933 . . . . 0.0 111.838 -178.545 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -69.25 -38.89 78.66 Favored 'General case' 0 C--O 1.232 0.173 0 O-C-N 121.666 -0.646 . . . . 0.0 110.479 179.711 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.436 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 46.9 m170 -72.19 -39.19 68.79 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 119.397 -0.335 . . . . 0.0 111.188 -178.314 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.84 -36.41 83.4 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 176.474 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -62.09 -44.46 96.62 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.43 177.749 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -63.15 -43.89 97.06 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 117.545 0.157 . . . . 0.0 111.394 177.727 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.6 mt -68.03 -38.69 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-N 117.781 0.264 . . . . 0.0 110.546 -179.293 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -68.68 -33.97 74.88 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.3 0.24 . . . . 0.0 110.504 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 64.1 ttp -68.31 -43.87 76.68 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 176.483 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.41 HD23 ' C ' ' A' ' 127' ' ' LEU . 7.6 tt -57.8 -47.46 82.52 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 178.115 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.4 mt -71.9 -31.23 66.2 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 111.76 0.281 . . . . 0.0 111.76 -179.257 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 30.6 t70 . . . . . 0 N--CA 1.456 -0.132 0 CA-C-N 118.29 0.496 . . . . 0.0 109.787 177.65 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo . . . . . 0 N--CA 1.454 -0.824 0 N-CA-C 111.357 -0.286 . . . . 0.0 111.357 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 38.8 t -177.97 152.08 0.72 Allowed 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.046 0.938 . . . . 0.0 109.351 176.634 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 162' ' ' TYR . . . . . 0.447 ' CE2' ' HB3' ' A' ' 71' ' ' SER . 44.5 t80 -152.25 125.86 8.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.732 0.301 . . . . 0.0 110.933 169.516 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 9.3 t -131.93 148.77 71.18 Favored Pre-proline 0 N--CA 1.453 -0.32 0 C-N-CA 124.607 1.163 . . . . 0.0 109.558 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_exo -58.22 -1.46 0.65 Allowed 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 123.607 2.871 . . . . 0.0 112.954 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 28.0 m . . . . . 0 N--CA 1.456 -0.159 0 O-C-N 122.226 -0.297 . . . . 0.0 111.139 -179.136 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.476 0.836 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 54.0 mm-40 -131.3 178.5 6.67 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.484 0.713 . . . . 0.0 109.848 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -68.12 -6.5 23.36 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.633 0.373 . . . . 0.0 111.32 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -88.57 -3.37 58.82 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.503 0.721 . . . . 0.0 111.035 178.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -109.08 23.22 14.85 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.685 0.794 . . . . 0.0 111.435 -178.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -72.95 -157.15 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.521 0.728 . . . . 0.0 109.907 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -55.21 -14.19 1.61 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.167 0.587 . . . . 0.0 110.876 178.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -52.89 -37.09 60.13 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 124.396 1.078 . . . . 0.0 111.214 175.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -65.18 -43.88 90.27 Favored 'General case' 0 N--CA 1.457 -0.101 0 CA-C-N 119.328 0.967 . . . . 0.0 110.342 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -65.65 -50.52 64.68 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -177.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 99.7 t -63.13 -54.52 32.32 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -178.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.51 -33.62 70.03 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 119.437 -0.316 . . . . 0.0 111.654 -178.005 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 67.1 m -70.65 -43.98 68.04 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 118.62 0.646 . . . . 0.0 110.495 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.3 tp -65.59 -33.99 77.19 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.208 0.528 . . . . 0.0 110.064 -179.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -66.62 -45.72 78.16 Favored 'General case' 0 CA--C 1.522 -0.101 0 C-N-CA 124.164 0.985 . . . . 0.0 110.063 177.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 74.2 m -65.43 -26.36 67.93 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 110.371 -0.233 . . . . 0.0 110.371 176.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -68.03 -45.06 75.02 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 174.694 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -66.44 -32.79 74.39 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.768 0.827 . . . . 0.0 111.659 177.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -69.07 -14.38 62.98 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.206 0.602 . . . . 0.0 112.614 -177.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.3 mt -115.62 163.55 15.62 Favored 'General case' 0 N--CA 1.457 -0.087 0 CA-C-O 121.066 0.46 . . . . 0.0 111.571 -175.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -128.73 144.79 51.25 Favored 'General case' 0 C--N 1.337 0.064 0 C-N-CA 123.781 0.833 . . . . 0.0 109.804 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.7 t 59.33 154.88 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.214 1.405 . . . . 0.0 113.117 -175.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.17 131.9 0.4 Allowed Glycine 0 CA--C 1.527 0.836 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 -178.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 18.7 mm -116.26 56.62 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.5 m -51.7 132.06 30.67 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.354 0.661 . . . . 0.0 112.049 -174.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -70.04 -16.0 72.41 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-O 118.909 -0.939 . . . . 0.0 113.366 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.422 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 41.2 t -65.93 -42.79 89.63 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-N 118.974 1.387 . . . . 0.0 110.625 -177.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -68.04 -37.46 81.36 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 62.8 mt -63.59 -41.71 93.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -58.39 -43.28 88.46 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 118.561 -0.733 . . . . 0.0 111.967 176.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.401 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -65.62 -43.54 89.23 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 119.735 1.152 . . . . 0.0 111.102 178.459 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.3 mt -61.44 -57.08 13.65 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.612 0.244 . . . . 0.0 110.413 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 43.3 p -56.69 -41.17 76.9 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.474 0.31 . . . . 0.0 111.748 177.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.9 m -56.02 -56.23 23.29 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 119.143 -0.456 . . . . 0.0 110.698 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -67.27 -33.64 75.75 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 118.971 -1.091 . . . . 0.0 111.548 -175.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.52 -59.76 4.89 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 118.225 0.466 . . . . 0.0 110.817 174.146 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 53.9 mt -71.62 -14.66 62.13 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.181 0.992 . . . . 0.0 112.889 -173.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -55.82 -34.85 65.75 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -178.33 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -153.11 -17.9 0.15 Allowed 'General case' 0 C--N 1.34 0.155 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -177.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 31.3 mm 47.75 75.91 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-O 121.829 0.823 . . . . 0.0 111.417 -178.094 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -132.09 8.19 4.37 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.911 0.884 . . . . 0.0 109.83 177.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.548 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.8 pt -144.54 123.72 6.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 C-N-CA 125.301 1.44 . . . . 0.0 108.145 -178.73 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.22 -66.72 1.04 Allowed 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 179.328 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 50.8 m -66.85 -22.47 65.99 Favored 'General case' 0 N--CA 1.46 0.051 0 C-N-CA 122.714 0.406 . . . . 0.0 111.844 -174.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.618 ' HD2' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -75.17 -52.99 9.59 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 123.996 0.918 . . . . 0.0 109.203 179.012 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.435 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 10.8 mt -58.95 -45.81 91.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 C-N-CA 123.041 0.536 . . . . 0.0 110.025 175.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.419 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 12.3 mm -69.59 -46.28 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-O 119.298 -0.382 . . . . 0.0 111.517 -177.046 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 40.4 t -58.68 -36.59 74.44 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 118.712 0.687 . . . . 0.0 109.697 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.9 tp -67.87 -45.01 75.74 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 118.754 -0.641 . . . . 0.0 112.282 -178.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 28.5 pt -73.41 -37.07 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-N 119.608 1.095 . . . . 0.0 111.893 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.444 HD13 HG21 ' A' ' 104' ' ' VAL . 97.4 mt -63.25 -52.65 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -66.91 -25.63 66.47 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.516 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -61.49 -43.68 98.44 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 173.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.3 t -64.51 -42.78 95.59 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 120.747 0.308 . . . . 0.0 110.346 175.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.64 -48.91 76.51 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 124.809 1.244 . . . . 0.0 112.536 -176.042 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 78.4 mt -81.89 -14.59 55.98 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -174.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 78.9 m -108.91 156.17 39.51 Favored Pre-proline 0 CA--C 1.535 0.375 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -169.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_exo -55.77 -179.87 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.351 1 C-N-CA 126.069 4.513 . . . . 0.0 115.409 176.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -55.46 -43.65 75.67 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.574 1.55 . . . . 0.0 114.036 -174.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.9 p -58.7 -28.44 65.79 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 31.8 m80 -92.02 -14.93 28.6 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 118.861 -0.59 . . . . 0.0 111.208 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.403 ' HB2' ' HE2' ' A' ' 115' ' ' LYS . 35.5 mmtp -69.15 -47.47 64.95 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 169.341 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.1 tp -66.14 -45.41 81.11 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.383 177.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.94 -43.65 96.65 Favored Glycine 0 C--N 1.336 0.556 0 N-CA-C 111.124 -0.79 . . . . 0.0 111.124 178.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.7 t -67.0 -37.72 84.72 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 117.579 0.689 . . . . 0.0 110.608 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 28.5 mt -57.89 -39.58 78.21 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.317 0.962 . . . . 0.0 110.579 174.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -71.57 -32.03 67.63 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.251 0.932 . . . . 0.0 111.835 178.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 83.7 mt -70.96 -47.02 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 O-C-N 121.609 -0.682 . . . . 0.0 110.18 176.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 79.7 mt -61.02 -36.05 69.64 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 C-N-CA 124.208 1.003 . . . . 0.0 109.156 176.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -62.9 -50.05 72.39 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 123.729 0.812 . . . . 0.0 110.656 176.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.5 t -70.47 -49.07 52.37 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 118.887 -1.125 . . . . 0.0 111.952 -175.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 46.2 mt -65.33 -37.55 80.4 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.8 -48.97 58.28 Favored Glycine 0 CA--C 1.523 0.583 0 CA-C-O 119.596 -0.558 . . . . 0.0 112.309 -178.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.413 HH22 ' C ' ' B' ' 166' ' ' SEP . 6.5 mtp-105 -66.12 -38.53 88.43 Favored 'General case' 0 CA--C 1.522 -0.106 0 CA-C-N 117.845 0.823 . . . . 0.0 110.92 178.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.74 -42.57 81.62 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 121.091 -0.243 . . . . 0.0 110.47 178.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.0 m-30 -61.39 -47.52 85.42 Favored 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 175.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.0 tp -59.09 -44.94 91.97 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.743 0.417 . . . . 0.0 110.813 -176.136 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -67.62 -41.65 83.63 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.631 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 59.2 tt0 -65.95 -38.96 89.94 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.502 -176.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.3 t -82.93 -23.17 33.61 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 117.928 0.331 . . . . 0.0 111.303 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 28.9 ttp180 -68.42 -32.76 73.04 Favored 'General case' 0 N--CA 1.463 0.177 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 172.204 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 28.8 t -70.97 -14.47 62.37 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.118 0.567 . . . . 0.0 111.444 176.065 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -103.61 170.91 7.66 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.748 0.819 . . . . 0.0 109.947 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 39.2 t -145.97 157.63 43.88 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 122.724 0.41 . . . . 0.0 110.749 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -73.96 -7.74 53.52 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.039 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 83.4 p -92.45 1.46 57.23 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.035 0.534 . . . . 0.0 111.09 176.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 40.7 m -136.39 14.53 3.23 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 123.567 0.747 . . . . 0.0 111.034 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.0 t -145.36 159.24 43.35 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 123.157 0.583 . . . . 0.0 110.337 -178.33 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 48.3 m-80 -142.05 165.77 26.54 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.745 0.818 . . . . 0.0 109.61 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.409 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 28.9 tptp 54.85 101.58 0.04 OUTLIER Pre-proline 0 CA--C 1.534 0.347 0 C-N-CA 125.285 1.434 . . . . 0.0 111.934 -177.143 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 90' ' ' LYS . 58.4 Cg_endo -64.6 153.12 79.03 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 122.843 2.362 . . . . 0.0 111.111 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 142.9 -147.05 18.35 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -175.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 53.86 -161.8 0.12 Allowed 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 175.043 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.9 p -50.95 -30.01 13.76 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.088 0.955 . . . . 0.0 113.416 -175.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.98 -46.83 89.14 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 118.753 0.706 . . . . 0.0 109.579 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -74.72 -23.09 58.52 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.987 178.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.419 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -64.29 -45.59 87.33 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 175.356 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.77 -42.25 91.99 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -59.35 -34.97 73.03 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 121.303 -0.159 . . . . 0.0 110.969 178.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.3 m -76.61 -40.77 48.36 Favored 'General case' 0 C--O 1.227 -0.098 0 O-C-N 122.288 -0.258 . . . . 0.0 111.244 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.8 mt -61.41 -29.49 69.97 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 174.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.47 -14.58 28.25 Favored Glycine 0 CA--C 1.529 0.95 0 CA-C-O 119.016 -0.88 . . . . 0.0 113.816 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -100.51 -6.79 24.94 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 118.776 1.288 . . . . 0.0 111.689 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.444 HG21 HD13 ' A' ' 51' ' ' ILE . 27.3 m -123.72 -18.28 4.13 Favored 'Isoleucine or valine' 0 C--N 1.339 0.134 0 N-CA-C 112.5 0.555 . . . . 0.0 112.5 -178.125 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -54.53 -28.08 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 118.48 0.582 . . . . 0.0 111.548 -177.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -62.29 -51.79 66.29 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.778 0.431 . . . . 0.0 111.215 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -77.94 -28.49 49.62 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 122.093 -0.379 . . . . 0.0 111.008 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.0 mt -65.25 -49.78 68.32 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 178.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 69.2 mt -65.56 -60.14 3.24 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 118.5 -0.762 . . . . 0.0 110.31 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.9 p -53.67 -40.37 65.87 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 119.011 -1.076 . . . . 0.0 112.199 -173.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -72.67 -45.0 61.11 Favored 'General case' 0 C--N 1.342 0.24 0 CA-C-N 119.44 1.018 . . . . 0.0 111.095 178.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.409 ' O ' ' HE3' ' A' ' 115' ' ' LYS . . . -55.96 -33.98 65.26 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.148 0.579 . . . . 0.0 111.635 177.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.564 HG21 ' HB2' ' A' ' 151' ' ' ALA . 0.0 OUTLIER -79.2 -41.97 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 CA-C-N 119.345 0.975 . . . . 0.0 112.019 173.955 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.54 -27.08 66.66 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.001 0.364 . . . . 0.0 111.746 -177.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.409 ' HE3' ' O ' ' A' ' 112' ' ' ALA . 0.1 OUTLIER -81.33 -18.41 45.8 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.647 0.779 . . . . 0.0 110.653 177.933 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.2 m -80.44 164.63 22.91 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -173.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -101.4 -179.41 4.02 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 169.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 15.9 tp60 -51.33 -39.92 58.01 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.639 0.654 . . . . 0.0 111.592 -178.352 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -69.08 -54.56 14.38 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -177.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -64.87 -35.87 82.52 Favored 'General case' 0 C--N 1.339 0.131 0 O-C-N 122.2 -0.312 . . . . 0.0 110.4 -178.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 11.9 ttpt -56.71 -51.9 67.04 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 175.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.5 -35.29 78.91 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.885 -176.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -63.59 -39.64 94.91 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 122.215 -0.303 . . . . 0.0 111.239 175.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.5 mt -68.88 -37.38 77.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 49.7 tpt85 -60.89 -41.41 95.97 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 122.792 0.437 . . . . 0.0 109.967 175.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 65.9 ttp -68.42 -37.67 80.5 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 122.62 0.368 . . . . 0.0 110.611 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 8.4 tt -59.48 -51.71 68.72 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.4 mt -71.03 -25.87 62.85 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 120.444 -0.502 . . . . 0.0 111.446 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -66.92 -39.46 87.37 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.285 0.493 . . . . 0.0 109.874 175.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.3 mt -70.82 -35.91 62.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.466 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 27.3 m0 -59.73 -44.13 93.91 Favored 'General case' 0 C--N 1.34 0.171 0 CA-C-N 118.2 0.455 . . . . 0.0 110.037 174.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -71.62 -33.36 68.91 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 111.501 0.186 . . . . 0.0 111.501 179.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 24.4 ttm180 -72.33 -31.1 65.37 Favored 'General case' 0 N--CA 1.458 -0.054 0 C-N-CA 123.207 0.603 . . . . 0.0 111.565 -178.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 35.6 t -70.49 -21.13 62.8 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.121 0.569 . . . . 0.0 111.412 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 71.56 4.87 58.84 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 111.776 -0.53 . . . . 0.0 111.776 -177.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 40.1 tp -79.54 -8.58 59.26 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.35 0.66 . . . . 0.0 110.755 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -127.87 162.93 25.54 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.703 0.801 . . . . 0.0 109.844 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -135.61 171.65 14.15 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 122.886 0.474 . . . . 0.0 110.721 -176.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -66.19 165.66 13.34 Favored 'General case' 0 N--CA 1.458 -0.068 0 C-N-CA 123.249 0.619 . . . . 0.0 110.832 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 22.1 m 58.35 15.85 3.71 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.139 0.976 . . . . 0.0 113.578 -177.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -132.8 11.19 4.34 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.223 0.609 . . . . 0.0 110.955 176.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.52 HD23 ' H ' ' A' ' 142' ' ' LEU . 1.5 pt? -135.4 10.34 3.47 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.958 0.503 . . . . 0.0 111.962 -179.424 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 36.8 m-20 -64.45 -6.75 7.88 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.855 0.862 . . . . 0.0 111.982 -179.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.501 ' C ' ' H ' ' A' ' 146' ' ' ARG . . . -36.85 -36.71 0.12 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 127.621 2.368 . . . . 0.0 114.106 -179.342 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.578 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -65.53 15.82 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 177.252 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.501 ' H ' ' C ' ' A' ' 144' ' ' ALA . 22.6 mmm180 50.86 50.32 19.29 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 123.827 0.851 . . . . 0.0 109.484 -174.132 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 13.4 t 71.03 161.1 0.23 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.33 1.052 . . . . 0.0 112.594 -174.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -51.5 -18.79 1.18 Allowed 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 117.058 2.244 . . . . 0.0 117.058 -166.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 81.1 m -41.23 -64.37 0.56 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 120.158 1.345 . . . . 0.0 112.107 -174.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' PHE . . . . . 0.454 ' H ' ' HD1' ' A' ' 150' ' ' PHE . 28.3 m-85 -32.01 -85.8 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 127.915 2.486 . . . . 0.0 114.305 -171.611 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 151' ' ' ALA . . . . . 0.564 ' HB2' HG21 ' A' ' 113' ' ' ILE . . . -105.63 -6.33 19.33 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 118.498 0.59 . . . . 0.0 112.423 176.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' MET . . . . . 0.404 ' SD ' ' N ' ' A' ' 152' ' ' MET . 0.9 OUTLIER -99.85 -14.52 18.75 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 118.609 -0.71 . . . . 0.0 112.179 -171.672 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -84.21 -20.79 31.72 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 119.77 1.168 . . . . 0.0 111.765 175.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 2.4 tm? . . . . . 0 C--O 1.249 1.077 0 CA-C-O 117.863 -1.065 . . . . 0.0 110.032 -179.942 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 53.9 p90 . . . . . 0 N--CA 1.473 0.71 0 CA-C-O 120.492 0.187 . . . . 0.0 110.595 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 88.8 p -141.6 169.62 10.89 Favored Pre-proline 0 CA--C 1.532 0.283 0 C-N-CA 123.427 0.691 . . . . 0.0 109.842 -177.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -61.4 1.35 0.72 Allowed 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 124.457 3.438 . . . . 0.0 114.097 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 40.6 p -132.54 151.61 51.86 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 118.471 0.578 . . . . 0.0 110.433 -179.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 160' ' ' PRO . . . . . 0.422 ' HD2' ' N ' ' A' ' 27' ' ' SER . 80.7 Cg_endo -69.94 175.13 38.38 Favored 'Cis proline' 0 N--CA 1.451 -0.975 0 N-CA-C 109.742 -0.907 . . . . 0.0 109.742 -10.617 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 45.5 m -65.74 144.9 56.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -151.23 142.6 23.4 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.634 0.254 . . . . 0.0 111.326 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 36.5 p -144.09 159.71 51.83 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-O 120.996 0.427 . . . . 0.0 111.328 177.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -57.02 -0.91 0.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 124.335 3.357 . . . . 0.0 113.464 174.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 26.9 m -67.79 -39.83 83.99 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.045 0.384 . . . . 0.0 110.877 178.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 166' ' ' SEP . . . . . 0.413 ' C ' HH22 ' A' ' 74' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -70.77 -12.14 30.54 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 123.648 2.899 . . . . 0.0 112.747 177.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 72.9 p . . . . . 0 C--O 1.251 1.168 0 CA-C-O 116.611 -1.661 . . . . 0.0 111.115 -175.485 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.2 mmm . . . . . 0 N--CA 1.475 0.811 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -88.34 13.29 11.97 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -177.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -126.98 1.74 6.57 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.951 0.5 . . . . 0.0 111.857 -178.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -71.33 137.76 48.72 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.442 0.565 . . . . 0.0 109.9 179.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 52.39 19.01 1.03 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.371 1.068 . . . . 0.0 113.043 -176.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -105.57 -117.68 0.23 Allowed 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -56.97 -17.12 8.53 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.018 0.372 . . . . 0.0 110.469 174.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -55.52 -42.75 74.95 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.109 0.564 . . . . 0.0 110.327 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -56.55 -43.32 79.82 Favored 'General case' 0 C--N 1.337 0.064 0 CA-C-N 118.264 0.484 . . . . 0.0 110.506 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -66.91 -52.68 40.22 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 110.576 -0.157 . . . . 0.0 110.576 -177.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 67.1 t -61.44 -53.49 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 -179.17 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.6 -34.66 71.37 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.921 0.488 . . . . 0.0 111.906 -177.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 78.4 m -72.03 -41.03 67.97 Favored 'General case' 0 CA--C 1.523 -0.079 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.707 177.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.3 tp -65.36 -33.05 75.04 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -68.42 -44.76 74.31 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.934 0.894 . . . . 0.0 109.941 176.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 72.1 m -64.36 -26.31 68.41 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 175.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.1 -45.82 69.28 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 174.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -63.45 -31.37 72.51 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 122.967 0.507 . . . . 0.0 111.197 177.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -71.46 -14.49 62.16 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.259 0.624 . . . . 0.0 112.461 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 96.7 mt -115.9 162.39 17.41 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.072 0.549 . . . . 0.0 111.05 -176.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -142.47 167.18 22.7 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 123.2 0.6 . . . . 0.0 110.633 -177.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 29.2 m 51.27 34.95 12.47 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.022 0.929 . . . . 0.0 113.423 176.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -166.45 126.84 1.51 Allowed Glycine 0 C--N 1.338 0.641 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 15.8 mm -111.23 50.71 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 C-N-CA 124.172 0.989 . . . . 0.0 108.505 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.4 m -54.88 132.05 45.65 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.045 0.538 . . . . 0.0 111.988 -176.023 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.14 -19.23 63.6 Favored Glycine 0 C--N 1.338 0.658 0 C-N-CA 124.542 1.067 . . . . 0.0 113.208 -178.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.45 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 63.1 p -67.32 -39.54 85.89 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 118.707 1.253 . . . . 0.0 110.649 -176.037 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -67.55 -40.24 84.97 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 178.066 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.5 mt -63.72 -39.48 85.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 177.17 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 47.5 mmtt -63.41 -40.19 96.53 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-O 118.939 -0.553 . . . . 0.0 110.77 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.95 -47.29 75.15 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 118.822 0.737 . . . . 0.0 110.554 175.647 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.7 mt -59.23 -58.77 7.16 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 122.452 -0.155 . . . . 0.0 110.833 -178.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.4 p -57.39 -49.13 77.17 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 t -62.53 -43.98 97.48 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 119.965 -0.694 . . . . 0.0 111.282 -175.237 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -77.27 -21.38 53.72 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -178.022 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.29 -55.81 10.83 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 119.029 0.831 . . . . 0.0 110.019 169.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.5 mt -65.46 -26.14 67.81 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.178 0.991 . . . . 0.0 111.334 -176.436 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -76.06 -16.81 59.86 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.077 0.551 . . . . 0.0 111.654 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -145.65 48.95 1.24 Allowed 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.206 0.203 . . . . 0.0 111.436 -173.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.634 HG22 HG22 ' A' ' 93' ' ' THR . 43.9 mm -63.07 79.05 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-O 121.468 0.651 . . . . 0.0 110.45 171.729 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -153.36 18.15 0.55 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.068 1.747 . . . . 0.0 108.538 176.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.576 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.8 OUTLIER -147.09 36.88 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.065 0 C-N-CA 125.542 1.537 . . . . 0.0 108.541 -171.965 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.469 ' HB2' ' HB2' ' A' ' 97' ' ' ALA . 0.0 OUTLIER -51.37 -53.81 32.75 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -175.237 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 85.6 p -75.4 -23.62 57.08 Favored 'General case' 0 CA--C 1.522 -0.107 0 O-C-N 121.577 -0.702 . . . . 0.0 112.369 -173.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.626 ' HD3' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -86.25 -41.61 14.47 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 -179.323 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 45.4 mt -57.37 -50.84 75.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 171.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.509 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 13.9 mm -66.85 -50.4 65.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 CA-C-O 119.128 -0.463 . . . . 0.0 112.094 -177.604 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 87.6 p -58.95 -31.98 69.2 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 118.973 -1.091 . . . . 0.0 110.438 178.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 57.1 tp -68.97 -44.7 72.4 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 118.765 -0.636 . . . . 0.0 112.145 178.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.0 pt -72.01 -34.71 51.49 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 119.682 1.128 . . . . 0.0 112.0 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.472 HD13 HG21 ' A' ' 104' ' ' VAL . 96.4 mt -64.86 -50.83 73.32 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.103 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 177.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -58.43 -41.2 84.48 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.498 177.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -57.95 -40.86 81.57 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 176.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.2 t -64.21 -53.57 47.09 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 121.245 -0.182 . . . . 0.0 111.42 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -72.4 -23.42 61.09 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 113.761 1.022 . . . . 0.0 113.761 -172.43 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.9 mt -84.03 -15.06 48.96 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.415 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 95.0 m -112.45 158.31 37.66 Favored Pre-proline 0 CA--C 1.533 0.318 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -171.008 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.415 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 74.3 Cg_endo -66.51 -177.47 0.91 Allowed 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 125.09 3.86 . . . . 0.0 113.486 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -55.18 -41.15 71.52 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.114 1.365 . . . . 0.0 114.26 -171.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.4 p -59.74 -32.33 70.46 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 28.9 m170 -88.99 -15.95 32.9 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 119.086 -0.483 . . . . 0.0 111.527 -178.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -68.87 -46.35 68.68 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 170.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 64.3 tp -66.5 -46.66 75.5 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.81 0.338 . . . . 0.0 110.111 177.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.81 -44.07 96.14 Favored Glycine 0 C--N 1.337 0.592 0 N-CA-C 110.7 -0.96 . . . . 0.0 110.7 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.3 t -66.18 -38.53 88.24 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 117.467 0.633 . . . . 0.0 110.367 -179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 66' ' ' LEU . 23.3 mt -58.62 -40.12 82.4 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 119.123 0.874 . . . . 0.0 110.717 175.464 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -69.02 -32.46 71.99 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 119.137 0.881 . . . . 0.0 111.497 178.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 70.8 mt -71.38 -48.21 54.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 O-C-N 121.639 -0.663 . . . . 0.0 110.252 177.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.6 mt -59.56 -36.15 63.32 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.176 0 C-N-CA 124.111 0.964 . . . . 0.0 109.307 176.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -64.33 -52.46 58.34 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.597 0.759 . . . . 0.0 110.54 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.8 t -66.14 -50.56 63.56 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 118.855 -1.138 . . . . 0.0 111.93 -176.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 52.2 mt -65.07 -37.43 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 110.289 -0.263 . . . . 0.0 110.289 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.41 -48.48 57.47 Favored Glycine 0 C--N 1.338 0.658 0 N-CA-C 111.95 -0.46 . . . . 0.0 111.95 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.471 HH22 ' C ' ' B' ' 166' ' ' SEP . 4.8 mtp-105 -67.61 -35.11 78.34 Favored 'General case' 0 C--O 1.23 0.061 0 CA-C-N 117.685 0.742 . . . . 0.0 110.701 179.236 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.61 -42.77 81.86 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 177.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 -62.43 -46.84 86.71 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 176.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 57.6 tp -58.63 -45.1 89.99 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 123.461 0.476 . . . . 0.0 110.424 -177.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -65.79 -46.56 78.27 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.553 -0.092 . . . . 0.0 110.878 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -69.89 -30.9 68.44 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -174.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.5 t -86.35 -26.58 24.77 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 118.61 0.641 . . . . 0.0 111.37 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -73.39 -31.07 63.69 Favored 'General case' 0 CA--C 1.529 0.152 0 O-C-N 122.206 -0.309 . . . . 0.0 110.326 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 31.2 t -61.97 -14.46 35.24 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.634 0.774 . . . . 0.0 112.365 179.334 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -71.09 -20.17 62.38 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.949 -0.469 . . . . 0.0 111.013 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 36.7 m 49.45 24.45 1.1 Allowed 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 177.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -147.93 160.17 43.09 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.21 0.459 . . . . 0.0 110.506 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 33.0 t -147.67 161.54 40.96 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 123.368 0.667 . . . . 0.0 109.9 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 93.2 p -149.19 171.36 16.58 Favored 'General case' 0 C--O 1.231 0.113 0 C-N-CA 122.831 0.453 . . . . 0.0 110.95 -178.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 35.7 m -80.24 5.69 13.93 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.931 0.493 . . . . 0.0 111.823 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -75.29 159.4 31.54 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 122.9 0.48 . . . . 0.0 110.29 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -70.22 152.85 95.58 Favored Pre-proline 0 CA--C 1.531 0.241 0 C-N-CA 123.092 0.557 . . . . 0.0 110.604 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -70.16 164.42 34.99 Favored 'Trans proline' 0 N--CA 1.452 -0.945 0 C-N-CA 123.746 2.964 . . . . 0.0 111.302 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -175.6 177.45 47.41 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.609 -0.996 . . . . 0.0 110.609 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.634 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER 50.62 -151.72 0.2 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.46 0.704 . . . . 0.0 112.58 176.621 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 26.3 p -50.24 -30.37 11.52 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.98 -41.37 95.49 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.308 -0.87 . . . . 0.0 110.152 176.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 -66.11 -34.72 78.7 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.111 0.481 . . . . 0.0 110.33 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.509 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -63.56 -45.15 91.81 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.964 179.173 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 98.3 mt -63.54 -42.92 97.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 175.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -61.03 -33.24 72.98 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 122.379 -0.201 . . . . 0.0 110.852 179.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 86.1 m -75.48 -41.33 55.73 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.467 0.307 . . . . 0.0 111.191 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.5 mt -62.01 -30.29 70.85 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 174.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.08 -14.58 25.51 Favored Glycine 0 CA--C 1.53 1.014 0 CA-C-O 119.174 -0.792 . . . . 0.0 113.668 178.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -101.95 -3.73 27.32 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.846 1.323 . . . . 0.0 112.136 -179.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.472 HG21 HD13 ' A' ' 51' ' ' ILE . 26.8 m -125.86 -18.82 3.0 Favored 'Isoleucine or valine' 0 C--N 1.338 0.074 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -178.693 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.4 tp -50.83 -27.12 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -177.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -64.98 -46.35 81.83 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 118.03 0.377 . . . . 0.0 110.886 178.145 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -74.23 -40.81 62.16 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -178.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 89.5 mt -60.32 -50.3 74.18 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.422 -177.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.415 HD12 ' CB ' ' A' ' 144' ' ' ALA . 78.0 mt -66.51 -59.62 3.48 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 118.383 -0.818 . . . . 0.0 110.245 177.529 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 62.2 p -49.45 -42.09 42.05 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 118.951 0.796 . . . . 0.0 111.898 -173.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -70.57 -51.69 26.77 Favored 'General case' 0 C--O 1.226 -0.152 0 CA-C-N 118.638 0.654 . . . . 0.0 110.863 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.407 ' O ' ' HE3' ' A' ' 115' ' ' LYS . . . -56.06 -32.43 64.08 Favored 'General case' 0 C--O 1.228 -0.078 0 C-N-CA 123.836 0.854 . . . . 0.0 113.044 -178.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -86.94 -36.43 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.151 0 CA-C-N 119.446 1.021 . . . . 0.0 112.35 175.237 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.92 -28.37 66.6 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.395 0.543 . . . . 0.0 111.0 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.407 ' HE3' ' O ' ' A' ' 112' ' ' ALA . 0.1 OUTLIER -79.0 -18.12 54.18 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.0 0.92 . . . . 0.0 110.843 178.386 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 14.9 m -79.07 166.4 22.33 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -174.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -107.93 -174.15 2.45 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.307 1.443 . . . . 0.0 107.886 173.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -50.89 -55.22 18.15 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.349 0.66 . . . . 0.0 112.097 -177.145 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -68.79 -32.74 72.69 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 122.004 -0.435 . . . . 0.0 111.617 -176.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 58.8 m-70 -76.67 -42.04 43.31 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 118.796 -0.621 . . . . 0.0 111.419 -177.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.73 -33.19 75.09 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 119.328 0.967 . . . . 0.0 108.787 176.111 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.07 -46.21 90.12 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.172 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.504 ' HE3' ' CE1' ' B' ' 155' ' ' TYR . 34.7 mtmm -62.42 -42.33 99.37 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.352 176.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.6 mt -66.19 -35.06 74.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -67.43 -38.31 84.36 Favored 'General case' 0 C--O 1.227 -0.107 0 O-C-N 121.986 -0.446 . . . . 0.0 110.637 178.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 64.6 ttp -66.07 -40.99 91.33 Favored 'General case' 0 N--CA 1.457 -0.116 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 176.22 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.9 tt -59.24 -45.01 92.31 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 177.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 91.2 mt -71.36 -28.68 64.22 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -67.51 -38.33 84.12 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 118.482 0.583 . . . . 0.0 109.506 176.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 95.6 mt -69.81 -37.7 74.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 176.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 16.6 m0 -64.5 -33.3 75.57 Favored 'General case' 0 C--N 1.341 0.226 0 O-C-N 122.06 -0.4 . . . . 0.0 110.817 175.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -73.48 -36.29 65.78 Favored 'General case' 0 CA--C 1.531 0.218 0 O-C-N 122.374 -0.204 . . . . 0.0 110.825 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -74.71 -33.82 62.47 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 21.3 t -100.22 -14.9 18.29 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 -176.01 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -70.4 164.26 52.59 Favored Glycine 0 CA--C 1.528 0.847 0 O-C-N 121.953 -0.467 . . . . 0.0 112.457 -176.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 85.3 mt -104.29 0.03 28.8 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.615 0.766 . . . . 0.0 110.862 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 0.415 ' CG ' ' N ' ' A' ' 138' ' ' GLN . 57.4 t80 -88.82 -177.77 5.59 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.693 0.797 . . . . 0.0 109.877 178.355 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' GLN . . . . . 0.415 ' N ' ' CG ' ' A' ' 137' ' ' PHE . 85.5 mt-30 -55.82 151.79 10.82 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 122.829 0.452 . . . . 0.0 109.846 177.732 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -115.32 174.79 5.81 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -170.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 20.3 m 63.28 -2.2 0.47 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 125.586 1.554 . . . . 0.0 114.3 -178.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 26.0 p90 -161.82 156.9 23.29 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 118.465 0.575 . . . . 0.0 110.719 175.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 95.8 mt -136.95 160.15 39.76 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 124.495 1.118 . . . . 0.0 108.747 178.241 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -99.93 -37.74 8.9 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -176.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.415 ' CB ' HD12 ' A' ' 109' ' ' LEU . . . -47.58 -39.88 17.83 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 124.725 1.21 . . . . 0.0 113.359 -171.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.448 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -71.64 29.39 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 123.043 0.537 . . . . 0.0 112.374 174.898 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 80.7 mtp180 48.51 30.24 2.36 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 123.72 0.808 . . . . 0.0 110.718 -172.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 75.4 m 46.87 22.59 0.2 Allowed 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 -175.236 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -125.02 -169.84 2.06 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 -172.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 29.0 p -51.68 -14.74 0.37 Allowed 'General case' 0 C--O 1.231 0.103 0 C-N-CA 126.191 1.797 . . . . 0.0 115.417 -169.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -37.39 -69.69 0.11 Allowed 'General case' 0 C--N 1.341 0.208 0 CA-C-N 118.829 0.74 . . . . 0.0 110.576 176.371 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -111.65 -11.75 13.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 119.101 -0.476 . . . . 0.0 111.218 169.035 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 31.6 mmt -71.34 -14.14 62.09 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.198 0.908 . . . . 0.0 110.335 175.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 8.1 t70 63.79 -14.28 0.08 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.853 1.661 . . . . 0.0 114.534 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 1.5 pt? . . . . . 0 C--O 1.254 1.296 0 CA-C-O 117.654 -1.165 . . . . 0.0 111.28 173.55 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 155' ' ' TYR . . . . . 0.504 ' CE1' ' HE3' ' A' ' 123' ' ' LYS . 29.0 t80 . . . . . 0 N--CA 1.473 0.68 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 84.2 p -71.86 156.49 90.96 Favored Pre-proline 0 N--CA 1.456 -0.152 0 C-N-CA 122.491 0.316 . . . . 0.0 111.085 -178.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -74.26 -2.95 13.05 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 123.879 3.053 . . . . 0.0 112.088 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 72.1 p 46.93 34.31 2.64 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.285 1.034 . . . . 0.0 112.7 -179.226 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 160' ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' ' 27' ' ' SER . 58.4 Cg_endo -65.62 -62.7 0.03 OUTLIER 'Cis proline' 0 N--CA 1.457 -0.62 0 CA-C-N 119.176 0.741 . . . . 0.0 111.698 -2.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 161' ' ' SER . . . . . 0.421 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 65.9 p -170.47 148.48 3.14 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.18 0.992 . . . . 0.0 108.997 175.381 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -158.62 137.96 11.62 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 120.677 0.275 . . . . 0.0 111.628 172.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 16.3 t -137.69 144.76 45.93 Favored Pre-proline 0 CA--C 1.529 0.138 0 C-N-CA 123.743 0.817 . . . . 0.0 110.152 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -66.23 -1.46 5.46 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 123.305 2.67 . . . . 0.0 111.712 177.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 39.4 p -75.33 -26.31 58.52 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 119.125 -0.464 . . . . 0.0 111.414 178.234 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 166' ' ' SEP . . . . . 0.471 ' C ' HH22 ' A' ' 74' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -65.84 170.84 10.77 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 123.2 2.6 . . . . 0.0 111.543 174.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 75.5 m . . . . . 0 C--O 1.251 1.173 0 CA-C-O 116.955 -1.497 . . . . 0.0 111.68 179.708 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.3 ptt? . . . . . 0 N--CA 1.474 0.77 0 CA-C-O 120.27 0.081 . . . . 0.0 110.994 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -148.77 -25.07 0.31 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 122.958 0.503 . . . . 0.0 111.294 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -149.3 16.99 0.93 Allowed 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.146 0.43 . . . . 0.0 111.911 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 58.82 9.17 1.1 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.73 1.212 . . . . 0.0 113.462 -177.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -142.64 15.6 1.98 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.96 0.904 . . . . 0.0 110.423 177.389 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -77.42 -151.32 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.469 1.108 . . . . 0.0 110.0 176.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -54.98 -16.41 2.73 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.199 0.6 . . . . 0.0 110.776 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -54.53 -39.16 67.4 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 118.944 -0.551 . . . . 0.0 110.289 173.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 -64.82 -42.31 95.08 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-N 118.947 0.794 . . . . 0.0 110.216 178.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -64.89 -50.32 67.0 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 118.087 0.403 . . . . 0.0 110.425 -178.117 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 93.0 t -63.75 -54.15 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.6 -30.69 67.42 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 122.781 0.432 . . . . 0.0 111.589 -178.143 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 54.0 m -74.64 -41.91 59.5 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.268 0.485 . . . . 0.0 110.594 177.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.4 tp -67.05 -29.75 69.62 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -71.04 -39.92 71.99 Favored 'General case' 0 CA--C 1.523 -0.09 0 C-N-CA 124.032 0.933 . . . . 0.0 109.868 175.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.6 t -63.78 -28.75 70.09 Favored 'General case' 0 N--CA 1.456 -0.134 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 173.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.52 -32.25 60.42 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 110.002 -0.369 . . . . 0.0 110.002 174.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -67.74 -33.28 74.56 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 122.678 0.391 . . . . 0.0 110.203 176.395 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -72.26 -14.3 61.74 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.956 0.502 . . . . 0.0 110.835 174.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.2 pp 51.67 170.59 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 128.02 2.528 . . . . 0.0 115.531 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.2 tptm -141.1 26.02 2.05 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.741 1.216 . . . . 0.0 109.499 -179.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 24.3 m 56.13 22.09 5.73 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.482 0.713 . . . . 0.0 112.003 -175.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -164.9 -162.14 15.32 Favored Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 178.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 20.7 mm -125.63 68.06 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 C-N-CA 124.732 1.213 . . . . 0.0 108.641 -173.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.42 ' HB2' HH11 ' A' ' 28' ' ' ARG . 73.8 m -59.35 132.41 53.93 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.112 0.565 . . . . 0.0 112.41 -175.127 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.73 -23.62 72.44 Favored Glycine 0 C--N 1.337 0.627 0 C-N-CA 124.117 0.865 . . . . 0.0 112.581 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.49 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 36.6 t -65.08 -41.12 95.32 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 118.533 1.167 . . . . 0.0 110.46 -175.372 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.42 HH11 ' HB2' ' A' ' 25' ' ' SER . 81.0 mtt85 -69.57 -38.8 77.54 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 75.9 mt -64.17 -39.42 85.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 176.366 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp -67.7 -36.86 81.41 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.348 -0.358 . . . . 0.0 111.412 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.453 ' HE3' ' O ' ' A' ' 27' ' ' SER . 0.0 OUTLIER -68.98 -43.93 73.94 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.676 0.671 . . . . 0.0 110.703 175.484 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.4 mt -62.85 -56.47 17.05 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 110.605 -0.146 . . . . 0.0 110.605 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.573 HG21 ' HB2' ' A' ' 71' ' ' SER . 50.8 p -56.3 -49.18 75.04 Favored 'General case' 0 CA--C 1.522 -0.13 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 177.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 t -62.28 -43.86 97.86 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.964 -174.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -68.47 -35.54 77.71 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 118.721 -1.192 . . . . 0.0 111.503 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.86 -58.0 10.57 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.132 0.424 . . . . 0.0 110.226 174.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.83 -16.23 63.23 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -176.216 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -59.62 -27.25 66.15 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -179.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.3 t-80 -152.3 -23.63 0.17 Allowed 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 -176.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.51 HG22 HG22 ' A' ' 93' ' ' THR . 33.5 mm 46.51 74.96 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 123.431 0.693 . . . . 0.0 111.675 -178.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -147.24 20.57 1.22 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.857 0.863 . . . . 0.0 109.8 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.58 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.3 pt -147.45 35.33 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 C-N-CA 124.291 1.036 . . . . 0.0 109.805 -171.319 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.487 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -50.61 -58.16 6.5 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.205 1.002 . . . . 0.0 113.601 -177.05 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 52.9 m -73.09 -26.8 61.38 Favored 'General case' 0 CA--C 1.52 -0.192 0 O-C-N 121.864 -0.523 . . . . 0.0 112.4 -174.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.655 ' H ' ' CD ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.76 -44.12 15.95 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 119.305 -0.378 . . . . 0.0 109.989 -178.741 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 16.7 mt -56.22 -51.93 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.125 0 CA-C-N 118.303 0.502 . . . . 0.0 109.711 171.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.43 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 13.4 mm -66.8 -49.45 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -176.412 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 34.2 t -56.66 -36.72 69.88 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 119.987 -0.685 . . . . 0.0 109.646 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.1 tp -69.71 -42.37 74.12 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 118.444 -0.789 . . . . 0.0 112.63 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 32.1 pt -72.99 -37.64 54.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 120.003 1.274 . . . . 0.0 111.773 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.446 HD13 HG21 ' A' ' 104' ' ' VAL . 95.5 mt -63.39 -49.6 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.251 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -59.21 -41.72 89.28 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.762 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -55.83 -40.13 72.38 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 176.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -67.9 -52.6 34.47 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -69.0 -23.03 64.05 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -173.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 55.9 mt -81.33 -14.84 56.85 Favored 'General case' 0 C--O 1.231 0.113 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 177.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.546 ' HB3' ' CG ' ' A' ' 61' ' ' HIS . 76.4 m -126.39 157.89 68.91 Favored Pre-proline 0 CA--C 1.539 0.554 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -170.448 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.452 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 64.0 Cg_endo -74.76 -166.56 0.35 Allowed 'Trans proline' 0 CA--C 1.537 0.665 1 C-N-CA 125.34 4.027 . . . . 0.0 114.648 -176.07 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -38.77 -57.2 1.24 Allowed 'General case' 0 C--O 1.236 0.358 0 C-N-CA 128.167 2.587 . . . . 0.0 115.342 -173.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.3 t -58.92 -31.49 68.7 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.774 0.321 . . . . 0.0 110.46 -175.191 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.546 ' CG ' ' HB3' ' A' ' 57' ' ' CYS . 16.2 m80 -82.49 -23.9 34.45 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.076 0.551 . . . . 0.0 111.272 -178.219 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -68.31 -44.67 74.89 Favored 'General case' 0 C--N 1.342 0.25 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 172.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 49.2 tp -66.39 -46.2 77.42 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.271 178.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.63 -44.0 97.22 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.153 -1.179 . . . . 0.0 110.153 177.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.3 t -55.82 -50.51 70.32 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.941 0.371 . . . . 0.0 110.064 177.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 37.5 mt -58.58 -39.94 81.74 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 118.692 -0.671 . . . . 0.0 111.645 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -69.2 -29.36 67.32 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.081 0.855 . . . . 0.0 111.789 179.011 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 64.1 mt -79.1 -39.24 21.18 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 O-C-N 121.797 -0.564 . . . . 0.0 110.588 178.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 75.9 mt -64.81 -35.8 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 175.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.12 -52.79 53.25 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.102 1.361 . . . . 0.0 110.127 177.03 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.573 ' HB2' HG21 ' A' ' 33' ' ' THR . 81.3 p -66.38 -52.52 45.96 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 120.049 -0.66 . . . . 0.0 112.015 -175.512 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 37.6 mt -67.86 -34.43 67.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 CA-C-N 117.641 0.2 . . . . 0.0 110.649 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.98 -50.16 59.27 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 111.692 -0.563 . . . . 0.0 111.692 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.7 mtp-105 -68.02 -36.96 80.82 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-N 117.364 0.582 . . . . 0.0 110.866 178.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.95 -40.95 83.14 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 117.623 0.192 . . . . 0.0 110.551 179.05 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.8 m-30 -64.79 -45.45 86.24 Favored 'General case' 0 CA--C 1.516 -0.332 0 O-C-N 122.147 -0.346 . . . . 0.0 110.093 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 48.4 tp -59.34 -44.7 92.61 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 123.37 0.419 . . . . 0.0 110.209 -177.026 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -66.3 -43.74 85.42 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 122.259 -0.276 . . . . 0.0 110.315 177.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.1 tp10 -67.03 -27.71 67.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 119.485 -0.293 . . . . 0.0 111.745 -176.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.9 t -94.04 -23.76 17.88 Favored 'General case' 0 CA--C 1.528 0.115 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 69.9 mtm180 -91.61 -33.68 15.01 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-N 119.097 0.862 . . . . 0.0 112.592 176.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 39.5 m -90.29 -10.32 44.61 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -176.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -141.14 158.27 44.14 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.593 0.357 . . . . 0.0 110.221 -178.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 50.3 m -81.59 165.13 21.38 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 122.953 0.501 . . . . 0.0 110.763 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -143.8 162.39 36.18 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.308 0.643 . . . . 0.0 109.788 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 83.8 p -78.74 169.15 18.68 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.225 0.61 . . . . 0.0 111.229 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 52.2 m -137.21 155.05 50.0 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 123.054 0.542 . . . . 0.0 110.227 178.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 50.6 m 57.69 176.17 0.05 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.37 1.068 . . . . 0.0 112.737 -176.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 48.4 t30 55.65 16.01 1.78 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.235 1.014 . . . . 0.0 113.085 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -145.69 150.79 44.53 Favored Pre-proline 0 CA--C 1.53 0.178 0 C-N-CA 123.825 0.85 . . . . 0.0 109.827 179.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -76.39 -14.89 18.06 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 123.424 2.75 . . . . 0.0 110.837 177.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 148.24 -176.13 27.21 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.181 -1.168 . . . . 0.0 110.181 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.51 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -152.76 -157.22 0.77 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 122.897 0.479 . . . . 0.0 110.392 176.305 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.9 p -48.35 -32.58 7.67 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -176.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.82 -46.73 83.8 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.835 0.743 . . . . 0.0 110.074 176.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 66.9 m80 -67.07 -29.79 69.67 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.005 0.522 . . . . 0.0 110.593 178.282 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.43 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -65.14 -46.6 80.25 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 122.99 0.516 . . . . 0.0 110.462 177.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.8 -42.77 97.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 176.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -61.48 -33.94 74.63 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 122.257 -0.277 . . . . 0.0 111.165 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.1 m -73.36 -42.16 62.56 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.161 -0.337 . . . . 0.0 110.889 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 47.8 mt -60.09 -31.4 69.99 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 174.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.55 -14.53 14.47 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-O 119.019 -0.878 . . . . 0.0 114.23 178.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -101.63 -6.25 24.03 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.957 1.379 . . . . 0.0 112.059 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.446 HG21 HD13 ' A' ' 51' ' ' ILE . 30.1 m -121.75 -19.36 4.56 Favored 'Isoleucine or valine' 0 C--N 1.337 0.048 0 C-N-CA 123.099 0.56 . . . . 0.0 111.846 -178.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.406 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.9 tp -52.14 -26.99 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 C-N-CA 122.891 0.476 . . . . 0.0 112.055 -178.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.427 ' HA ' ' HB1' ' A' ' 144' ' ' ALA . 17.3 pt20 -59.44 -57.21 14.0 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 122.896 0.479 . . . . 0.0 111.499 177.783 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -76.37 -32.81 58.82 Favored 'General case' 0 N--CA 1.457 -0.115 0 O-C-N 122.137 -0.352 . . . . 0.0 111.409 -177.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.4 mt -61.65 -49.48 76.39 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.415 HD12 ' CB ' ' A' ' 144' ' ' ALA . 70.7 mt -65.41 -58.18 6.49 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.343 -0.836 . . . . 0.0 109.989 177.002 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 98.0 p -50.33 -43.93 54.14 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.093 0.861 . . . . 0.0 111.735 -173.261 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -68.49 -52.53 31.32 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 118.422 0.555 . . . . 0.0 110.776 177.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.461 ' O ' ' HE3' ' A' ' 115' ' ' LYS . . . -56.19 -33.06 64.96 Favored 'General case' 0 N--CA 1.457 -0.107 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -177.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -87.15 -36.16 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 119.853 1.206 . . . . 0.0 112.374 175.295 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.44 -25.49 63.22 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 119.771 -0.772 . . . . 0.0 110.747 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.461 ' HE3' ' O ' ' A' ' 112' ' ' ALA . 0.1 OUTLIER -80.2 -20.09 45.52 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.629 0.772 . . . . 0.0 110.536 177.277 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.7 m -77.08 159.18 30.03 Favored 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -171.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -90.62 175.79 6.91 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.831 1.253 . . . . 0.0 107.859 170.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -55.97 -40.76 73.73 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.832 -0.542 . . . . 0.0 112.069 -177.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -69.7 -36.77 76.22 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.958 -0.464 . . . . 0.0 110.654 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -75.3 -42.92 53.63 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 118.734 -0.651 . . . . 0.0 110.843 -178.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.404 ' HD2' ' C ' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -64.88 -33.66 76.54 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 119.539 1.063 . . . . 0.0 109.78 176.348 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.1 -46.5 87.04 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.023 177.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -63.89 -37.59 87.97 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.688 177.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 92.7 mt -68.58 -35.55 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -65.44 -40.1 92.86 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 176.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 24.2 ttt -62.41 -43.13 99.55 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 176.102 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.0 tt -58.04 -44.63 87.52 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 178.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.9 mt -71.45 -32.13 67.97 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -64.66 -43.55 93.24 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.019 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.3 mt -66.26 -39.52 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 59.8 t-105 -63.66 -29.21 70.48 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 122.177 0.191 . . . . 0.0 110.743 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -73.17 -42.39 62.82 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 174.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -70.51 -16.24 62.87 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 67.6 m -62.39 -14.67 42.78 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 118.381 0.537 . . . . 0.0 112.068 175.077 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 75.5 10.74 84.62 Favored Glycine 0 CA--C 1.531 1.049 0 CA-C-O 119.696 -0.502 . . . . 0.0 113.035 176.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 54.0 tp -68.12 -20.48 64.91 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.06 0.93 . . . . 0.0 110.461 178.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -144.67 170.05 16.82 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.174 0.99 . . . . 0.0 108.959 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 54.3 mm-40 -68.73 163.73 23.32 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -62.96 138.56 58.59 Favored 'General case' 0 N--CA 1.455 -0.183 0 O-C-N 122.07 -0.394 . . . . 0.0 110.571 -178.043 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 23.5 m 54.48 21.65 3.43 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.109 0.964 . . . . 0.0 112.958 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -86.26 -7.14 58.74 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 122.245 -0.285 . . . . 0.0 111.684 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 82.7 mt -68.4 138.35 55.27 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -132.73 -17.34 2.52 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 119.307 -0.378 . . . . 0.0 111.459 -177.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.439 ' C ' ' H ' ' A' ' 146' ' ' ARG . . . -40.67 -40.29 1.26 Allowed 'General case' 0 C--N 1.343 0.29 0 C-N-CA 125.766 1.627 . . . . 0.0 113.439 -174.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -68.77 22.03 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 123.245 0.618 . . . . 0.0 112.387 175.708 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.439 ' H ' ' C ' ' A' ' 144' ' ' ALA . 79.3 mtp180 51.34 24.61 2.18 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 124.684 1.193 . . . . 0.0 110.959 -170.468 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 9.1 t 49.39 23.76 0.93 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.06 0.544 . . . . 0.0 111.96 -171.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -97.78 170.13 9.2 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.614 0.766 . . . . 0.0 112.773 -173.002 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 28.6 p -55.09 -14.09 1.45 Allowed 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 124.426 1.091 . . . . 0.0 112.306 -177.632 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 18.6 m-30 -29.96 -66.21 0.1 Allowed 'General case' 0 C--N 1.34 0.164 0 C-N-CA 125.033 1.333 . . . . 0.0 110.35 175.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -113.18 -13.11 13.03 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.168 167.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 32.3 mmt -73.46 0.14 13.26 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.934 0.788 . . . . 0.0 111.969 179.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -55.45 -20.6 12.99 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.508 0.723 . . . . 0.0 112.066 175.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 95.6 mt . . . . . 0 C--O 1.249 1.063 0 CA-C-O 117.666 -1.159 . . . . 0.0 109.75 179.106 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 54.1 p90 . . . . . 0 N--CA 1.475 0.783 0 CA-C-O 120.568 0.223 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 90.1 p -150.97 166.61 14.69 Favored Pre-proline 0 CA--C 1.532 0.287 0 C-N-CA 123.209 0.604 . . . . 0.0 109.839 -179.14 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -54.02 149.83 33.5 Favored 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 123.69 2.927 . . . . 0.0 112.794 178.224 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 43.5 p -139.86 21.02 2.49 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 123.158 0.583 . . . . 0.0 111.752 -177.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 160' ' ' PRO . . . . . 0.49 ' HD2' ' N ' ' A' ' 27' ' ' SER . 63.5 Cg_endo -69.21 -65.16 0.03 OUTLIER 'Cis proline' 0 N--CA 1.456 -0.69 0 CA-C-N 119.572 0.883 . . . . 0.0 110.864 -4.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 161' ' ' SER . . . . . 0.482 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 41.2 t -168.43 145.55 3.96 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 124.186 0.994 . . . . 0.0 108.585 175.109 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -157.75 137.84 12.52 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 117.842 0.292 . . . . 0.0 111.434 174.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 12.2 t -135.37 144.98 51.87 Favored Pre-proline 0 N--CA 1.454 -0.227 0 C-N-CA 123.773 0.829 . . . . 0.0 110.362 -178.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -67.81 -0.09 4.95 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 123.186 2.591 . . . . 0.0 110.707 178.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 37.9 m -71.08 -30.24 66.31 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.582 0.353 . . . . 0.0 110.568 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -74.15 -20.81 18.62 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 123.369 2.713 . . . . 0.0 112.446 178.096 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 31.0 t . . . . . 0 C--O 1.252 1.222 0 CA-C-O 117.268 -1.348 . . . . 0.0 110.703 -177.424 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.474 0.756 0 N-CA-C 110.56 -0.163 . . . . 0.0 110.56 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -137.44 163.84 30.11 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.243 0.617 . . . . 0.0 109.93 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -147.58 148.74 31.46 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 120.974 0.416 . . . . 0.0 110.588 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -149.11 156.86 42.83 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.969 0.908 . . . . 0.0 108.821 176.361 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -137.52 24.66 2.91 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -177.188 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -81.3 -151.73 0.09 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 175.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -55.81 -14.77 2.55 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.768 -0.583 . . . . 0.0 111.189 177.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.5 tp60 -55.3 -40.18 70.79 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.265 0.626 . . . . 0.0 110.836 177.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -64.44 -38.64 91.72 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.754 0.706 . . . . 0.0 111.004 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -64.46 -55.13 22.86 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.501 0.591 . . . . 0.0 109.897 178.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.8 t -60.04 -55.37 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 -178.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.12 -33.28 67.19 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 123.248 0.619 . . . . 0.0 112.026 -178.163 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 53.5 m -70.22 -45.17 67.11 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.847 0.749 . . . . 0.0 110.415 177.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.8 tp -65.6 -33.06 75.04 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.216 0.531 . . . . 0.0 109.741 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -66.72 -45.92 77.15 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 123.916 0.886 . . . . 0.0 110.325 178.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 73.1 m -63.23 -29.45 70.79 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 174.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.79 -29.62 64.66 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.545 0.338 . . . . 0.0 110.264 176.538 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -77.7 -43.54 30.79 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.894 0.478 . . . . 0.0 111.635 176.116 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -76.1 -26.61 56.61 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 112.956 0.725 . . . . 0.0 112.956 -173.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.1 mt -141.61 160.0 41.07 Favored 'General case' 0 N--CA 1.458 -0.057 0 C-N-CA 122.868 0.467 . . . . 0.0 110.756 -177.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -104.44 158.58 16.37 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 123.194 0.597 . . . . 0.0 109.793 177.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 92.3 p -146.56 11.18 1.11 Allowed 'General case' 0 CA--C 1.527 0.083 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.81 30.96 62.91 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 110.354 -1.099 . . . . 0.0 110.354 -176.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.4 mm 58.29 42.99 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 C-N-CA 124.123 0.969 . . . . 0.0 110.389 -175.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.0 t -57.53 136.56 56.74 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 120.974 0.416 . . . . 0.0 110.844 -177.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.59 -24.12 72.4 Favored Glycine 0 CA--C 1.526 0.731 0 CA-C-O 118.999 -0.889 . . . . 0.0 113.911 -172.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.422 ' O ' ' HE3' ' A' ' 31' ' ' LYS . 81.0 p -63.36 -35.89 81.9 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 118.958 1.379 . . . . 0.0 111.217 -175.415 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -65.52 -44.54 86.65 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 178.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 48.7 mt -61.5 -40.59 86.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -63.68 -38.5 91.36 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 119.241 -0.409 . . . . 0.0 111.415 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.422 ' HE3' ' O ' ' A' ' 27' ' ' SER . 0.0 OUTLIER -64.28 -47.32 79.96 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 118.627 0.649 . . . . 0.0 109.85 175.194 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 92.8 mt -60.28 -56.82 16.89 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 122.395 -0.191 . . . . 0.0 110.973 -178.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.405 HG21 ' OG ' ' A' ' 71' ' ' SER . 75.9 p -58.28 -48.06 81.65 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 t -63.27 -42.48 99.13 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.247 -0.581 . . . . 0.0 111.453 -175.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -75.56 -22.94 56.57 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.99 -55.6 13.77 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 119.043 0.838 . . . . 0.0 109.166 167.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 61.8 mt -69.78 -15.72 63.17 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.21 1.004 . . . . 0.0 113.05 -175.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -57.07 -29.49 63.49 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -178.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.5 t-160 -150.91 -24.65 0.22 Allowed 'General case' 0 N--CA 1.461 0.122 0 N-CA-C 113.994 1.109 . . . . 0.0 113.994 -176.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.405 HG22 HG22 ' A' ' 93' ' ' THR . 40.3 mm 45.73 73.92 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-O 122.06 0.933 . . . . 0.0 111.351 -179.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -138.02 8.63 2.75 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.23 1.012 . . . . 0.0 109.83 178.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.528 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -142.72 109.61 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 125.142 1.377 . . . . 0.0 107.913 -178.301 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.472 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -104.92 -67.96 0.88 Allowed 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -177.342 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.431 ' H ' ' HG2' ' A' ' 43' ' ' GLU . 81.6 p -68.29 -23.16 64.71 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 122.98 0.512 . . . . 0.0 111.894 -173.235 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.622 ' HD2' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -73.36 -54.8 7.45 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.799 0.84 . . . . 0.0 109.299 178.377 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.419 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 8.6 mt -57.25 -45.79 84.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 C-N-CA 122.836 0.454 . . . . 0.0 110.143 175.584 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 14.6 mm -69.5 -47.98 69.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 CA-C-O 119.143 -0.456 . . . . 0.0 111.988 -177.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 95.5 p -63.02 -30.65 71.76 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-N 119.294 0.952 . . . . 0.0 110.227 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 46.4 tp -68.66 -45.72 71.0 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 119.15 -0.452 . . . . 0.0 111.772 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.5 pt -73.08 -36.77 51.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 119.192 0.905 . . . . 0.0 111.677 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.474 HD13 HG21 ' A' ' 104' ' ' VAL . 93.7 mt -62.03 -53.33 49.23 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.124 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.513 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.451 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 36.3 t70 -62.67 -31.47 72.37 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.517 179.12 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -61.14 -41.42 96.72 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.1 t -69.36 -35.99 76.4 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.935 175.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.451 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 50.9 tpt85 -66.53 -41.82 88.15 Favored 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -174.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 71.7 mt -96.06 -14.51 22.86 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 113.952 1.093 . . . . 0.0 113.952 -172.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 82.0 m -101.61 162.48 20.31 Favored Pre-proline 0 CA--C 1.536 0.432 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -170.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_exo -55.68 177.49 0.13 Allowed 'Trans proline' 0 N--CA 1.461 -0.431 1 C-N-CA 125.637 4.225 . . . . 0.0 115.188 179.261 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -56.88 -46.2 82.03 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.28 1.032 . . . . 0.0 113.293 -175.37 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 73.1 m -60.87 -26.88 67.72 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 5.5 m80 -81.77 -23.74 36.43 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 119.243 -0.408 . . . . 0.0 110.803 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -73.82 -44.77 54.77 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.877 0.762 . . . . 0.0 109.23 175.272 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.99 -50.09 65.51 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 177.063 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.59 -41.85 93.8 Favored Glycine 0 C--N 1.337 0.619 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.8 t -67.55 -37.76 83.16 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.713 0.756 . . . . 0.0 110.538 179.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 32.1 mt -59.79 -36.12 76.07 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 119.522 1.056 . . . . 0.0 110.756 175.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -73.08 -32.76 65.2 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 119.485 -0.886 . . . . 0.0 111.644 176.224 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 79.0 mt -67.04 -48.03 80.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 118.819 0.736 . . . . 0.0 109.915 175.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 72.1 mt -61.12 -35.9 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 C-N-CA 124.226 1.01 . . . . 0.0 109.431 178.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -66.91 -45.49 77.77 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 118.88 -0.581 . . . . 0.0 110.418 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.405 ' OG ' HG21 ' A' ' 33' ' ' THR . 7.5 t -63.86 -54.52 33.63 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 118.794 0.724 . . . . 0.0 111.336 -178.213 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 55.5 mt -63.16 -33.77 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.22 -51.95 34.96 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-O 119.545 -0.586 . . . . 0.0 112.437 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.646 ' CG ' HH11 ' A' ' 74' ' ' ARG . 0.0 OUTLIER -70.51 -31.83 69.08 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 118.056 0.928 . . . . 0.0 110.625 -178.525 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.71 -46.75 71.33 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -61.29 -46.95 88.21 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 176.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 66.4 tp -56.91 -45.63 82.53 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.587 0.355 . . . . 0.0 110.483 -177.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -66.61 -48.28 70.0 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.761 179.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.9 mm-40 -61.87 -27.77 69.03 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -175.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.2 t -97.79 -24.84 15.27 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 36.9 ptt180 -79.13 -24.68 43.18 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 119.346 0.976 . . . . 0.0 111.408 177.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.3 m -68.35 -14.05 62.72 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 175.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -80.27 153.48 28.45 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 120.823 0.344 . . . . 0.0 110.85 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 49.3 m -139.0 23.5 2.59 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.844 0.858 . . . . 0.0 110.353 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.8 p30 -130.7 -174.86 3.48 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.765 0.826 . . . . 0.0 110.383 -176.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 80.7 p -71.25 -2.81 17.33 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -177.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 36.1 m -77.79 0.45 23.7 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.418 0.554 . . . . 0.0 111.747 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 77.8 p -130.71 18.26 5.19 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 123.588 0.755 . . . . 0.0 110.421 177.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -127.33 26.04 6.06 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.725 0.81 . . . . 0.0 110.507 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -129.91 155.56 80.37 Favored Pre-proline 0 C--O 1.231 0.091 0 C-N-CA 124.139 0.976 . . . . 0.0 109.805 -178.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.27 166.4 27.11 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 123.472 2.781 . . . . 0.0 110.864 177.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 82.45 178.03 52.18 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.084 -178.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.405 HG22 HG22 ' A' ' 40' ' ' ILE . 0.6 OUTLIER 53.87 -169.87 0.05 Allowed 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 125.514 1.526 . . . . 0.0 114.901 179.249 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.5 p -50.06 -31.54 13.33 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 -173.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.08 -47.52 82.54 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.872 0.76 . . . . 0.0 109.981 176.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -67.69 -31.29 71.15 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.3 0.572 . . . . 0.0 110.4 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.37 -45.93 82.16 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.366 -178.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.6 mt -64.72 -42.73 95.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 174.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -59.75 -32.81 70.91 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 122.546 -0.096 . . . . 0.0 111.034 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.9 m -76.39 -41.39 48.07 Favored 'General case' 0 C--O 1.227 -0.08 0 C-N-CA 122.421 0.288 . . . . 0.0 111.162 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 58.4 mt -61.79 -29.26 70.02 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-N 118.867 0.758 . . . . 0.0 109.166 174.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.99 -14.38 31.11 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-O 119.199 -0.779 . . . . 0.0 113.562 178.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -101.84 -3.81 27.36 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 118.806 1.303 . . . . 0.0 112.136 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.474 HG21 HD13 ' A' ' 51' ' ' ILE . 27.4 m -125.86 -17.97 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.03 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.1 tp -48.96 -30.5 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 C-N-CA 123.171 0.588 . . . . 0.0 112.458 -178.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -64.23 -45.42 88.26 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.24 0.473 . . . . 0.0 110.713 178.242 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -74.07 -38.95 63.78 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.282 0.633 . . . . 0.0 110.082 -178.233 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.0 mt -62.92 -53.04 60.2 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.24 -178.048 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.437 ' O ' HG13 ' A' ' 113' ' ' ILE . 81.0 mt -63.82 -59.11 4.96 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.71 -0.662 . . . . 0.0 109.463 177.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.443 ' HB2' ' CZ ' ' A' ' 150' ' ' PHE . 77.7 p -48.82 -45.53 40.63 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 119.008 0.822 . . . . 0.0 112.457 -174.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 89.5 m-20 -69.13 -44.76 71.72 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 118.852 0.751 . . . . 0.0 110.764 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.05 -44.88 94.39 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 118.306 0.503 . . . . 0.0 111.434 -177.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -74.73 -33.44 31.24 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.13 0 CA-C-N 118.661 0.664 . . . . 0.0 112.138 179.864 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.21 -26.94 65.97 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.572 176.361 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.75 -17.65 57.34 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 125.963 1.705 . . . . 0.0 110.842 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 37.6 m -83.48 155.89 23.15 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -172.124 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 -103.32 -175.94 2.94 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 169.361 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 22.2 tm0? -55.54 -41.2 72.87 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 119.398 0.999 . . . . 0.0 110.982 -178.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.81 -45.85 87.77 Favored 'General case' 0 C--O 1.233 0.206 0 O-C-N 121.583 -0.698 . . . . 0.0 110.891 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 46.6 m170 -73.29 -37.6 66.19 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 118.783 -0.627 . . . . 0.0 111.737 -176.271 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.72 -34.03 76.95 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 119.278 0.945 . . . . 0.0 109.0 176.308 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -66.04 -41.69 90.54 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -65.39 -42.63 92.42 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 176.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.4 -35.87 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 80.1 ttt-85 -67.77 -34.34 76.61 Favored 'General case' 0 N--CA 1.453 -0.316 0 O-C-N 122.31 -0.244 . . . . 0.0 110.708 177.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.2 ttt -66.1 -44.37 84.53 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 176.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.422 HD23 ' C ' ' A' ' 127' ' ' LEU . 6.4 tt -56.29 -48.9 75.7 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.099 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 79.0 mt -73.03 -26.54 61.34 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -178.429 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -68.42 -36.56 79.26 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 175.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 84.8 mt -69.23 -42.62 81.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.112 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 175.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 28.3 m0 -62.68 -30.64 71.54 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 121.12 -0.232 . . . . 0.0 110.579 177.23 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -75.44 -40.27 57.79 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 122.115 -0.365 . . . . 0.0 111.378 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 47.1 mtm105 -78.84 -14.08 59.44 Favored 'General case' 0 C--O 1.231 0.098 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 55.7 p -57.68 -18.79 22.71 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 118.394 0.543 . . . . 0.0 111.836 176.032 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 71.78 9.81 70.87 Favored Glycine 0 CA--C 1.53 0.995 0 CA-C-O 119.435 -0.647 . . . . 0.0 112.528 177.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 58.5 tp -56.72 121.36 9.6 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 118.024 0.912 . . . . 0.0 110.646 -177.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 52.01 11.35 0.15 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.348 1.459 . . . . 0.0 114.058 -178.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 48.85 28.79 2.04 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.391 1.077 . . . . 0.0 113.687 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -75.69 -27.98 58.46 Favored 'General case' 0 C--N 1.34 0.18 0 O-C-N 121.879 -0.513 . . . . 0.0 111.223 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 21.7 m 51.18 18.24 0.57 Allowed 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 177.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -149.58 154.57 38.9 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.236 0.471 . . . . 0.0 110.986 179.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 65.3 tp -153.24 124.25 7.42 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 175.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 53.2 p-10 -77.34 -15.42 59.41 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -175.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -54.84 -32.03 60.11 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.305 0.642 . . . . 0.0 111.703 -173.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.65 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -116.72 -29.37 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.14 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 171.81 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 95.0 mtt-85 -67.98 -14.09 62.69 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 118.013 0.37 . . . . 0.0 111.491 -177.173 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 35.6 t -69.21 -23.82 63.94 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 118.746 -0.645 . . . . 0.0 112.167 178.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.555 ' HG2' ' H ' ' A' ' 149' ' ' CYS . 40.6 tttt -155.12 178.52 10.11 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 123.085 1.422 . . . . 0.0 114.729 -176.517 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 149' ' ' CYS . . . . . 0.555 ' H ' ' HG2' ' A' ' 148' ' ' LYS . 69.9 m -55.41 -8.54 0.35 Allowed 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 125.785 1.634 . . . . 0.0 112.359 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 150' ' ' PHE . . . . . 0.443 ' CZ ' ' HB2' ' A' ' 110' ' ' SER . 22.0 m-85 -33.03 -71.41 0.06 Allowed 'General case' 0 CA--C 1.519 -0.229 0 C-N-CA 125.014 1.325 . . . . 0.0 109.408 176.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -113.47 -8.99 13.36 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.111 167.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 34.4 mmt -73.84 -16.6 61.13 Favored 'General case' 0 C--N 1.345 0.401 0 CA-C-N 120.131 1.332 . . . . 0.0 111.713 176.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 2.3 p30 50.03 -2.07 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 127.136 2.174 . . . . 0.0 116.137 -178.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 62.1 tp . . . . . 0 C--O 1.25 1.092 0 CA-C-O 117.18 -1.39 . . . . 0.0 110.173 179.273 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 39.2 t80 . . . . . 0 N--CA 1.475 0.776 0 CA-C-O 120.498 0.189 . . . . 0.0 110.568 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 62.9 p -144.85 153.75 54.44 Favored Pre-proline 0 CA--C 1.529 0.164 0 C-N-CA 123.537 0.735 . . . . 0.0 110.054 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -70.67 160.05 50.7 Favored 'Trans proline' 0 N--CA 1.453 -0.898 0 C-N-CA 123.941 3.094 . . . . 0.0 111.407 -178.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 64.5 p -135.71 165.0 26.58 Favored 'General case' 0 C--O 1.231 0.115 0 C-N-CA 123.46 0.704 . . . . 0.0 109.85 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 159' ' ' SEP . . . . . 0.401 ' HA ' ' HA ' ' B' ' 160' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 160' ' ' PRO . . . . . 0.401 ' HA ' ' HA ' ' B' ' 159' ' ' SEP . 78.4 Cg_endo -76.27 -179.88 28.68 Favored 'Cis proline' 0 N--CA 1.457 -0.675 0 CA-C-N 118.857 0.628 . . . . 0.0 110.743 -5.168 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 38.9 t -68.02 152.47 45.47 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 174.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 162' ' ' TYR . . . . . 0.464 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 17.8 t80 -143.81 132.13 22.03 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 29.2 t -127.59 144.36 50.77 Favored Pre-proline 0 N--CA 1.452 -0.365 0 C-N-CA 123.348 0.659 . . . . 0.0 110.619 177.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -65.54 -7.01 14.91 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 122.888 2.392 . . . . 0.0 111.564 175.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 80.6 p -91.95 22.79 4.05 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.043 0.537 . . . . 0.0 111.975 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -61.14 168.4 7.65 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.306 2.004 . . . . 0.0 111.02 170.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 44.8 m . . . . . 0 C--O 1.252 1.185 0 CA-C-O 117.977 -1.011 . . . . 0.0 111.546 -179.067 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt . . . . . 0 N--CA 1.476 0.85 0 CA-C-O 120.537 0.208 . . . . 0.0 110.641 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -139.08 154.38 48.16 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.114 0.566 . . . . 0.0 110.025 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -153.24 147.68 25.98 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.07 0.548 . . . . 0.0 110.114 179.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -150.67 147.29 27.2 Favored 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 175.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -139.08 26.82 2.41 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 123.131 0.572 . . . . 0.0 110.793 -179.184 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.406 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 16.4 t70 -85.02 -145.06 0.09 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 177.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.406 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 18.1 t80 -55.54 -16.03 3.47 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.351 0.66 . . . . 0.0 111.636 179.205 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -56.04 -43.43 77.84 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.737 0.415 . . . . 0.0 111.018 177.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -63.4 -36.87 85.17 Favored 'General case' 0 C--O 1.227 -0.118 0 CA-C-N 118.321 0.509 . . . . 0.0 110.542 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -65.85 -54.44 26.77 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 117.812 0.278 . . . . 0.0 110.366 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 63.9 t -60.63 -53.73 44.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.03 -32.81 68.33 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 123.453 0.701 . . . . 0.0 112.162 -177.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 88.1 m -73.71 -40.88 63.27 Favored 'General case' 0 C--N 1.338 0.101 0 CA-C-N 118.557 0.617 . . . . 0.0 110.469 176.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.1 tp -66.7 -30.55 70.81 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.957 0.408 . . . . 0.0 110.061 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -72.65 -40.38 66.4 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.03 0.932 . . . . 0.0 109.691 176.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.0 t -62.12 -30.4 71.0 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 174.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.64 -41.53 68.7 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 122.917 0.487 . . . . 0.0 109.89 175.316 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.412 ' HB2' ' HE3' ' A' ' 18' ' ' LYS . 39.1 ttmt -65.05 -28.92 69.81 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 123.821 0.848 . . . . 0.0 111.269 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -69.13 -14.47 63.01 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.758 0.423 . . . . 0.0 112.056 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.2 mt -101.13 167.76 10.02 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.238 0.615 . . . . 0.0 110.521 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -132.74 -0.64 3.47 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.24 0.616 . . . . 0.0 111.519 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 32.2 t -153.59 159.72 42.23 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.195 0.598 . . . . 0.0 109.475 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.29 137.16 2.12 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -178.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.8 mm -118.37 50.65 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.107 0 C-N-CA 124.5 1.12 . . . . 0.0 108.079 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.2 m -49.9 124.55 10.11 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.025 0.53 . . . . 0.0 111.951 -174.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.86 -19.41 63.19 Favored Glycine 0 CA--C 1.525 0.659 0 CA-C-O 119.584 -0.565 . . . . 0.0 112.301 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.426 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 42.0 t -66.31 -39.2 89.14 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.173 0.987 . . . . 0.0 110.169 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.6 mmp_? -60.09 -45.66 92.19 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 58.3 mt -65.65 -34.51 70.84 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.924 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.7 tmtt? -63.02 -43.75 97.85 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 122.084 -0.385 . . . . 0.0 110.466 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.426 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.4 OUTLIER -65.26 -43.73 90.38 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 118.152 0.433 . . . . 0.0 110.705 176.251 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.5 mt -62.17 -57.93 9.65 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 121.261 -0.176 . . . . 0.0 110.875 -178.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.565 HG21 ' HB2' ' A' ' 71' ' ' SER . 51.5 p -56.29 -48.98 75.55 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 178.641 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.3 t -63.44 -44.86 93.32 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 120.021 -0.672 . . . . 0.0 111.6 -174.229 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -76.78 -21.33 55.31 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.07 -56.66 9.09 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 167.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 46.9 mt -68.97 -17.51 63.94 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.524 1.13 . . . . 0.0 113.075 -175.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -59.9 -26.14 65.66 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -178.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -149.04 -28.46 0.28 Allowed 'General case' 0 C--N 1.34 0.154 0 N-CA-C 113.84 1.052 . . . . 0.0 113.84 -175.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.575 HG22 HG22 ' A' ' 93' ' ' THR . 37.9 mm 44.87 74.76 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-O 121.923 0.868 . . . . 0.0 111.605 -179.306 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -147.98 22.41 1.1 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.354 1.062 . . . . 0.0 109.234 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.558 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -148.63 38.83 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.116 0 C-N-CA 124.765 1.226 . . . . 0.0 109.251 -171.176 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.53 ' CD ' ' H ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -52.95 -57.13 11.35 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -174.508 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.53 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 88.4 p -72.67 -26.35 61.6 Favored 'General case' 0 CA--C 1.521 -0.144 0 O-C-N 121.489 -0.757 . . . . 0.0 112.37 -173.293 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.682 ' H ' ' CD ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.18 -44.35 16.53 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 119.189 -0.434 . . . . 0.0 109.932 -179.074 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 38.0 mt -55.48 -50.85 63.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 171.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 15.9 mm -66.92 -51.81 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -176.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 73.8 m -57.68 -33.59 68.52 Favored 'General case' 0 N--CA 1.458 -0.058 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.324 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.1 tp -69.4 -45.41 69.3 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 118.582 -0.723 . . . . 0.0 112.083 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 38.1 pt -71.35 -34.42 53.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 119.63 1.105 . . . . 0.0 111.699 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.532 HD13 HG21 ' A' ' 104' ' ' VAL . 97.7 mt -63.05 -55.49 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.09 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -64.51 -27.12 68.75 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.308 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -62.78 -45.56 92.1 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 175.354 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.7 t -61.2 -43.37 98.99 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.903 0.382 . . . . 0.0 110.154 175.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 14.7 tpp180 -59.31 -44.86 92.51 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.801 0.84 . . . . 0.0 112.698 -176.411 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 70.2 mt -89.66 -15.04 33.54 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 -173.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 72.5 m -100.5 165.28 14.67 Favored Pre-proline 0 CA--C 1.537 0.461 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -172.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.68 177.31 0.24 Allowed 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 125.298 3.998 . . . . 0.0 115.036 -178.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -58.78 -41.47 86.74 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.853 0.861 . . . . 0.0 111.875 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.9 m -60.09 -21.3 61.33 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 177.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -93.55 -20.13 20.54 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 118.848 -0.596 . . . . 0.0 111.141 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.8 mptt -64.49 -46.63 82.15 Favored 'General case' 0 C--N 1.342 0.239 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 167.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -65.15 -52.46 55.01 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.47 -42.51 93.91 Favored Glycine 0 C--N 1.338 0.641 0 N-CA-C 111.581 -0.608 . . . . 0.0 111.581 -179.17 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.9 t -68.83 -34.81 76.11 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 117.735 0.767 . . . . 0.0 110.493 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.4 mt -62.57 -32.45 73.43 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 119.47 1.032 . . . . 0.0 110.818 174.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -73.81 -31.47 63.26 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.845 0.748 . . . . 0.0 111.417 175.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 80.7 mt -72.58 -40.43 62.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 118.622 0.646 . . . . 0.0 110.769 175.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.7 mt -66.63 -35.05 73.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -67.17 -45.47 76.89 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 119.023 -0.513 . . . . 0.0 110.82 176.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.565 ' HB2' HG21 ' A' ' 33' ' ' THR . 79.3 p -66.03 -57.14 8.42 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 118.534 0.606 . . . . 0.0 110.832 -176.275 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 59.3 mt -64.19 -32.07 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.76 -55.87 17.69 Favored Glycine 0 CA--C 1.527 0.796 0 CA-C-O 119.813 -0.437 . . . . 0.0 112.52 178.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.635 HH11 ' HG3' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -66.6 -30.8 71.17 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-N 117.964 0.882 . . . . 0.0 110.561 -178.929 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.03 -44.93 71.72 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 122.574 -0.078 . . . . 0.0 110.828 176.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -64.05 -48.24 77.02 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 177.085 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 57.5 tp -58.26 -47.52 83.33 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 122.834 0.454 . . . . 0.0 110.08 -176.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -64.12 -43.15 96.18 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.407 -0.183 . . . . 0.0 110.599 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -65.18 -34.58 78.71 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -175.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.5 t -94.6 -18.63 21.2 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -177.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -100.42 -24.18 14.56 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 119.027 0.83 . . . . 0.0 112.802 178.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 11.8 t -91.35 -14.05 31.42 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 118.383 0.538 . . . . 0.0 112.196 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -141.07 161.75 37.12 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.549 0.34 . . . . 0.0 110.095 -177.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 92.5 p -147.22 173.24 12.72 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.386 0.674 . . . . 0.0 110.475 -178.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -130.16 27.46 5.1 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 122.852 0.461 . . . . 0.0 110.648 -179.595 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 36.3 m 55.55 27.19 10.01 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.756 0.822 . . . . 0.0 112.707 -178.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 71.0 m -135.66 160.89 37.09 Favored 'General case' 0 C--O 1.23 0.073 0 C-N-CA 123.505 0.722 . . . . 0.0 110.43 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 79.5 p -150.32 173.28 14.17 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.435 0.694 . . . . 0.0 110.508 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 37.4 t30 58.98 -177.79 0.08 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.452 1.101 . . . . 0.0 111.772 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt 50.15 55.17 16.65 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 124.435 1.094 . . . . 0.0 112.161 -179.556 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.02 156.81 64.14 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 123.369 2.712 . . . . 0.0 110.689 -179.168 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 176.27 28.73 0.04 OUTLIER Glycine 0 CA--C 1.525 0.692 0 N-CA-C 111.659 -0.576 . . . . 0.0 111.659 -178.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.575 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -146.4 -155.14 0.59 Allowed 'General case' 0 C--N 1.34 0.189 0 CA-C-N 117.205 0.503 . . . . 0.0 110.868 -175.93 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.6 p -47.37 -31.74 4.27 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -176.38 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.27 -45.61 87.34 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.807 0.73 . . . . 0.0 109.943 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 46.1 t60 -66.87 -29.62 69.57 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 123.482 0.713 . . . . 0.0 109.927 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.17 -43.82 77.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 123.045 0.538 . . . . 0.0 110.548 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.17 -43.58 98.91 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.069 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 174.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -59.53 -33.83 71.87 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.682 -0.236 . . . . 0.0 111.13 178.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.1 m -73.72 -42.05 61.72 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 122.302 -0.249 . . . . 0.0 111.218 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 48.7 mt -60.39 -30.21 69.44 Favored 'General case' 0 C--N 1.339 0.126 0 O-C-N 121.418 -0.802 . . . . 0.0 109.274 173.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.43 -14.91 22.15 Favored Glycine 0 CA--C 1.531 1.076 0 CA-C-O 119.112 -0.827 . . . . 0.0 113.918 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -100.82 -6.92 24.15 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.016 1.408 . . . . 0.0 112.074 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.532 HG21 HD13 ' A' ' 51' ' ' ILE . 27.1 m -123.42 -17.91 4.42 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -177.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.434 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.0 tp -55.22 -26.08 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 CA-C-N 118.246 0.476 . . . . 0.0 111.527 -177.111 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.402 ' HG2' ' H ' ' A' ' 106' ' ' GLN . 16.9 pt20 -61.54 -53.32 57.86 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.379 0.672 . . . . 0.0 111.65 176.39 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -75.55 -34.48 60.73 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 122.002 -0.436 . . . . 0.0 110.912 -178.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 88.9 mt -62.38 -46.94 86.37 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.554 ' O ' HD12 ' A' ' 113' ' ' ILE . 55.9 mt -71.31 -53.95 12.49 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 118.532 -0.747 . . . . 0.0 111.19 179.245 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 69.2 p -55.06 -35.76 64.86 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 119.033 0.833 . . . . 0.0 111.118 -176.072 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -70.1 -48.62 56.87 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-N 118.798 0.726 . . . . 0.0 110.269 173.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.96 -34.39 65.64 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.984 0.914 . . . . 0.0 113.369 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.554 HD12 ' O ' ' A' ' 109' ' ' LEU . 0.2 OUTLIER -84.5 -38.08 13.27 Favored 'Isoleucine or valine' 0 C--N 1.343 0.288 0 C-N-CA 117.482 -1.687 . . . . 0.0 112.667 170.794 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.27 -22.42 66.94 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.881 0.764 . . . . 0.0 110.85 -178.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.04 -17.11 30.02 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.064 0.946 . . . . 0.0 110.995 178.317 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.42 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 53.1 p -85.41 167.57 15.4 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -172.287 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -102.5 177.17 4.94 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 168.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.3 -33.27 63.13 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 118.546 0.612 . . . . 0.0 112.32 -176.747 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -70.63 -49.93 42.36 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 122.03 -0.419 . . . . 0.0 111.312 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.42 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 6.2 m170 -67.56 -34.07 76.31 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-O 119.052 -0.499 . . . . 0.0 110.41 179.454 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.5 ttpt -55.67 -51.94 65.55 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 118.736 0.698 . . . . 0.0 109.204 171.106 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -58.94 -38.96 80.22 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 120.674 -0.411 . . . . 0.0 110.864 -176.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.8 mtpp -63.06 -41.59 99.5 Favored 'General case' 0 N--CA 1.455 -0.187 0 O-C-N 122.338 -0.226 . . . . 0.0 110.955 175.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 97.9 mt -67.65 -36.45 76.13 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 O-C-N 121.863 -0.523 . . . . 0.0 109.595 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -66.26 -32.58 74.08 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 176.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.4 ttt -65.67 -42.68 91.04 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 175.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 89.2 mt -58.99 -43.32 91.46 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.119 175.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.1 mt -65.62 -36.1 82.73 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 117.676 0.216 . . . . 0.0 111.315 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -66.22 -39.74 89.81 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 118.05 0.386 . . . . 0.0 110.51 178.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.4 mt -67.15 -42.76 88.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 N-CA-C 110.321 -0.252 . . . . 0.0 110.321 177.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 48.4 m0 -67.7 -31.27 71.11 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 117.938 0.336 . . . . 0.0 110.872 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -73.38 -36.44 66.06 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 117.516 0.144 . . . . 0.0 110.94 176.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 51.1 tpt85 -70.67 -31.53 68.47 Favored 'General case' 0 CA--C 1.528 0.12 0 O-C-N 122.325 -0.235 . . . . 0.0 111.03 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 69.1 m -82.06 -8.55 59.67 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.966 0.506 . . . . 0.0 111.446 176.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -67.34 164.09 45.08 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 111.762 -0.535 . . . . 0.0 111.762 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 91.2 mt -117.57 9.72 13.25 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.432 0.693 . . . . 0.0 111.133 -178.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 18.4 t80 60.48 147.5 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.918 1.687 . . . . 0.0 113.433 -178.368 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 52.66 11.45 0.19 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.646 1.178 . . . . 0.0 113.756 -177.218 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm -139.22 11.12 2.58 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.591 0.756 . . . . 0.0 111.075 -177.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 50.1 m -140.16 166.78 23.75 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 123.552 0.741 . . . . 0.0 110.584 -178.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -136.26 155.31 50.28 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 123.189 0.596 . . . . 0.0 110.221 -179.281 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 11.2 tp -145.47 3.42 1.0 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.475 -178.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -65.43 -15.87 63.06 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.814 0.846 . . . . 0.0 112.6 -177.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.468 ' C ' ' H ' ' A' ' 146' ' ' ARG . . . -37.83 -40.27 0.43 Allowed 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 126.135 1.774 . . . . 0.0 114.735 -172.504 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.443 HG22 HD11 ' A' ' 113' ' ' ILE . 0.2 OUTLIER -69.39 21.41 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 118.424 0.556 . . . . 0.0 112.077 176.347 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.468 ' H ' ' C ' ' A' ' 144' ' ' ALA . 34.2 mmt180 53.06 19.77 1.51 Allowed 'General case' 0 C--N 1.339 0.121 0 C-N-CA 124.888 1.275 . . . . 0.0 111.183 -169.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 17.7 t 51.54 19.47 0.85 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.642 0.777 . . . . 0.0 112.974 -170.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -85.35 168.62 14.49 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 122.19 0.995 . . . . 0.0 113.102 -176.424 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 73.0 m -55.34 -14.78 2.02 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 114.47 -1.241 . . . . 0.0 111.389 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' PHE . . . . . 0.406 ' HB3' HD13 ' A' ' 113' ' ' ILE . 17.1 m-30 -28.86 -60.86 0.13 Allowed 'General case' 0 C--N 1.343 0.286 0 C-N-CA 126.039 1.736 . . . . 0.0 110.31 176.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 151' ' ' ALA . . . . . 0.417 ' HB2' HG21 ' A' ' 113' ' ' ILE . . . -128.88 -9.54 4.92 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 123.73 0.644 . . . . 0.0 110.929 169.062 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 152' ' ' MET . . . . . 0.408 ' C ' ' H ' ' A' ' 154' ' ' LEU . 31.4 mmt -74.07 -15.6 61.06 Favored 'General case' 0 C--N 1.341 0.212 0 CA-C-N 119.176 0.898 . . . . 0.0 111.027 177.396 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 33.1 t70 56.38 -8.68 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.045 1.738 . . . . 0.0 114.886 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.408 ' H ' ' C ' ' A' ' 152' ' ' MET . 96.1 mt . . . . . 0 C--O 1.252 1.194 0 CA-C-O 116.98 -1.486 . . . . 0.0 110.542 -178.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 87.1 t80 . . . . . 0 N--CA 1.477 0.878 0 CA-C-O 120.478 0.18 . . . . 0.0 110.654 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 63.7 p -149.27 151.93 34.88 Favored Pre-proline 0 CA--C 1.532 0.251 0 C-N-CA 123.423 0.689 . . . . 0.0 109.707 178.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -77.28 -11.47 17.51 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 123.418 2.745 . . . . 0.0 112.261 -178.123 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 48.3 p -144.07 145.83 32.42 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 118.209 0.459 . . . . 0.0 111.056 -177.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -73.2 -179.07 23.71 Favored 'Cis proline' 0 N--CA 1.451 -1.001 0 N-CA-C 110.119 -0.762 . . . . 0.0 110.119 -8.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 36.5 t -69.12 156.83 38.02 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 176.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 162' ' ' TYR . . . . . 0.418 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 13.0 t80 -145.99 131.89 19.14 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.575 0.35 . . . . 0.0 110.988 -179.17 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 31.2 t -119.65 128.83 25.69 Favored Pre-proline 0 N--CA 1.452 -0.329 0 C-N-CA 122.95 0.5 . . . . 0.0 110.153 175.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.15 -16.25 48.41 Favored 'Trans proline' 0 N--CA 1.449 -1.091 0 C-N-CA 122.64 2.227 . . . . 0.0 109.696 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 2.1 m -69.39 -9.14 52.17 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.972 0.909 . . . . 0.0 112.47 -175.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 166' ' ' SEP . . . . . 0.423 ' HA ' ' HD2' ' B' ' 167' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 167' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' B' ' 166' ' ' SEP . 29.8 Cg_endo -55.17 154.79 21.54 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 123.222 2.615 . . . . 0.0 111.94 170.703 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 C--O 1.25 1.125 0 CA-C-O 117.347 -1.311 . . . . 0.0 111.406 -177.193 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.475 0.781 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.1 pm0 -140.59 6.3 2.06 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 122.673 0.389 . . . . 0.0 112.007 -178.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 -94.02 151.34 19.59 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -144.48 158.76 43.6 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.522 0.329 . . . . 0.0 110.873 -178.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -142.33 20.94 2.06 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.623 0.769 . . . . 0.0 111.384 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -83.51 -144.34 0.07 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.054 0.941 . . . . 0.0 109.61 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -55.18 -14.38 1.67 Allowed 'General case' 0 C--N 1.339 0.111 0 C-N-CA 123.483 0.713 . . . . 0.0 111.507 178.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -54.56 -42.88 71.5 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.264 0.626 . . . . 0.0 110.481 177.04 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 56.1 m-20 -55.91 -46.35 78.42 Favored 'General case' 0 C--O 1.227 -0.104 0 CA-C-N 118.285 0.493 . . . . 0.0 110.51 177.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -65.98 -50.03 65.74 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 117.777 0.262 . . . . 0.0 110.591 -176.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.8 t -63.72 -54.6 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 -178.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.89 -32.72 67.99 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.069 0.548 . . . . 0.0 111.897 -178.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 80.0 m -73.02 -41.46 64.21 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 118.312 0.505 . . . . 0.0 110.525 177.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.2 tp -66.12 -32.7 74.31 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.086 0.47 . . . . 0.0 110.097 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -68.58 -43.49 76.41 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.967 0.907 . . . . 0.0 109.616 175.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 65.4 m -64.39 -26.36 68.43 Favored 'General case' 0 C--O 1.227 -0.105 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 175.231 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.423 ' CE2' HD11 ' A' ' 68' ' ' ILE . 0.1 OUTLIER -71.81 -40.55 69.06 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 175.574 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -64.93 -32.63 74.44 Favored 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 176.123 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -76.31 -14.55 60.1 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.863 0.465 . . . . 0.0 111.762 176.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 57.5 tp -92.18 150.48 20.89 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.011 0.524 . . . . 0.0 110.482 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -150.13 163.4 38.3 Favored 'General case' 0 CA--C 1.523 -0.082 0 C-N-CA 123.388 0.675 . . . . 0.0 110.22 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 29.9 m 52.28 29.44 6.71 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.377 0.671 . . . . 0.0 112.782 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -177.97 135.76 2.8 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.452 -1.059 . . . . 0.0 110.452 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 19.7 mm -111.71 58.35 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.109 0 C-N-CA 124.659 1.184 . . . . 0.0 107.982 178.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.0 m -50.56 127.99 19.18 Favored 'General case' 0 CA--C 1.522 -0.099 0 C-N-CA 122.954 0.502 . . . . 0.0 111.641 -174.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.55 -20.11 67.59 Favored Glycine 0 CA--C 1.526 0.758 0 CA-C-O 119.098 -0.834 . . . . 0.0 112.546 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.428 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 40.3 t -66.05 -37.19 85.23 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 118.801 1.3 . . . . 0.0 110.059 -178.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.5 mmp_? -61.99 -49.0 77.83 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 176.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.6 mt -61.5 -38.53 80.33 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.883 -179.198 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -65.76 -38.96 90.51 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 118.954 -0.546 . . . . 0.0 111.291 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.1 OUTLIER -66.61 -41.38 88.51 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 119.279 0.945 . . . . 0.0 110.238 175.52 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.2 mt -62.0 -57.47 11.55 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 119.55 -0.262 . . . . 0.0 111.042 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.527 HG21 ' HB2' ' A' ' 71' ' ' SER . 66.6 p -56.85 -42.46 79.74 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 118.228 0.467 . . . . 0.0 111.707 177.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.7 m -55.44 -56.27 22.1 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 119.234 -0.413 . . . . 0.0 110.873 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -69.35 -32.72 71.97 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 118.524 -1.27 . . . . 0.0 111.815 -175.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.29 -58.4 8.78 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 174.267 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.7 mt -71.36 -15.81 62.4 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.711 0.804 . . . . 0.0 112.697 -174.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -61.09 -28.42 69.07 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 25.0 t60 -150.76 -24.37 0.22 Allowed 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -175.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.5 HG22 HG22 ' A' ' 93' ' ' THR . 30.3 mm 46.65 74.67 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-O 121.645 0.736 . . . . 0.0 111.522 -178.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -147.62 21.16 1.17 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.898 0.879 . . . . 0.0 109.918 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.555 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.01 37.76 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.087 0 C-N-CA 124.331 1.052 . . . . 0.0 109.365 -171.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.467 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -53.2 -54.19 39.67 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -174.676 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 81.0 p -75.22 -28.42 59.92 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -173.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.703 ' H ' ' CD ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -79.44 -45.41 19.5 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -179.247 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 24.4 mt -56.11 -51.76 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 172.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.431 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 11.7 mm -66.17 -50.83 65.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-O 119.02 -0.514 . . . . 0.0 112.124 -176.291 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 63.6 m -58.03 -33.55 69.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 119.198 0.908 . . . . 0.0 110.558 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 54.1 tp -70.06 -43.36 71.37 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 36.5 pt -73.24 -35.48 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-N 119.588 1.086 . . . . 0.0 111.927 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.475 HD13 HG21 ' A' ' 104' ' ' VAL . 96.8 mt -64.02 -52.37 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 178.079 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.411 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 37.3 t70 -62.39 -30.53 71.27 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.286 178.252 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -61.37 -42.51 98.82 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 175.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.1 t -68.39 -35.73 78.1 Favored 'General case' 0 C--N 1.338 0.098 0 O-C-N 122.097 -0.377 . . . . 0.0 110.701 175.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.411 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 8.3 tpt180 -64.82 -42.24 95.12 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.925 0.89 . . . . 0.0 113.056 -174.762 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 79.6 mt -91.24 -14.31 31.19 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -174.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 71.1 m -106.1 155.53 38.32 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -170.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.69 -174.95 0.79 Allowed 'Trans proline' 0 N--CA 1.459 -0.52 1 C-N-CA 125.788 4.325 . . . . 0.0 113.823 -179.422 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -53.77 -45.1 70.54 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 125.732 1.613 . . . . 0.0 114.738 -170.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 73.3 m -61.21 -27.33 68.36 Favored 'General case' 0 CA--C 1.523 -0.06 0 CA-C-N 118.484 0.584 . . . . 0.0 110.152 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 24.0 m170 -91.58 -16.99 26.29 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.263 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -66.09 -47.57 73.79 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 169.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 58.4 tp -66.86 -48.64 68.17 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.449 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.11 -46.45 92.67 Favored Glycine 0 C--N 1.338 0.643 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.8 t -62.65 -45.22 93.85 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 117.495 0.647 . . . . 0.0 110.069 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 25.2 mt -54.22 -41.18 68.37 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 119.162 0.892 . . . . 0.0 110.774 176.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -68.31 -27.0 65.91 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.028 0.831 . . . . 0.0 111.263 178.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.423 HD11 ' CE2' ' A' ' 17' ' ' PHE . 72.0 mt -75.12 -44.4 43.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 CA-C-N 118.247 0.476 . . . . 0.0 111.23 174.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 1.6 mp -60.33 -34.69 58.49 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 175.437 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.425 ' CG ' HH22 ' A' ' 74' ' ' ARG . 38.3 t70 -71.53 -45.4 62.47 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.744 1.218 . . . . 0.0 111.584 -178.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.527 ' HB2' HG21 ' A' ' 33' ' ' THR . 65.8 p -67.29 -56.04 11.42 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 119.009 0.822 . . . . 0.0 110.478 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 49.2 mt -63.37 -32.27 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.6 -55.68 21.44 Favored Glycine 0 CA--C 1.525 0.677 0 CA-C-O 119.65 -0.528 . . . . 0.0 112.02 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.436 ' HD3' ' HD3' ' B' ' 167' ' ' PRO . 5.1 ptp85 -67.14 -32.85 74.24 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 118.086 0.943 . . . . 0.0 110.658 -178.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.87 -44.7 69.26 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 121.514 -0.074 . . . . 0.0 110.803 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.2 m-30 -62.45 -47.93 81.86 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 176.543 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -59.17 -47.76 84.12 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 123.344 0.402 . . . . 0.0 110.144 -176.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -62.27 -47.74 83.01 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 120.515 0.198 . . . . 0.0 110.651 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -66.11 -38.04 87.23 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 121.039 -0.264 . . . . 0.0 111.591 -175.275 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 6.2 t -82.61 -19.42 38.41 Favored 'General case' 0 C--O 1.226 -0.138 0 CA-C-N 118.108 0.413 . . . . 0.0 111.592 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 79.8 ttt-85 -85.12 -27.15 26.43 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-N 117.978 0.354 . . . . 0.0 111.351 174.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 68.2 m -71.61 -14.77 62.17 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -178.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -147.61 158.36 43.97 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.668 0.667 . . . . 0.0 110.557 -178.055 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 53.4 m -143.14 159.61 41.96 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.18 0.592 . . . . 0.0 110.921 -178.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 54.3 t-20 -149.83 149.06 29.93 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.109 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.1 m -138.79 15.54 2.69 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 123.284 0.634 . . . . 0.0 111.577 -176.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 29.8 t -132.58 160.81 35.53 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 122.569 0.348 . . . . 0.0 111.161 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 43.5 m 58.6 161.83 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.77 1.628 . . . . 0.0 113.744 -177.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -80.44 148.0 30.71 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -156.17 156.16 29.98 Favored Pre-proline 0 CA--C 1.531 0.231 0 C-N-CA 122.602 0.361 . . . . 0.0 111.254 -176.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -71.47 171.99 15.12 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 123.796 2.997 . . . . 0.0 110.487 174.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -73.24 -30.81 62.23 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 111.759 -0.536 . . . . 0.0 111.759 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.5 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER 47.57 -158.78 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.646 1.178 . . . . 0.0 114.07 176.668 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.6 p -52.52 -28.88 22.44 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.162 0.985 . . . . 0.0 113.546 -176.219 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.11 -46.17 88.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.819 0.736 . . . . 0.0 109.758 176.274 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 9.4 m170 -73.38 -24.28 60.29 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.506 178.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.431 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -63.67 -46.45 85.5 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 175.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.1 mt -64.46 -44.24 96.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.171 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 176.35 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -58.17 -36.39 72.98 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 122.516 -0.115 . . . . 0.0 111.042 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.3 m -74.04 -41.03 62.41 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-O 119.626 -0.226 . . . . 0.0 111.482 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.4 mt -60.36 -30.21 69.41 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.824 0.738 . . . . 0.0 109.348 174.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.0 -15.44 21.13 Favored Glycine 0 CA--C 1.528 0.861 0 CA-C-O 119.222 -0.765 . . . . 0.0 113.967 179.103 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -101.3 -6.02 24.68 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.01 1.405 . . . . 0.0 112.28 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.475 HG21 HD13 ' A' ' 51' ' ' ILE . 35.0 m -123.02 -16.72 5.14 Favored 'Isoleucine or valine' 0 C--N 1.339 0.135 0 C-N-CA 122.941 0.496 . . . . 0.0 112.005 -178.163 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.44 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.6 tp -52.2 -26.34 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 122.884 0.474 . . . . 0.0 111.58 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.2 pt20 -63.89 -48.03 78.25 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.037 0.535 . . . . 0.0 111.57 178.017 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -79.39 -31.39 42.78 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 118.107 0.412 . . . . 0.0 110.721 -178.485 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.0 mp -61.67 -53.3 57.93 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.547 HD12 ' CB ' ' A' ' 144' ' ' ALA . 85.5 mt -66.07 -56.72 10.13 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 118.621 -0.704 . . . . 0.0 110.389 178.18 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 80.9 p -54.02 -40.57 67.15 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 119.238 0.926 . . . . 0.0 112.229 -174.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -71.04 -47.04 60.82 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 119.465 1.029 . . . . 0.0 110.357 176.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.22 -37.92 72.95 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 118.949 -0.548 . . . . 0.0 111.904 -177.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.419 HG21 ' HB2' ' A' ' 151' ' ' ALA . 0.0 OUTLIER -82.92 -33.93 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 119.058 0.845 . . . . 0.0 111.925 177.041 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.84 -28.22 67.37 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 119.789 -0.764 . . . . 0.0 111.028 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.21 -14.76 45.82 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.466 0.707 . . . . 0.0 111.053 177.368 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.41 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 32.4 p -74.39 159.57 32.16 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 -171.657 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.1 t-20 -96.25 174.39 6.91 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 169.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -55.42 -43.58 75.45 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.231 0.923 . . . . 0.0 111.507 -176.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -66.01 -40.78 91.38 Favored 'General case' 0 CA--C 1.527 0.093 0 O-C-N 121.856 -0.528 . . . . 0.0 110.529 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.41 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 40.2 m80 -69.94 -38.77 76.28 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.376 -0.345 . . . . 0.0 110.996 -178.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -39.3 90.14 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 174.295 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -66.06 -38.35 88.1 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.563 -178.057 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -64.33 -42.79 96.11 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 121.071 -0.251 . . . . 0.0 111.013 175.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.7 mt -67.17 -34.81 71.8 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -66.54 -36.06 81.76 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 122.75 0.42 . . . . 0.0 110.454 176.637 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.3 ttt -65.56 -42.13 92.16 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 109.668 -0.494 . . . . 0.0 109.668 176.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.41 HD23 ' C ' ' A' ' 127' ' ' LEU . 7.2 tt -58.05 -49.9 75.28 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 176.635 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.79 -30.29 69.69 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 122.264 -0.273 . . . . 0.0 111.715 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -67.01 -37.83 84.88 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 118.144 0.429 . . . . 0.0 110.058 177.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 95.6 mt -69.13 -39.97 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 176.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 20.0 m0 -63.52 -30.6 71.7 Favored 'General case' 0 CA--C 1.531 0.226 0 O-C-N 122.181 -0.324 . . . . 0.0 110.624 176.258 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -75.62 -36.07 60.33 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 117.876 0.307 . . . . 0.0 111.11 176.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 93.5 mtt-85 -71.96 -22.79 61.4 Favored 'General case' 0 C--N 1.337 0.065 0 O-C-N 122.165 -0.334 . . . . 0.0 111.076 176.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 23.0 t -61.44 -22.63 65.21 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.131 0.172 . . . . 0.0 111.145 176.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 160.86 152.48 6.61 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.855 -0.498 . . . . 0.0 111.855 177.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -97.47 -3.75 39.37 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.93 0.492 . . . . 0.0 110.308 178.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -143.06 164.69 29.42 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.671 0.788 . . . . 0.0 109.443 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 54.5 -162.61 0.13 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.315 0.646 . . . . 0.0 110.918 -177.227 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 95.5 mttt 55.05 25.19 6.72 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.616 0.766 . . . . 0.0 112.443 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 50.3 m 58.52 171.82 0.06 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.795 1.238 . . . . 0.0 113.37 -177.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 27.9 p90 -81.02 161.19 24.33 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.112 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.521 HD23 ' H ' ' A' ' 142' ' ' LEU . 1.8 pt? -140.65 15.62 2.34 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 123.418 0.687 . . . . 0.0 111.475 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -62.35 -14.75 43.07 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 -177.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.547 ' CB ' HD12 ' A' ' 109' ' ' LEU . . . 10.47 -76.34 0.0 OUTLIER 'General case' 0 C--N 1.342 0.28 0 C-N-CA 128.401 2.681 . . . . 0.0 115.566 177.075 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.446 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -65.9 18.39 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 C-N-CA 125.534 1.534 . . . . 0.0 112.588 179.958 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.482 ' H ' ' C ' ' A' ' 144' ' ' ALA . 23.0 mmt85 51.67 25.21 2.72 Favored 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 124.805 1.242 . . . . 0.0 110.903 -171.402 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 10.8 t 54.24 22.56 3.71 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.806 0.842 . . . . 0.0 113.172 -174.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -85.01 -175.91 5.97 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 122.35 1.071 . . . . 0.0 113.124 -177.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 85.2 m -52.43 -17.12 1.07 Allowed 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.774 1.23 . . . . 0.0 113.997 -173.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -33.06 -68.44 0.1 Allowed 'General case' 0 C--N 1.339 0.125 0 C-N-CA 124.414 1.085 . . . . 0.0 110.377 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' ALA . . . . . 0.419 ' HB2' HG21 ' A' ' 113' ' ' ILE . . . -112.24 -14.56 13.34 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 118.948 -0.549 . . . . 0.0 111.218 167.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 152' ' ' MET . . . . . 0.418 ' N ' ' SD ' ' A' ' 152' ' ' MET . 0.6 OUTLIER -84.49 1.54 45.16 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -175.605 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -56.55 -27.0 56.58 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 119.073 0.851 . . . . 0.0 110.816 173.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 59.4 tp . . . . . 0 C--O 1.252 1.209 0 CA-C-O 117.444 -1.265 . . . . 0.0 109.015 177.203 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 51.8 p90 . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 120.386 0.136 . . . . 0.0 110.684 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 70.6 p -143.82 156.03 59.28 Favored Pre-proline 0 CA--C 1.532 0.278 0 C-N-CA 123.195 0.598 . . . . 0.0 110.567 -179.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_endo -70.31 159.04 54.37 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 123.622 2.881 . . . . 0.0 111.413 179.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 61.4 p -142.51 157.06 45.14 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.453 0.701 . . . . 0.0 110.186 -178.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 160' ' ' PRO . . . . . 0.409 ' HD2' ' N ' ' A' ' 27' ' ' SER . 85.3 Cg_endo -72.28 -175.35 13.58 Favored 'Cis proline' 0 N--CA 1.456 -0.68 0 N-CA-C 109.509 -0.997 . . . . 0.0 109.509 -11.498 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 67.9 p -72.83 157.29 37.77 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.675 0.274 . . . . 0.0 111.12 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 162' ' ' TYR . . . . . 0.411 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 4.2 t80 -144.25 129.62 18.87 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 123.338 0.655 . . . . 0.0 109.771 178.318 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 28.8 t -125.65 138.16 31.37 Favored Pre-proline 0 N--CA 1.454 -0.246 0 C-N-CA 123.144 0.577 . . . . 0.0 111.512 -177.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -67.83 -1.59 7.11 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 123.556 2.837 . . . . 0.0 111.44 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 57.2 p -76.13 -12.78 60.17 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.673 -0.68 . . . . 0.0 112.145 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 167' ' ' PRO . . . . . 0.436 ' HD3' ' HD3' ' A' ' 74' ' ' ARG . 52.2 Cg_endo -62.69 168.17 10.55 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 124.035 3.157 . . . . 0.0 111.792 171.605 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 40.5 m . . . . . 0 C--O 1.25 1.086 0 CA-C-O 117.712 -1.137 . . . . 0.0 111.413 179.154 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.2 mtp . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 110.476 -0.194 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -143.29 151.57 40.67 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.451 0.701 . . . . 0.0 109.396 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -79.71 162.5 25.16 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 122.514 0.326 . . . . 0.0 111.166 -178.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -86.08 161.33 18.96 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 122.721 0.409 . . . . 0.0 110.181 178.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 52.29 25.16 3.23 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.946 0.899 . . . . 0.0 112.466 -175.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.424 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 27.2 t70 -80.82 -153.57 0.09 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.554 0.742 . . . . 0.0 109.182 176.67 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.424 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 19.9 t80 -55.79 -14.44 2.34 Favored 'General case' 0 CA--C 1.532 0.28 0 O-C-N 121.721 -0.612 . . . . 0.0 111.484 178.27 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.8 tp60 -54.25 -40.23 67.57 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.678 0.791 . . . . 0.0 110.877 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -63.42 -39.48 94.6 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 118.779 0.718 . . . . 0.0 110.703 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.1 t80 -64.6 -54.3 34.18 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 118.464 0.575 . . . . 0.0 109.795 179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.6 t -59.57 -55.67 22.32 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.145 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 -178.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.1 -33.17 67.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.507 0.723 . . . . 0.0 112.197 -178.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 60.2 m -70.73 -44.97 65.74 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.705 0.684 . . . . 0.0 110.33 176.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.7 tp -65.36 -33.72 76.63 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.235 0.54 . . . . 0.0 110.071 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -66.34 -46.87 75.31 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.49 0.716 . . . . 0.0 109.757 177.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 61.6 m -63.86 -26.52 68.65 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -69.54 -45.7 68.17 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 177.123 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 15.7 pttm -77.9 -25.4 48.44 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -177.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -72.15 -16.48 61.98 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.2 mt -141.87 169.04 18.33 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.132 0.573 . . . . 0.0 110.687 -176.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -84.54 154.33 22.72 Favored 'General case' 0 N--CA 1.457 -0.117 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 174.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 47.9 t -152.3 150.87 30.23 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 120.879 0.371 . . . . 0.0 111.088 -178.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -85.72 31.7 3.87 Favored Glycine 0 CA--C 1.529 0.91 0 N-CA-C 110.679 -0.968 . . . . 0.0 110.679 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.5 mm 58.89 37.29 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 124.134 0.973 . . . . 0.0 110.408 -173.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.4 t -57.12 136.21 56.38 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.963 0.411 . . . . 0.0 111.146 -177.259 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -71.95 -22.18 78.84 Favored Glycine 0 CA--C 1.524 0.643 0 CA-C-O 119.072 -0.849 . . . . 0.0 114.601 -170.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 79.7 p -64.39 -38.7 91.96 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 119.384 1.592 . . . . 0.0 111.635 -174.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.6 mpt_? -65.69 -40.74 92.66 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 42.4 mt -64.89 -36.07 76.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 178.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.3 mmtt -65.35 -39.87 92.89 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.606 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.36 -48.57 77.39 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 118.746 0.703 . . . . 0.0 110.382 174.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.1 mt -59.66 -59.16 5.88 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 122.293 -0.255 . . . . 0.0 110.872 -178.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 59.4 p -55.67 -47.62 76.4 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.8 t -63.9 -43.04 97.2 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.528 -176.186 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -74.56 -22.78 58.81 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.695 0.68 . . . . 0.0 112.811 -178.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.5 -56.46 9.45 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.895 0.77 . . . . 0.0 109.545 167.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 65.6 mt -69.88 -14.89 62.95 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.931 0.892 . . . . 0.0 113.076 -175.187 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -55.81 -30.59 61.61 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -178.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.9 t-80 -151.9 -23.61 0.19 Allowed 'General case' 0 C--N 1.34 0.174 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -176.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 41.1 mm 46.18 73.51 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 121.941 0.877 . . . . 0.0 111.446 -178.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -136.63 9.33 3.11 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.272 1.029 . . . . 0.0 109.207 177.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.536 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -142.97 111.77 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 C-N-CA 125.125 1.37 . . . . 0.0 107.692 -177.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.471 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -108.13 -64.05 1.26 Allowed 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.686 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 74.0 p -68.75 -24.15 64.41 Favored 'General case' 0 CA--C 1.521 -0.15 0 C-N-CA 123.096 0.558 . . . . 0.0 111.909 -173.022 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.617 ' HD2' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -74.82 -53.72 8.61 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.995 0.918 . . . . 0.0 109.143 179.715 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.419 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 10.1 mt -57.22 -47.08 84.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 C-N-CA 123.129 0.572 . . . . 0.0 110.165 175.256 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.424 HD13 ' HA ' ' A' ' 47' ' ' ILE . 12.7 mm -69.47 -46.95 74.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-O 119.067 -0.492 . . . . 0.0 111.652 -176.688 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.0 m -61.31 -33.4 73.52 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 119.318 -0.953 . . . . 0.0 109.891 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.6 tp -68.07 -44.97 75.1 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 119.183 -0.437 . . . . 0.0 112.037 -178.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.5 pt -73.51 -35.69 45.86 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-N 119.207 0.912 . . . . 0.0 111.871 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.475 HD13 HG21 ' A' ' 104' ' ' VAL . 96.0 mt -64.29 -49.34 81.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 178.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -58.32 -40.8 83.01 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.777 177.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -57.68 -42.46 83.65 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 175.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.0 t -65.41 -47.05 77.61 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -75.48 -24.74 56.96 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -174.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 53.6 mt -81.53 -15.44 54.85 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 178.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.403 ' HB3' ' CG ' ' A' ' 61' ' ' HIS . 74.4 m -120.78 153.77 57.12 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -171.65 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -74.23 -169.54 0.6 Allowed 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 125.178 3.919 . . . . 0.0 114.26 -175.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -35.02 -59.99 0.48 Allowed 'General case' 0 C--O 1.236 0.345 0 C-N-CA 128.258 2.623 . . . . 0.0 115.787 -172.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.8 p -59.79 -26.29 65.61 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 122.309 -0.245 . . . . 0.0 110.987 -175.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.403 ' CG ' ' HB3' ' A' ' 57' ' ' CYS . 40.0 m80 -89.6 -18.87 25.73 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 119.625 -0.226 . . . . 0.0 110.946 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -66.04 -49.1 68.9 Favored 'General case' 0 C--N 1.343 0.322 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 171.119 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.5 mt -67.27 -44.6 78.91 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.502 178.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.71 -50.88 61.67 Favored Glycine 0 C--N 1.335 0.504 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 9.9 t -65.75 -36.88 84.83 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 118.749 -0.644 . . . . 0.0 110.963 -178.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 66' ' ' LEU . 36.2 mt -60.99 -39.11 88.38 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 119.655 1.116 . . . . 0.0 111.635 176.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -72.21 -31.67 66.07 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.349 0.977 . . . . 0.0 111.094 177.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 64.3 mt -71.91 -47.63 54.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 O-C-N 121.895 -0.503 . . . . 0.0 110.529 177.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.4 mt -59.84 -37.19 70.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.179 0 C-N-CA 124.258 1.023 . . . . 0.0 109.213 176.063 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -66.19 -47.48 73.79 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 118.987 -0.53 . . . . 0.0 110.868 178.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.8 t -64.52 -53.73 43.4 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 118.615 0.643 . . . . 0.0 111.129 -176.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 57.2 mt -63.27 -34.2 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 179.08 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.06 -51.35 39.78 Favored Glycine 0 CA--C 1.526 0.734 0 CA-C-O 119.823 -0.432 . . . . 0.0 112.492 -178.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.635 ' CG ' HH11 ' A' ' 74' ' ' ARG . 0.0 OUTLIER -71.17 -31.46 67.68 Favored 'General case' 0 C--N 1.338 0.085 0 CA-C-N 117.996 0.898 . . . . 0.0 111.008 -178.894 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.87 -43.84 74.51 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 176.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.0 m-30 -62.38 -45.89 91.12 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 175.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.11 -46.57 87.99 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 123.358 0.411 . . . . 0.0 110.287 -176.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -64.18 -45.17 89.56 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.598 0.237 . . . . 0.0 110.565 178.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -62.75 -39.51 94.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -175.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.6 t -84.33 -28.08 27.31 Favored 'General case' 0 C--O 1.232 0.148 0 O-C-N 122.093 -0.38 . . . . 0.0 111.8 -177.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -78.13 -19.9 53.17 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-N 118.412 0.551 . . . . 0.0 111.523 175.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 73.9 m -69.02 -14.44 63.04 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 117.853 0.297 . . . . 0.0 111.235 174.094 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -106.26 162.34 13.75 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.131 0.572 . . . . 0.0 110.232 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 48.8 m -67.99 158.8 32.02 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.906 0.483 . . . . 0.0 110.808 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -71.59 148.84 46.23 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 86.1 p -155.06 170.35 21.98 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 123.37 0.668 . . . . 0.0 110.24 -179.212 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.3 m -136.99 154.71 50.34 Favored 'General case' 0 N--CA 1.458 -0.068 0 C-N-CA 122.826 0.45 . . . . 0.0 110.722 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.4 m -144.61 159.32 42.99 Favored 'General case' 0 N--CA 1.458 -0.051 0 C-N-CA 123.289 0.636 . . . . 0.0 110.15 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 68.2 m-20 -87.68 -9.52 53.91 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 119.579 -0.248 . . . . 0.0 111.417 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -143.32 153.1 58.97 Favored Pre-proline 0 CA--C 1.531 0.229 0 C-N-CA 123.507 0.723 . . . . 0.0 109.99 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -59.74 157.81 31.21 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 123.892 3.061 . . . . 0.0 112.504 176.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 175.48 148.57 6.88 Favored Glycine 0 CA--C 1.528 0.856 0 CA-C-O 121.119 0.288 . . . . 0.0 112.831 176.14 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.408 ' HA ' ' HB3' ' A' ' 43' ' ' GLU . 0.6 OUTLIER 52.55 -175.82 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 176.782 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.0 p -50.22 -32.85 17.63 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.475 1.51 . . . . 0.0 114.813 -172.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.54 -47.0 87.54 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.225 0.921 . . . . 0.0 109.799 177.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 55.3 m-70 -78.15 -17.37 56.93 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.235 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.75 -44.67 80.87 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 173.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.6 mt -63.61 -44.35 98.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.187 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -57.78 -35.28 70.58 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.981 -0.099 . . . . 0.0 111.154 178.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.9 m -74.39 -41.77 60.39 Favored 'General case' 0 C--N 1.339 0.15 0 O-C-N 122.291 -0.256 . . . . 0.0 111.309 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 52.1 mt -60.28 -30.15 69.28 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 174.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.44 -14.63 28.31 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-O 119.08 -0.844 . . . . 0.0 113.641 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -100.81 -4.76 27.32 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.95 1.375 . . . . 0.0 112.075 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.475 HG21 HD13 ' A' ' 51' ' ' ILE . 34.5 m -124.48 -21.8 2.68 Favored 'Isoleucine or valine' 0 C--N 1.338 0.086 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -178.092 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.414 ' HA ' HD12 ' A' ' 105' ' ' ILE . 11.0 tp -52.83 -26.67 11.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 123.277 0.631 . . . . 0.0 112.294 -175.832 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.2 pt20 -62.85 -45.2 93.7 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 122.942 0.497 . . . . 0.0 111.255 177.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -74.01 -39.2 63.77 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.091 0.472 . . . . 0.0 110.132 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 68.8 mt -62.05 -50.49 71.77 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.459 -177.087 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.46 HD12 ' CB ' ' A' ' 144' ' ' ALA . 66.2 mt -65.63 -56.79 10.32 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.286 176.355 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 87.5 p -50.66 -41.65 55.65 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 119.181 0.9 . . . . 0.0 111.893 -174.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -70.74 -50.79 32.36 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 118.791 0.723 . . . . 0.0 111.148 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.483 ' O ' ' HE3' ' A' ' 115' ' ' LYS . . . -56.24 -32.4 64.42 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.599 0.76 . . . . 0.0 112.855 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.48 HG21 ' HB2' ' A' ' 151' ' ' ALA . 0.0 OUTLIER -84.85 -38.35 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 CA-C-N 119.673 1.124 . . . . 0.0 111.788 174.772 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.25 -26.44 65.68 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 121.956 -0.465 . . . . 0.0 111.186 -179.362 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.483 ' HE3' ' O ' ' A' ' 112' ' ' ALA . 0.2 OUTLIER -80.73 -21.01 41.54 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.13 0.572 . . . . 0.0 110.075 177.414 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.3 m -80.93 169.86 17.0 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 122.063 0.935 . . . . 0.0 113.494 -173.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -105.78 -176.89 3.21 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 114.124 -1.398 . . . . 0.0 107.262 169.187 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' GLN . . . . . 0.42 ' O ' ' HE2' ' A' ' 121' ' ' LYS . 50.4 mm-40 -55.97 -35.91 67.25 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.789 -0.569 . . . . 0.0 112.031 -177.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -71.36 -49.6 40.61 Favored 'General case' 0 N--CA 1.456 -0.173 0 O-C-N 121.932 -0.48 . . . . 0.0 111.475 -177.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 49.4 m-70 -69.39 -34.6 74.75 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 122.191 -0.318 . . . . 0.0 110.679 -179.262 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.42 ' HE2' ' O ' ' A' ' 118' ' ' GLN . 4.7 ttpt -56.67 -48.35 77.8 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 108.301 -0.999 . . . . 0.0 108.301 171.349 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -59.56 -39.73 85.0 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.919 -176.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -60.72 -44.37 96.69 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.28 175.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.8 mt -68.35 -34.26 64.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-O 120.757 0.313 . . . . 0.0 110.164 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 69.6 ttt-85 -69.66 -35.33 75.08 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.077 0.551 . . . . 0.0 109.908 178.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 62.8 ttp -68.37 -38.8 81.73 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 176.029 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.6 tt -58.95 -45.75 89.7 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 81.6 mt -66.31 -34.27 77.61 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 177.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -67.34 -33.41 75.2 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 118.205 0.457 . . . . 0.0 110.446 178.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 97.9 mt -74.8 -34.53 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 25.0 m0 -67.99 -30.8 70.16 Favored 'General case' 0 N--CA 1.456 -0.156 0 O-C-N 121.832 -0.543 . . . . 0.0 110.004 174.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -72.26 -36.42 69.02 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 175.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -63.03 -36.55 83.93 Favored 'General case' 0 C--N 1.342 0.246 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 174.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 49.4 m -75.32 -7.77 54.87 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.495 0.718 . . . . 0.0 111.884 178.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -67.55 164.62 45.1 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.929 -0.468 . . . . 0.0 111.929 -178.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 96.2 mt -134.59 178.54 6.92 Favored 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 124.179 0.992 . . . . 0.0 109.497 -178.022 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -64.21 -16.85 62.84 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.576 0.351 . . . . 0.0 111.243 178.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -81.38 -3.44 52.77 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.142 0.577 . . . . 0.0 111.2 177.188 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 59.7 mttp 60.12 166.33 0.07 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.815 1.646 . . . . 0.0 113.673 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 50.4 m -145.94 162.24 38.25 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.822 0.849 . . . . 0.0 109.9 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -88.2 130.33 35.09 Favored 'General case' 0 N--CA 1.457 -0.101 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 179.202 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 95.5 mt -142.3 3.12 1.52 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.541 0.736 . . . . 0.0 111.258 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 -70.92 -4.24 23.49 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -177.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.46 ' CB ' HD12 ' A' ' 109' ' ' LEU . . . -37.47 -37.94 0.22 Allowed 'General case' 0 C--N 1.34 0.184 0 C-N-CA 126.467 1.907 . . . . 0.0 114.249 -177.686 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -70.11 25.02 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 122.866 0.466 . . . . 0.0 111.825 175.679 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.46 ' H ' ' C ' ' A' ' 144' ' ' ALA . 75.8 mtp180 51.94 18.78 0.85 Allowed 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 125.205 1.402 . . . . 0.0 111.287 -171.011 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 11.1 t 51.77 24.83 2.62 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.563 0.745 . . . . 0.0 112.508 -171.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -112.17 -176.54 2.95 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 122.257 1.027 . . . . 0.0 113.505 -174.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' CYS . . . . . 0.424 ' O ' ' C ' ' A' ' 150' ' ' PHE . 50.0 t -41.25 -38.2 1.1 Allowed 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 126.173 1.789 . . . . 0.0 113.389 -174.014 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 150' ' ' PHE . . . . . 0.424 ' C ' ' O ' ' A' ' 149' ' ' CYS . 95.4 m-85 -16.65 -74.56 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.782 1.633 . . . . 0.0 111.034 -179.723 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 151' ' ' ALA . . . . . 0.48 ' HB2' HG21 ' A' ' 113' ' ' ILE . . . -122.04 -2.58 9.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 118.812 -0.613 . . . . 0.0 111.949 166.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 23.9 mmt -81.89 2.52 30.08 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 119.633 1.106 . . . . 0.0 112.059 178.012 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -55.39 -17.18 4.49 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.602 0.637 . . . . 0.0 112.457 176.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.429 HD23 ' H ' ' A' ' 154' ' ' LEU . 2.2 pt? . . . . . 0 C--O 1.25 1.093 0 CA-C-O 117.283 -1.341 . . . . 0.0 110.49 178.158 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 91.8 t80 . . . . . 0 N--CA 1.476 0.835 0 N-CA-C 110.542 -0.17 . . . . 0.0 110.542 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 62.3 m -145.46 149.86 42.18 Favored Pre-proline 0 C--O 1.233 0.191 0 C-N-CA 123.501 0.72 . . . . 0.0 109.665 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -74.23 167.24 27.64 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 123.628 2.885 . . . . 0.0 110.642 177.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 70.2 p -97.21 163.92 12.71 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 122.767 0.427 . . . . 0.0 109.905 178.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -74.64 177.72 37.38 Favored 'Cis proline' 0 N--CA 1.458 -0.579 0 CA-C-N 118.879 0.635 . . . . 0.0 110.494 -5.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 50.1 m -63.74 147.32 51.99 Favored 'General case' 0 C--O 1.231 0.096 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 175.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 162' ' ' TYR . . . . . 0.464 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 17.2 t80 -145.93 131.12 18.42 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 178.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 163' ' ' SER . . . . . 0.404 ' HA ' ' HD3' ' B' ' 164' ' ' PRO . 29.4 t -135.44 135.45 22.37 Favored Pre-proline 0 C--O 1.234 0.265 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.878 176.535 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 164' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' B' ' 163' ' ' SER . 52.9 Cg_exo -56.58 -17.34 21.89 Favored 'Trans proline' 0 N--CA 1.451 -1.009 0 C-N-CA 123.23 2.62 . . . . 0.0 112.443 175.227 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 73.3 p -69.95 -6.54 33.77 Favored 'General case' 0 C--N 1.341 0.227 0 N-CA-C 113.196 0.814 . . . . 0.0 113.196 -174.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -57.7 156.88 25.49 Favored 'Trans proline' 0 N--CA 1.453 -0.875 0 C-N-CA 123.409 2.74 . . . . 0.0 111.252 169.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 32.9 m . . . . . 0 C--O 1.251 1.147 0 CA-C-O 117.601 -1.19 . . . . 0.0 111.118 -179.261 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.7 ttm . . . . . 0 N--CA 1.475 0.776 0 CA-C-O 119.822 -0.132 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -82.93 149.08 27.26 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.739 0.304 . . . . 0.0 110.299 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -145.1 10.65 1.32 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.028 0.531 . . . . 0.0 111.067 178.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -85.23 163.2 18.82 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 122.863 0.465 . . . . 0.0 111.217 -177.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -79.94 41.69 0.52 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.062 0.945 . . . . 0.0 111.206 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.437 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 17.3 t70 -76.47 -159.76 0.13 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.939 0.895 . . . . 0.0 109.608 178.214 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.437 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 13.3 t80 -55.62 -14.82 2.36 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.335 0.654 . . . . 0.0 111.036 178.288 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -55.33 -34.56 64.31 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.505 1.122 . . . . 0.0 111.304 176.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 40.8 m-20 -66.38 -44.2 83.79 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 119.2 0.909 . . . . 0.0 109.927 178.06 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -64.44 -50.23 68.38 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 -178.331 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 88.1 t -62.53 -57.71 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 -179.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.42 -32.32 64.75 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -177.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 78.9 m -72.43 -44.03 62.99 Favored 'General case' 0 C--N 1.338 0.079 0 O-C-N 121.798 -0.564 . . . . 0.0 110.78 176.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.0 tp -65.62 -31.59 72.71 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -69.73 -43.1 73.01 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 124.001 0.921 . . . . 0.0 109.546 176.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.8 t -60.07 -31.47 70.04 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -36.91 68.63 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.231 0.212 . . . . 0.0 110.592 175.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -68.73 -29.01 67.34 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 123.808 0.843 . . . . 0.0 111.18 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -66.51 -14.24 62.02 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.13 0.572 . . . . 0.0 111.854 178.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.2 mt -108.61 160.08 16.22 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 123.069 0.548 . . . . 0.0 111.097 -178.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -128.82 -1.15 5.36 Favored 'General case' 0 N--CA 1.457 -0.079 0 C-N-CA 123.309 0.644 . . . . 0.0 111.501 178.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 55.2 m -146.19 151.94 38.43 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 123.941 0.897 . . . . 0.0 109.574 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.28 136.45 1.97 Allowed Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 17.4 mm -117.64 56.23 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 C-N-CA 123.952 0.901 . . . . 0.0 108.608 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.4 m -54.21 123.38 12.62 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-O 121.063 0.459 . . . . 0.0 111.481 -175.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -69.77 -14.98 70.82 Favored Glycine 0 CA--C 1.525 0.675 0 CA-C-O 119.13 -0.817 . . . . 0.0 113.288 -177.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.4 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 43.1 t -64.02 -43.63 95.04 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 118.914 1.357 . . . . 0.0 109.816 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 83.6 mtt85 -65.32 -41.42 94.01 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 53.1 mt -59.01 -41.46 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.103 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 176.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.3 tmtt? -60.79 -44.72 96.45 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.772 0.429 . . . . 0.0 111.256 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.4 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.3 OUTLIER -63.66 -40.99 98.23 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 118.72 0.691 . . . . 0.0 110.925 177.909 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 92.2 mt -63.66 -53.4 51.93 Favored 'General case' 0 C--O 1.233 0.202 0 O-C-N 122.534 -0.104 . . . . 0.0 110.782 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 48.4 p -60.94 -39.65 90.27 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.1 m -55.5 -57.7 10.8 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 122.876 0.47 . . . . 0.0 110.572 178.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -67.95 -35.09 77.81 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 118.908 -1.117 . . . . 0.0 111.942 -175.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.95 -58.3 9.27 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.422 0.556 . . . . 0.0 110.336 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 53.0 mt -72.21 -15.74 61.94 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.847 0.859 . . . . 0.0 112.913 -174.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -61.94 -24.69 67.14 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -150.85 -26.69 0.22 Allowed 'General case' 0 C--N 1.338 0.102 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -175.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 34.9 mm 44.97 73.59 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-O 121.768 0.794 . . . . 0.0 111.283 -178.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -137.53 9.26 2.89 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.114 0.966 . . . . 0.0 110.137 178.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.537 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.5 pt -143.64 119.62 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 C-N-CA 125.205 1.402 . . . . 0.0 107.837 -178.069 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.409 ' HG2' ' N ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -114.92 -66.89 1.04 Allowed 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -179.192 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.409 ' N ' ' HG2' ' A' ' 43' ' ' GLU . 79.4 p -67.84 -23.19 65.13 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 122.851 0.46 . . . . 0.0 111.774 -173.764 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.621 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -75.46 -52.63 10.25 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.263 1.025 . . . . 0.0 109.399 179.475 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.433 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 7.4 mt -59.72 -44.33 93.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 C-N-CA 123.02 0.528 . . . . 0.0 110.352 176.207 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.426 HD12 HD11 ' A' ' 101' ' ' LEU . 12.3 mm -71.33 -47.63 58.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 O-C-N 122.258 -0.276 . . . . 0.0 111.681 -177.51 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.3 t -57.68 -35.02 70.03 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 176.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.4 tp -68.26 -45.67 72.51 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 118.442 -0.789 . . . . 0.0 112.184 -179.021 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 26.3 pt -73.01 -35.77 49.39 Favored 'Isoleucine or valine' 0 C--N 1.342 0.258 0 CA-C-N 120.03 1.286 . . . . 0.0 112.149 -179.206 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 95.8 mt -66.15 -50.73 66.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-O 121.431 0.634 . . . . 0.0 109.336 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -60.77 -40.38 92.3 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.317 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -55.67 -43.08 76.0 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 175.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.4 ' HB2' ' HB2' ' A' ' 65' ' ' SER . 11.1 p -62.49 -51.5 67.2 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 119.442 -0.314 . . . . 0.0 110.96 -177.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.42 -20.45 66.37 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 118.585 0.63 . . . . 0.0 112.314 -177.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 69.8 mt -79.27 -14.74 58.84 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 173.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 59.6 m -95.17 163.49 21.67 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -173.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -74.04 -137.81 0.02 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.62 1 C-N-CA 125.606 4.204 . . . . 0.0 109.25 170.241 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -55.54 -26.89 45.75 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 119.361 0.982 . . . . 0.0 111.966 178.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 25.5 m -58.51 -21.27 51.48 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.962 0.505 . . . . 0.0 110.564 175.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -55.21 -72.36 0.07 Allowed 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 174.094 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -59.11 -60.37 3.97 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -175.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 35.1 tp -73.58 -47.47 40.26 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 119.619 -0.832 . . . . 0.0 112.203 -170.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.55 -41.78 93.91 Favored Glycine 0 C--N 1.335 0.479 0 N-CA-C 110.586 -1.005 . . . . 0.0 110.586 -175.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.4 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 11.4 t -68.2 -44.03 76.75 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 117.76 0.78 . . . . 0.0 110.4 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 66' ' ' LEU . 49.6 mt -55.48 -42.04 73.83 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 119.704 -0.799 . . . . 0.0 111.178 178.129 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -71.12 -40.93 71.13 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.327 0.967 . . . . 0.0 112.372 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 89.1 mt -65.56 -45.9 91.19 Favored 'Isoleucine or valine' 0 C--N 1.341 0.228 0 CA-C-N 118.868 0.758 . . . . 0.0 109.847 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.0 mt -59.64 -36.63 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 C-N-CA 123.368 0.667 . . . . 0.0 109.432 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -66.44 -46.52 76.2 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 119.144 -0.455 . . . . 0.0 111.019 -179.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.6 m -67.63 -51.23 52.61 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 118.955 0.798 . . . . 0.0 111.443 -178.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 39.4 mt -66.94 -39.1 82.73 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 C-N-CA 120.56 -0.456 . . . . 0.0 109.999 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.48 -39.73 86.92 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 111.926 -0.47 . . . . 0.0 111.926 -179.162 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 42.9 ttm-85 -67.75 -42.25 82.1 Favored 'General case' 0 CA--C 1.523 -0.08 0 CA-C-N 117.52 0.66 . . . . 0.0 110.016 178.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.86 -41.47 82.84 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.324 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -63.7 -45.54 89.55 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 175.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 55.8 tp -59.38 -43.64 92.87 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 123.205 0.316 . . . . 0.0 110.184 -177.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -64.26 -46.63 82.89 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 120.776 0.322 . . . . 0.0 110.25 176.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -58.4 -41.84 85.83 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.543 -176.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 15.0 t -87.34 -20.48 26.7 Favored 'General case' 0 CA--C 1.528 0.101 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 51.2 tpt85 -71.06 -30.9 67.17 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 118.503 0.592 . . . . 0.0 110.131 175.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.4 m -72.06 -14.65 61.92 Favored 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 176.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -79.13 142.11 36.69 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 118.413 0.551 . . . . 0.0 109.87 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 43.5 m 50.13 17.39 0.31 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.878 0.871 . . . . 0.0 112.829 -178.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 53.57 10.22 0.22 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.981 1.312 . . . . 0.0 113.337 -176.055 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 9.3 t -158.04 8.53 0.15 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.151 0.432 . . . . 0.0 111.558 -177.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 19.1 t 60.19 170.75 0.09 Allowed 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.465 1.106 . . . . 0.0 112.026 -172.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 81.0 p -145.15 0.68 0.93 Allowed 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 122.891 0.476 . . . . 0.0 111.755 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 46.6 t30 48.3 37.9 9.35 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.804 0.842 . . . . 0.0 111.875 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.79 153.61 71.04 Favored Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 122.676 0.39 . . . . 0.0 110.937 -179.592 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -70.08 156.31 62.82 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 123.311 2.674 . . . . 0.0 110.458 177.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 73.01 168.77 13.38 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-O 121.239 0.355 . . . . 0.0 112.252 -178.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 53.3 -167.03 0.07 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.1 1.36 . . . . 0.0 114.36 178.637 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.5 p -50.65 -31.73 17.03 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.585 1.154 . . . . 0.0 114.114 -173.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.52 -45.36 90.97 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 118.752 0.706 . . . . 0.0 110.006 177.043 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -68.18 -32.32 72.48 Favored 'General case' 0 CA--C 1.52 -0.204 0 C-N-CA 122.904 0.482 . . . . 0.0 110.215 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.79 -43.99 91.42 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.395 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.71 -42.08 91.81 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 175.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -59.15 -35.0 72.74 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 122.493 -0.129 . . . . 0.0 110.961 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 62.2 m -76.81 -43.05 38.11 Favored 'General case' 0 CA--C 1.524 -0.049 0 CA-C-O 119.689 -0.196 . . . . 0.0 111.413 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.426 HD11 HD12 ' A' ' 47' ' ' ILE . 51.1 mt -60.96 -27.78 68.51 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.553 -0.717 . . . . 0.0 109.137 174.648 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.1 -15.35 36.2 Favored Glycine 0 CA--C 1.528 0.889 0 CA-C-O 119.228 -0.762 . . . . 0.0 113.458 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -97.82 -5.33 34.97 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.664 1.232 . . . . 0.0 111.652 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.9 m -123.45 -26.81 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.338 0.102 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.429 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.5 tp -55.78 -27.46 22.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 CA-C-N 118.123 0.42 . . . . 0.0 111.588 -178.535 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.549 ' HA ' ' HB1' ' A' ' 144' ' ' ALA . 22.1 pt20 -60.84 -47.5 86.05 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.262 0.625 . . . . 0.0 110.606 178.416 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -75.19 -38.71 60.7 Favored 'General case' 0 CA--C 1.522 -0.116 0 C-N-CA 123.022 0.529 . . . . 0.0 110.502 -179.361 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 89.0 mt -59.41 -49.67 76.9 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.409 -178.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.567 HD12 ' CB ' ' A' ' 144' ' ' ALA . 58.6 mt -67.73 -51.87 44.17 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-O 118.458 -0.782 . . . . 0.0 110.462 177.235 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 91.2 p -53.52 -49.05 68.4 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 119.227 -0.989 . . . . 0.0 111.313 -176.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -69.65 -35.11 74.88 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 121.882 -0.511 . . . . 0.0 111.467 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.87 -48.26 81.3 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 118.225 0.466 . . . . 0.0 111.17 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -74.88 -33.21 29.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.743 -177.994 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.03 -27.56 65.77 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 119.522 -0.871 . . . . 0.0 110.646 178.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 4.5 ttpt -80.69 -23.81 39.3 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.205 1.002 . . . . 0.0 110.583 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.9 m -78.04 158.72 29.11 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -170.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -100.12 -179.87 4.27 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 170.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -36.59 68.08 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.547 1.067 . . . . 0.0 112.858 -175.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -69.66 -42.78 73.74 Favored 'General case' 0 N--CA 1.456 -0.166 0 O-C-N 121.618 -0.676 . . . . 0.0 110.698 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 60.6 m80 -73.57 -37.67 65.45 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 119.573 -0.251 . . . . 0.0 111.136 -177.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.421 ' C ' ' HD2' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -64.92 -37.2 86.84 Favored 'General case' 0 C--N 1.34 0.184 0 N-CA-C 108.469 -0.938 . . . . 0.0 108.469 176.321 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -62.3 -43.62 98.4 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 178.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -62.35 -38.92 91.38 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 122.119 -0.363 . . . . 0.0 111.424 176.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.6 -43.32 80.46 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 118.526 0.603 . . . . 0.0 111.13 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -70.68 -26.18 63.32 Favored 'General case' 0 C--O 1.225 -0.236 0 O-C-N 121.329 -0.857 . . . . 0.0 110.645 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.1 ttt -68.58 -41.04 80.23 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 174.108 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 33.2 tp -57.19 -49.3 76.42 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.121 0.568 . . . . 0.0 109.609 176.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 85.7 mt -72.92 -31.89 64.94 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -178.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -64.99 -43.92 90.98 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 118.274 0.488 . . . . 0.0 109.813 177.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.8 mt -65.86 -39.68 85.41 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 177.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 91.8 t90 -60.65 -33.14 72.37 Favored 'General case' 0 N--CA 1.454 -0.242 0 O-C-N 122.309 -0.244 . . . . 0.0 110.932 176.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -79.54 -34.26 41.21 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.404 0.282 . . . . 0.0 111.724 178.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 13.3 mmp_? -74.81 -20.3 59.84 Favored 'General case' 0 C--N 1.339 0.144 0 CA-C-N 118.0 0.364 . . . . 0.0 111.217 177.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 69.8 m -59.12 -28.73 66.81 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 117.677 0.217 . . . . 0.0 111.317 176.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 65.08 11.93 53.25 Favored Glycine 0 CA--C 1.529 0.906 0 CA-C-O 119.457 -0.635 . . . . 0.0 113.688 175.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 95.5 mt -74.94 -17.95 60.47 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 118.555 1.178 . . . . 0.0 111.694 -177.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -155.66 147.51 23.23 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 122.707 0.403 . . . . 0.0 110.354 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -161.32 163.5 30.75 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.098 0.559 . . . . 0.0 110.749 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt 59.82 170.98 0.08 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.727 1.211 . . . . 0.0 113.121 178.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 23.3 m 54.81 25.94 7.18 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.552 1.141 . . . . 0.0 113.164 178.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -150.83 155.66 39.66 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.9 0.48 . . . . 0.0 110.33 -178.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 96.8 mt -127.13 136.21 51.79 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 176.508 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 42.9 t-20 -64.34 125.47 24.71 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 111.622 0.23 . . . . 0.0 111.622 -173.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.567 ' CB ' HD12 ' A' ' 109' ' ' LEU . . . -26.07 -46.64 0.02 OUTLIER 'General case' 0 C--N 1.342 0.257 0 C-N-CA 129.077 2.951 . . . . 0.0 115.133 -178.453 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.421 ' CD1' ' H ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -73.55 21.41 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 179.368 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? 52.34 27.63 5.01 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 123.412 0.685 . . . . 0.0 110.216 -170.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 75.7 m 45.71 30.98 0.9 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.514 0.726 . . . . 0.0 112.931 -172.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.635 ' HG3' ' H ' ' A' ' 149' ' ' CYS . 17.9 tptm -98.34 -174.54 2.86 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.881 0.848 . . . . 0.0 113.066 -172.491 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 149' ' ' CYS . . . . . 0.635 ' H ' ' HG3' ' A' ' 148' ' ' LYS . 83.4 m -47.91 -20.57 0.33 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 126.246 1.818 . . . . 0.0 114.289 -173.69 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -34.74 -69.55 0.09 Allowed 'General case' 0 CA--C 1.521 -0.156 0 C-N-CA 124.723 1.209 . . . . 0.0 111.669 177.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -107.46 -14.79 14.77 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 123.568 0.543 . . . . 0.0 111.154 170.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' MET . . . . . 0.422 ' SD ' ' N ' ' A' ' 152' ' ' MET . 0.4 OUTLIER -83.24 -10.49 58.53 Favored 'General case' 0 C--N 1.342 0.243 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -174.981 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -66.19 -37.34 85.38 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 119.252 0.933 . . . . 0.0 112.136 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 2.3 tm? . . . . . 0 C--O 1.252 1.198 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 -179.945 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 58.5 t80 . . . . . 0 N--CA 1.477 0.895 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 78.2 p -69.11 152.19 96.83 Favored Pre-proline 0 CA--C 1.532 0.272 0 O-C-N 122.103 -0.373 . . . . 0.0 110.918 -179.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -78.66 5.12 5.82 Favored 'Trans proline' 0 N--CA 1.453 -0.858 0 C-N-CA 124.179 3.253 . . . . 0.0 112.289 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 63.3 p -98.8 155.88 17.14 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.984 0.514 . . . . 0.0 111.128 -177.066 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -76.51 -176.52 18.75 Favored 'Cis proline' 0 N--CA 1.456 -0.734 0 CA-C-N 119.332 0.797 . . . . 0.0 110.646 -7.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 32.5 t -81.89 164.0 21.86 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 122.521 0.328 . . . . 0.0 110.519 176.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -131.5 127.18 36.76 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.841 0.456 . . . . 0.0 110.713 177.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 163' ' ' SER . . . . . 0.409 ' HA ' ' HD3' ' B' ' 164' ' ' PRO . 21.8 t -104.07 131.14 22.22 Favored Pre-proline 0 N--CA 1.453 -0.295 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 174.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 164' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' B' ' 163' ' ' SER . 50.9 Cg_exo -57.48 -10.45 6.8 Favored 'Trans proline' 0 N--CA 1.448 -1.183 0 C-N-CA 122.854 2.369 . . . . 0.0 112.943 176.755 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 52.4 p -67.15 -22.29 65.77 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 118.865 0.757 . . . . 0.0 112.21 -177.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -76.5 -14.21 18.07 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.181 2.587 . . . . 0.0 112.378 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 47.7 t . . . . . 0 C--O 1.251 1.179 0 CA-C-O 117.574 -1.203 . . . . 0.0 110.286 -175.939 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.7 tpt . . . . . 0 N--CA 1.475 0.808 0 CA-C-O 119.518 -0.277 . . . . 0.0 111.643 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -95.41 15.27 20.0 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -175.279 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -133.68 3.8 3.56 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 122.265 -0.272 . . . . 0.0 111.433 -178.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -149.74 172.85 14.43 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 122.045 -0.409 . . . . 0.0 110.424 -178.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -76.27 47.08 0.44 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.417 1.087 . . . . 0.0 112.004 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -75.97 -160.86 0.15 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.542 0.737 . . . . 0.0 109.852 176.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -54.79 -14.35 1.37 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.525 0.73 . . . . 0.0 111.053 177.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -53.63 -34.6 59.12 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.367 0.667 . . . . 0.0 110.506 175.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 34.4 m-20 -64.47 -48.5 75.01 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 118.962 0.801 . . . . 0.0 110.16 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -63.1 -49.06 75.93 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 110.466 -0.198 . . . . 0.0 110.466 -177.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 86.2 t -63.45 -57.75 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.22 -29.54 67.58 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 119.395 -0.336 . . . . 0.0 111.802 -177.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 61.9 m -71.53 -46.04 60.69 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.35 0.523 . . . . 0.0 110.48 176.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.438 HD11 ' CD2' ' A' ' 53' ' ' TYR . 19.5 tp -65.89 -33.84 76.76 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.077 0.465 . . . . 0.0 110.167 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -68.42 -43.27 77.53 Favored 'General case' 0 CA--C 1.522 -0.108 0 C-N-CA 123.93 0.892 . . . . 0.0 109.648 178.359 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.6 t -62.88 -31.75 72.86 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 174.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.83 -32.86 70.04 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 177.214 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -72.83 -37.73 67.37 Favored 'General case' 0 C--O 1.23 0.06 0 C-N-CA 123.019 0.528 . . . . 0.0 111.655 176.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -73.98 -16.92 61.06 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -175.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 90.0 mt -93.34 159.29 15.33 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.081 0.467 . . . . 0.0 111.465 -178.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -122.84 7.74 9.35 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.104 0.961 . . . . 0.0 109.92 178.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 77.4 p -76.17 -168.98 1.03 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.117 0.967 . . . . 0.0 110.024 178.037 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -75.94 -145.28 1.53 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 111.551 -0.62 . . . . 0.0 111.551 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 21.3 mm -107.13 76.94 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 C-N-CA 123.322 0.649 . . . . 0.0 110.072 -173.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.7 t -64.24 124.52 21.92 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 120.882 0.372 . . . . 0.0 110.139 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.408 ' C ' ' HD2' ' B' ' 160' ' ' PRO . . . -68.79 -25.79 74.96 Favored Glycine 0 CA--C 1.524 0.604 0 CA-C-O 119.603 -0.554 . . . . 0.0 112.534 -176.132 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 83.1 p -64.22 -33.96 77.0 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 118.549 1.174 . . . . 0.0 111.079 -175.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -69.98 -39.19 76.09 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 54.7 mt -63.98 -38.08 81.47 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.07 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 176.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -60.8 -45.24 95.17 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 118.92 -0.562 . . . . 0.0 110.654 176.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.95 -40.34 97.38 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 119.256 0.934 . . . . 0.0 111.396 178.05 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 99.4 mt -64.52 -58.56 6.05 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 119.709 -0.186 . . . . 0.0 111.044 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.556 HG21 ' HB2' ' A' ' 71' ' ' SER . 44.2 p -54.18 -41.36 68.47 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-N 118.0 0.363 . . . . 0.0 111.693 175.765 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.0 m -55.53 -60.18 3.79 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 119.227 -0.416 . . . . 0.0 111.104 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -67.15 -32.69 73.98 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 119.134 -1.026 . . . . 0.0 111.711 -174.254 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.38 -58.14 9.91 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 122.029 -0.42 . . . . 0.0 110.109 174.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.0 mt -70.45 -17.02 62.99 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.637 0.775 . . . . 0.0 112.47 -175.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -66.9 -21.76 65.98 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -178.759 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.4 t60 -148.17 -30.03 0.3 Allowed 'General case' 0 C--N 1.34 0.169 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -175.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.514 HG22 HG22 ' A' ' 93' ' ' THR . 33.4 mm 43.86 73.95 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 121.583 0.706 . . . . 0.0 111.436 -178.274 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -149.49 21.12 0.93 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.705 0.802 . . . . 0.0 109.754 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.595 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.24 36.85 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 C-N-CA 124.539 1.135 . . . . 0.0 109.183 -172.109 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.49 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -50.95 -56.12 13.92 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -175.899 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 79.2 p -75.29 -25.78 58.22 Favored 'General case' 0 CA--C 1.522 -0.129 0 N-CA-C 112.33 0.492 . . . . 0.0 112.33 -173.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.676 ' H ' ' CD ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -83.07 -42.3 17.6 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -179.3 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 21.0 mt -57.61 -52.77 53.21 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.123 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 171.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 13.3 mm -65.81 -47.05 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 CA-C-O 119.494 -0.288 . . . . 0.0 111.514 -176.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.6 t -56.21 -40.1 73.52 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 120.034 -0.667 . . . . 0.0 109.859 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.7 tp -68.3 -41.72 80.53 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 118.834 -0.603 . . . . 0.0 112.543 -176.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.7 pt -74.67 -36.4 40.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 CA-C-N 119.688 1.131 . . . . 0.0 111.946 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.454 HD13 HG21 ' A' ' 104' ' ' VAL . 96.0 mt -63.97 -48.59 85.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 177.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -59.47 -43.72 93.17 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.778 177.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.438 ' CD2' HD11 ' A' ' 14' ' ' LEU . 31.6 t80 -55.73 -40.1 72.02 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 177.268 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.7 t -65.34 -55.41 18.36 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -69.15 -21.17 64.02 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -173.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 50.2 mt -81.55 -14.8 56.41 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 179.212 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 78.8 m -125.04 163.73 35.9 Favored Pre-proline 0 CA--C 1.539 0.546 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 -169.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -59.11 174.26 1.0 Allowed 'Trans proline' 0 C--N 1.348 0.549 1 C-N-CA 126.041 4.494 . . . . 0.0 114.645 -179.231 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.567 ' HB3' ' HE2' ' A' ' 115' ' ' LYS . 4.6 p-10 -59.42 -30.18 68.29 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -174.366 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 25.3 t -63.53 -36.88 85.25 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -78.49 -28.13 46.3 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.034 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -63.05 -45.31 92.83 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-N 119.013 0.824 . . . . 0.0 109.104 173.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.7 tp -63.32 -48.27 78.73 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.76 -41.86 96.14 Favored Glycine 0 C--N 1.336 0.579 0 N-CA-C 111.111 -0.796 . . . . 0.0 111.111 178.503 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.2 m -63.63 -43.97 95.26 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 117.043 0.422 . . . . 0.0 110.443 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 81.6 mt -62.34 -37.02 84.04 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 118.086 0.403 . . . . 0.0 110.749 179.127 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -70.81 -33.28 70.54 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.64 0.654 . . . . 0.0 111.344 177.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 69.9 mt -71.3 -41.38 74.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 176.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 66.8 mt -65.25 -33.72 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 123.516 0.726 . . . . 0.0 109.412 177.306 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -75.18 -42.48 55.74 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 119.606 -0.235 . . . . 0.0 111.361 -178.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.556 ' HB2' HG21 ' A' ' 33' ' ' THR . 10.9 p -68.42 -49.77 57.53 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-N 118.592 0.633 . . . . 0.0 110.731 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 54.8 mt -67.4 -42.67 87.6 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.096 0 CA-C-N 117.725 0.239 . . . . 0.0 110.466 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.22 -39.66 94.54 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 -178.494 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.0 ttm-85 -70.1 -40.02 75.19 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.181 0.592 . . . . 0.0 110.314 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.92 -40.38 83.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 178.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -62.36 -49.43 75.59 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 175.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.6 tp -57.61 -48.39 79.54 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.017 0.527 . . . . 0.0 110.25 -176.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -64.51 -43.86 92.74 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.808 -0.178 . . . . 0.0 110.811 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -67.9 -39.25 83.65 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 121.127 -0.229 . . . . 0.0 111.506 -175.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.1 t -80.17 -24.28 40.45 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.872 -178.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -82.03 -24.19 35.48 Favored 'General case' 0 C--N 1.341 0.212 0 CA-C-N 118.438 0.563 . . . . 0.0 111.621 172.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.0 t -75.68 -18.1 59.74 Favored 'General case' 0 CA--C 1.528 0.135 0 CA-C-N 117.948 0.34 . . . . 0.0 111.725 177.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -86.76 147.29 25.91 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 49.4 m -140.54 5.02 2.0 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.562 0.745 . . . . 0.0 111.389 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -95.47 163.87 13.05 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.05 0.54 . . . . 0.0 109.938 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 78.9 p -72.35 151.38 42.74 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.984 0.421 . . . . 0.0 110.933 -179.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.9 t -158.33 169.79 23.69 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.091 0.556 . . . . 0.0 109.592 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.6 t -71.25 158.92 35.55 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 120.987 0.422 . . . . 0.0 110.351 178.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -129.61 6.49 5.19 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.271 0.628 . . . . 0.0 111.273 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.411 ' N ' ' HD2' ' A' ' 91' ' ' PRO . 40.8 ttmt -74.46 -45.18 5.8 Favored Pre-proline 0 CA--C 1.532 0.288 0 CA-C-O 118.353 -0.832 . . . . 0.0 112.534 -178.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.411 ' HD2' ' N ' ' A' ' 90' ' ' LYS . 59.4 Cg_endo -80.02 -16.01 11.44 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.259 1.973 . . . . 0.0 111.439 178.543 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 75.66 -33.69 1.2 Allowed Glycine 0 CA--C 1.529 0.949 0 C-N-CA 124.167 0.889 . . . . 0.0 112.249 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.514 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER 49.39 -158.92 0.07 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.71 1.204 . . . . 0.0 113.767 176.827 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.2 p -53.0 -30.17 33.65 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.034 0.934 . . . . 0.0 113.434 -175.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.74 -46.32 90.13 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 118.97 0.804 . . . . 0.0 109.859 175.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -73.78 -23.04 59.65 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.897 178.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.75 -45.89 84.5 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 175.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.6 mt -64.45 -43.0 96.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 176.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -60.18 -34.12 73.15 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 121.309 -0.156 . . . . 0.0 111.33 178.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.6 m -74.92 -41.29 59.96 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-O 119.517 -0.278 . . . . 0.0 111.342 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.2 mt -61.39 -30.5 70.59 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 174.105 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.68 -14.92 31.38 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 119.277 -0.735 . . . . 0.0 113.637 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.78 -6.92 24.23 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.701 1.25 . . . . 0.0 111.959 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.454 HG21 HD13 ' A' ' 51' ' ' ILE . 27.3 m -121.18 -20.29 4.36 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -178.287 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.416 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.5 tp -51.42 -27.66 7.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 C-N-CA 123.027 0.531 . . . . 0.0 112.099 -177.385 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -64.1 -56.22 16.42 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 122.765 0.426 . . . . 0.0 110.81 177.42 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -66.31 -40.32 89.9 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 73.5 mt -58.59 -55.68 31.94 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 119.05 -0.5 . . . . 0.0 110.946 -177.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.3 mt -69.45 -51.8 32.78 Favored 'General case' 0 N--CA 1.457 -0.08 0 CA-C-N 118.581 0.628 . . . . 0.0 111.565 -177.145 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 80.4 p -55.06 -49.82 70.66 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 120.116 -0.634 . . . . 0.0 111.706 -178.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -69.69 -45.76 67.58 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 118.897 0.772 . . . . 0.0 111.513 -178.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -51.91 -55.88 17.51 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 118.11 0.414 . . . . 0.0 110.955 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 25.7 mt -69.19 -37.28 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 O-C-N 122.955 0.159 . . . . 0.0 110.821 -178.103 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.61 -21.46 61.84 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.143 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.567 ' HE2' ' HB3' ' A' ' 59' ' ' ASP . 0.1 OUTLIER -98.39 -15.17 19.79 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.649 0.38 . . . . 0.0 111.929 -175.736 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 87.8 p -84.34 167.99 16.03 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -174.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -86.72 174.42 8.85 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 49.9 mm-40 -55.89 -40.31 72.81 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.558 0.617 . . . . 0.0 112.04 -175.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -71.42 -42.6 68.08 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.514 0.597 . . . . 0.0 111.001 -179.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 7.5 m80 -71.17 -42.42 69.1 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.149 -0.345 . . . . 0.0 110.543 -178.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.4 ttpt -51.36 -49.88 60.6 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 169.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -61.12 -37.82 84.14 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 120.93 -0.308 . . . . 0.0 111.33 -175.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -63.03 -43.33 98.99 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 122.365 -0.209 . . . . 0.0 111.483 175.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 69.4 mt -69.59 -34.24 60.58 Favored 'Isoleucine or valine' 0 C--N 1.338 0.096 0 C-N-CA 119.869 -0.733 . . . . 0.0 109.05 178.255 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -35.75 81.95 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 177.788 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 19.9 ttt -66.27 -43.72 85.6 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 123.132 0.573 . . . . 0.0 110.316 175.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.41 -41.29 84.62 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 176.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 75.9 mt -70.43 -31.23 68.33 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 178.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -67.47 -39.47 85.29 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 117.941 0.337 . . . . 0.0 110.135 178.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.66 -42.28 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 177.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 61.3 t90 -61.83 -36.96 82.71 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.494 0.318 . . . . 0.0 110.868 177.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -75.08 -37.28 61.61 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 122.695 0.398 . . . . 0.0 111.305 178.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -67.3 -40.07 86.0 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 122.203 0.201 . . . . 0.0 111.104 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 64.9 m -73.63 -16.58 61.22 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 111.37 0.137 . . . . 0.0 111.37 178.048 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -88.15 -4.82 77.42 Favored Glycine 0 CA--C 1.527 0.833 0 CA-C-O 119.667 -0.518 . . . . 0.0 112.036 178.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 73.4 mt 56.44 179.49 0.04 OUTLIER 'General case' 0 C--N 1.343 0.325 0 C-N-CA 124.38 1.072 . . . . 0.0 112.194 -176.262 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 54.4 -164.17 0.11 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.792 0.837 . . . . 0.0 111.739 -178.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.9 13.83 9.89 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.193 0.597 . . . . 0.0 111.963 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -107.07 146.69 30.9 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.206 0.602 . . . . 0.0 110.213 -178.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 81.6 p -88.21 167.62 13.44 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 122.993 0.517 . . . . 0.0 111.321 -179.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -127.9 10.26 6.46 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.975 0.51 . . . . 0.0 111.405 -179.12 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.555 ' HG ' ' H ' ' A' ' 144' ' ' ALA . 55.8 tp -148.16 137.54 22.15 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 122.847 0.459 . . . . 0.0 109.977 -178.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -80.93 -14.48 57.95 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -176.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.555 ' H ' ' HG ' ' A' ' 142' ' ' LEU . . . -53.26 -45.22 68.72 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.123 0.969 . . . . 0.0 111.986 -171.172 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.754 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -103.21 -10.7 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 C-N-CA 122.387 0.275 . . . . 0.0 111.713 174.479 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -58.61 -31.95 68.54 Favored 'General case' 0 C--N 1.339 0.132 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 174.172 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 47.3 t -69.77 118.63 12.88 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 169.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.472 ' O ' ' HB2' ' A' ' 152' ' ' MET . 99.2 mttt -56.06 -20.66 17.91 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 123.773 0.829 . . . . 0.0 113.102 -172.084 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 72.1 m -43.57 -29.29 0.46 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.608 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' PHE . . . . . 0.542 ' CE1' ' HG2' ' A' ' 152' ' ' MET . 6.4 p90 -49.98 -126.67 0.0 OUTLIER 'General case' 0 C--N 1.344 0.353 0 C-N-CA 126.301 1.84 . . . . 0.0 114.279 -176.039 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 151' ' ' ALA . . . . . 0.456 ' N ' ' CG ' ' A' ' 150' ' ' PHE . . . -66.96 -0.06 2.86 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 120.408 -1.432 . . . . 0.0 110.851 172.347 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 152' ' ' MET . . . . . 0.542 ' HG2' ' CE1' ' A' ' 150' ' ' PHE . 12.8 mmt -106.14 -13.74 15.35 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 119.59 1.087 . . . . 0.0 111.751 -177.565 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 28.6 t70 50.81 13.97 0.16 Allowed 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 172.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 54.7 tp . . . . . 0 C--O 1.251 1.146 0 CA-C-O 117.766 -1.111 . . . . 0.0 110.713 -178.678 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 55.0 p90 . . . . . 0 N--CA 1.473 0.708 0 N-CA-C 110.585 -0.154 . . . . 0.0 110.585 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 53.0 m -130.34 156.76 78.98 Favored Pre-proline 0 CA--C 1.531 0.214 0 C-N-CA 123.377 0.671 . . . . 0.0 110.442 -178.144 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -69.05 164.83 32.31 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 123.754 2.969 . . . . 0.0 111.213 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 82.2 p -136.75 177.57 7.75 Favored 'General case' 0 N--CA 1.457 -0.082 0 C-N-CA 123.324 0.65 . . . . 0.0 110.81 -177.184 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 160' ' ' PRO . . . . . 0.408 ' HD2' ' C ' ' A' ' 26' ' ' GLY . 44.5 Cg_endo -79.35 13.05 18.83 Favored 'Cis proline' 0 N--CA 1.455 -0.764 0 CA-C-N 118.786 0.602 . . . . 0.0 110.854 -10.459 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 18.8 t 62.82 171.56 0.14 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.901 1.28 . . . . 0.0 112.108 -171.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -144.52 148.53 34.58 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.753 0.821 . . . . 0.0 110.306 -178.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 16.1 t -124.44 130.51 24.29 Favored Pre-proline 0 N--CA 1.45 -0.43 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.72 -10.8 4.19 Favored 'Trans proline' 0 N--CA 1.452 -0.952 0 C-N-CA 123.292 2.661 . . . . 0.0 113.054 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 67.2 p -72.63 -19.32 61.47 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -177.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -71.21 176.22 8.16 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 123.608 2.872 . . . . 0.0 111.666 178.075 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 74.1 m . . . . . 0 C--O 1.252 1.199 0 CA-C-O 117.775 -1.107 . . . . 0.0 111.172 176.808 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.836 0 CA-C-O 120.26 0.076 . . . . 0.0 110.934 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -139.03 164.62 29.29 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.029 0.532 . . . . 0.0 110.262 179.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -101.58 155.59 18.0 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 122.863 0.465 . . . . 0.0 110.894 -177.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 60.61 144.59 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.202 1.801 . . . . 0.0 114.297 -178.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -147.95 31.24 0.86 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.173 0.989 . . . . 0.0 109.588 179.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -75.75 -152.69 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.83 0.852 . . . . 0.0 110.282 179.189 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -54.28 -15.06 1.37 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.928 0.891 . . . . 0.0 111.957 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.4 tp60 -55.64 -41.8 74.1 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.191 0.596 . . . . 0.0 111.13 177.614 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -65.47 -38.75 90.72 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 118.637 0.653 . . . . 0.0 110.521 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -64.44 -55.13 22.96 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 120.726 0.298 . . . . 0.0 110.235 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 96.6 t -59.16 -54.65 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.52 -32.1 68.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.938 0.495 . . . . 0.0 112.08 -177.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 58.9 m -72.56 -44.44 62.08 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 118.45 0.568 . . . . 0.0 110.707 177.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.9 tp -67.72 -33.38 74.76 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.424 0.631 . . . . 0.0 109.854 -179.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -65.15 -45.45 84.9 Favored 'General case' 0 CA--C 1.521 -0.159 0 C-N-CA 123.842 0.857 . . . . 0.0 109.216 176.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.3 t -61.6 -32.13 72.23 Favored 'General case' 0 N--CA 1.457 -0.079 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 175.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -61.58 -49.92 74.7 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 176.709 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -67.71 -36.56 80.85 Favored 'General case' 0 C--N 1.339 0.129 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -77.14 -37.38 54.11 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -175.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 34.4 tp -82.75 -17.64 43.53 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 117.672 0.214 . . . . 0.0 111.399 -176.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm 52.72 29.19 7.1 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.412 0.685 . . . . 0.0 112.145 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 69.3 p -74.67 179.59 4.67 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.658 0.783 . . . . 0.0 111.227 -179.074 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -76.57 -141.53 1.2 Allowed Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.5 mm -106.08 36.43 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 123.073 0.549 . . . . 0.0 110.71 -174.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.6 m -54.95 128.51 33.78 Favored 'General case' 0 C--N 1.339 0.134 0 O-C-N 121.959 -0.463 . . . . 0.0 110.241 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.81 -15.27 62.03 Favored Glycine 0 C--N 1.337 0.584 0 CA-C-O 119.166 -0.796 . . . . 0.0 113.761 -174.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.1 p -62.38 -40.08 95.27 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 119.155 1.478 . . . . 0.0 110.823 -177.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -68.16 -42.72 79.64 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 56.1 mt -63.77 -36.04 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.209 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.3 mmtt -66.5 -42.21 87.73 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 118.743 -0.646 . . . . 0.0 110.864 179.167 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.13 -41.77 94.51 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.213 0.915 . . . . 0.0 111.039 175.715 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.2 mt -61.81 -57.28 12.47 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 122.563 -0.086 . . . . 0.0 110.929 -179.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.563 HG21 ' HB2' ' A' ' 71' ' ' SER . 41.3 p -55.67 -43.97 76.85 Favored 'General case' 0 CA--C 1.523 -0.071 0 O-C-N 122.152 -0.343 . . . . 0.0 111.641 177.185 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 m -55.38 -58.8 6.23 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 122.396 0.278 . . . . 0.0 110.799 -178.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -78.59 -14.62 59.24 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -172.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.42 -58.51 3.65 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 166.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.4 mt -65.62 -20.69 66.41 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.901 0.88 . . . . 0.0 112.284 -176.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -72.59 -14.89 61.72 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -133.71 -46.11 0.81 Allowed 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 119.011 0.823 . . . . 0.0 112.964 -176.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.512 HG22 HG22 ' A' ' 93' ' ' THR . 39.8 mm 40.27 66.32 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 122.304 1.05 . . . . 0.0 111.529 -174.536 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -150.34 21.62 0.84 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.663 1.185 . . . . 0.0 108.655 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.577 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -148.8 35.52 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 C-N-CA 125.069 1.347 . . . . 0.0 109.063 -170.562 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.442 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -51.45 -52.81 43.17 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -175.044 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 83.5 p -76.57 -24.06 53.54 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -173.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.645 ' H ' ' CD ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -86.2 -41.76 14.39 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -179.584 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 48.8 mt -56.27 -52.77 47.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 118.259 0.481 . . . . 0.0 109.817 170.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 14.8 mm -67.09 -48.12 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.139 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.582 -177.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 48.4 t -55.76 -37.64 68.8 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 120.001 -0.68 . . . . 0.0 109.722 178.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.4 tp -69.31 -43.12 74.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.551 -0.738 . . . . 0.0 112.613 -177.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 31.3 pt -72.41 -35.53 52.05 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 120.047 1.294 . . . . 0.0 111.781 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.505 HD13 HG21 ' A' ' 104' ' ' VAL . 94.9 mt -64.24 -49.66 80.13 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-O 121.593 0.711 . . . . 0.0 109.257 178.072 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -57.92 -41.97 83.83 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.474 177.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -56.45 -41.07 75.88 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 176.074 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.4 t -66.22 -48.42 70.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 112.135 0.421 . . . . 0.0 112.135 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -73.21 -23.97 60.45 Favored 'General case' 0 C--O 1.231 0.081 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -175.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 51.4 mt -80.49 -15.1 57.55 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 178.246 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.408 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 73.4 m -119.87 157.36 52.74 Favored Pre-proline 0 CA--C 1.536 0.434 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -171.416 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 90.5 Cg_endo -72.62 -170.79 0.64 Allowed 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 125.045 3.83 . . . . 0.0 113.642 -176.709 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -50.67 -44.98 57.83 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.42 1.888 . . . . 0.0 114.462 -170.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.0 p -60.12 -31.4 70.03 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.403 ' CG ' ' HB3' ' A' ' 57' ' ' CYS . 65.1 m-70 -86.32 -14.7 42.84 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 118.921 -0.561 . . . . 0.0 111.136 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.411 ' HB2' ' HE2' ' A' ' 115' ' ' LYS . 75.1 mmtt -69.85 -43.47 71.87 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 171.187 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 57.2 tp -66.44 -49.12 67.76 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.08 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.3 -38.32 93.15 Favored Glycine 0 C--N 1.336 0.552 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 178.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.1 t -60.94 -51.07 70.82 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 177.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 49.5 mt -58.59 -34.58 71.27 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.736 -0.65 . . . . 0.0 111.605 179.372 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -72.41 -33.53 67.21 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.389 0.995 . . . . 0.0 111.783 177.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 75.9 mt -75.69 -40.42 40.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 118.607 0.639 . . . . 0.0 110.378 178.125 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 84.6 mt -63.63 -36.68 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 174.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -67.8 -43.68 79.1 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.998 -0.525 . . . . 0.0 111.057 178.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.563 ' HB2' HG21 ' A' ' 33' ' ' THR . 89.3 p -67.17 -57.13 7.33 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 118.627 0.649 . . . . 0.0 111.289 -177.269 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 54.1 mt -64.88 -30.5 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 178.365 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.09 -54.67 19.81 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-O 119.851 -0.416 . . . . 0.0 112.541 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.64 HH11 ' HG3' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -66.49 -34.13 77.24 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 118.162 0.981 . . . . 0.0 110.754 -179.678 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.79 -45.96 76.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 110.318 -0.253 . . . . 0.0 110.318 177.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -63.71 -46.76 83.96 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 177.181 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 60.5 tp -55.93 -45.38 78.78 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 122.802 0.441 . . . . 0.0 110.507 -177.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -67.41 -46.94 71.7 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 120.775 -0.37 . . . . 0.0 110.811 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -64.68 -24.95 67.74 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -175.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.3 t -99.09 -27.77 13.68 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 118.798 0.726 . . . . 0.0 112.237 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 -84.2 -18.83 35.3 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.948 -0.47 . . . . 0.0 111.882 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 88.3 p -62.1 -18.88 62.16 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 118.223 0.465 . . . . 0.0 111.994 177.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 45.9 t30 52.28 25.02 3.13 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.228 1.011 . . . . 0.0 112.643 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 90.4 p -87.8 -3.11 58.97 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 122.677 0.391 . . . . 0.0 111.788 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -147.87 155.34 41.52 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.2 0.6 . . . . 0.0 109.403 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.0 t -99.56 -5.63 28.8 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.214 0.606 . . . . 0.0 111.173 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.4 t 56.88 -173.75 0.07 Allowed 'General case' 0 C--N 1.341 0.222 0 C-N-CA 124.287 1.035 . . . . 0.0 112.18 -177.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 53.8 m -71.81 163.71 27.32 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.216 0.606 . . . . 0.0 110.913 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -103.4 13.03 34.54 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -174.027 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.697 ' H ' ' HD2' ' A' ' 91' ' ' PRO . 88.8 tttt -133.22 -52.36 0.03 OUTLIER Pre-proline 0 CA--C 1.533 0.298 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -179.044 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.697 ' HD2' ' H ' ' A' ' 90' ' ' LYS . 95.8 Cg_endo -75.53 159.73 39.12 Favored 'Trans proline' 0 N--CA 1.452 -0.918 0 C-N-CA 122.137 1.891 . . . . 0.0 110.745 178.7 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.436 ' HA3' ' CG ' ' A' ' 96' ' ' HIS . . . -83.27 -20.79 59.89 Favored Glycine 0 CA--C 1.529 0.93 0 N-CA-C 111.551 -0.619 . . . . 0.0 111.551 178.109 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.512 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER 49.68 -160.67 0.06 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.665 1.186 . . . . 0.0 114.093 177.867 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.6 p -53.58 -28.46 32.14 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.153 0.981 . . . . 0.0 113.549 -174.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.74 -46.16 86.61 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 118.921 0.782 . . . . 0.0 109.952 176.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' HIS . . . . . 0.436 ' CG ' ' HA3' ' A' ' 92' ' ' GLY . 3.2 m80 -73.96 -22.32 59.68 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.462 178.212 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.79 -46.57 78.18 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 175.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 94.9 mt -63.05 -41.69 93.8 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 175.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -63.51 -33.87 76.53 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 179.411 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.6 m -73.12 -39.7 65.55 Favored 'General case' 0 C--O 1.227 -0.126 0 O-C-N 122.342 -0.224 . . . . 0.0 110.654 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.1 mt -62.34 -31.58 72.24 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 173.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.46 -15.4 24.36 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-O 119.0 -0.889 . . . . 0.0 113.463 179.206 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -100.29 -4.74 28.68 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 119.263 1.531 . . . . 0.0 111.856 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.505 HG21 HD13 ' A' ' 51' ' ' ILE . 28.7 m -124.52 -20.55 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 122.823 0.449 . . . . 0.0 112.024 -179.282 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.416 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.8 tp -54.4 -23.4 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 C-N-CA 123.358 0.663 . . . . 0.0 112.222 -176.299 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -59.4 -54.01 51.56 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.623 0.369 . . . . 0.0 111.602 178.007 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -78.34 -29.16 47.42 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 121.124 -0.23 . . . . 0.0 110.795 -177.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.2 mt -63.16 -52.16 63.54 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 64.3 mt -64.79 -59.81 3.8 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 118.478 -0.773 . . . . 0.0 110.369 176.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 90.7 p -52.77 -42.32 64.89 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 118.97 -1.092 . . . . 0.0 111.857 -172.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -69.44 -47.49 63.88 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 119.16 0.891 . . . . 0.0 111.175 178.121 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.84 -34.58 65.53 Favored 'General case' 0 N--CA 1.458 -0.068 0 C-N-CA 123.503 0.721 . . . . 0.0 112.323 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -81.92 -39.75 16.92 Favored 'Isoleucine or valine' 0 C--N 1.337 0.041 0 CA-C-N 119.471 1.032 . . . . 0.0 112.048 175.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.64 -25.95 64.17 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.344 -178.151 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.411 ' HE2' ' HB2' ' A' ' 62' ' ' LYS . 0.1 OUTLIER -81.94 -17.39 47.22 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.256 0.623 . . . . 0.0 110.731 178.406 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 13.3 m -80.88 160.85 24.62 Favored 'General case' 0 N--CA 1.457 -0.079 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -174.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -96.27 -179.2 4.57 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 170.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -55.47 -43.5 75.56 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.931 0.787 . . . . 0.0 111.828 -177.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -68.6 -41.39 79.66 Favored 'General case' 0 N--CA 1.453 -0.285 0 O-C-N 121.555 -0.715 . . . . 0.0 111.05 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -72.15 -38.27 69.24 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 122.158 -0.339 . . . . 0.0 111.176 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.73 -34.94 78.95 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.103 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -63.14 -42.51 99.48 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 178.112 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -61.59 -42.71 99.26 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 110.556 -0.165 . . . . 0.0 110.556 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.0 mt -65.89 -37.74 80.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 39.4 ttt180 -63.35 -33.26 75.13 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 176.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 62.4 ttp -67.79 -41.45 83.19 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 176.008 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 88.3 mt -58.76 -45.7 89.14 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.197 176.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.3 mt -67.33 -35.25 79.03 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 111.571 0.212 . . . . 0.0 111.571 -179.316 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -66.01 -37.43 85.91 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 117.999 0.363 . . . . 0.0 110.176 178.321 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 89.4 mt -70.27 -38.83 75.69 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 177.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 44.4 m0 -66.86 -29.97 70.01 Favored 'General case' 0 C--N 1.338 0.099 0 CA-C-N 117.874 0.307 . . . . 0.0 110.43 177.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -77.27 -34.34 55.73 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 117.757 0.253 . . . . 0.0 110.891 176.095 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 22.8 tpp180 -70.73 -38.33 73.56 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 122.618 0.367 . . . . 0.0 111.372 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 90.8 p -86.4 -13.53 46.04 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.43 0.292 . . . . 0.0 111.747 179.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 72.58 -174.08 45.93 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 -178.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.503 ' HG ' ' H ' ' A' ' 138' ' ' GLN . 35.2 tp -143.19 150.64 39.64 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 53.2 t80 -82.36 -0.48 46.07 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.075 0.55 . . . . 0.0 110.853 -178.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' GLN . . . . . 0.503 ' H ' ' HG ' ' A' ' 136' ' ' LEU . 75.8 mt-30 -139.04 168.34 20.06 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.229 1.011 . . . . 0.0 109.063 -178.048 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -134.83 177.02 8.12 Favored 'General case' 0 C--N 1.338 0.087 0 C-N-CA 122.798 0.439 . . . . 0.0 111.484 -174.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 19.9 m 60.41 23.9 13.47 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.295 1.038 . . . . 0.0 113.603 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -125.3 7.81 7.8 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.107 0.563 . . . . 0.0 111.27 178.032 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 83.4 mt -94.3 -7.53 41.64 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.467 0.544 . . . . 0.0 112.467 -175.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 67.0 m-20 -80.08 -6.18 57.2 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 122.815 0.446 . . . . 0.0 111.403 178.328 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.449 ' C ' ' H ' ' A' ' 146' ' ' ARG . . . -38.3 -37.38 0.28 Allowed 'General case' 0 C--N 1.343 0.314 0 C-N-CA 127.858 2.463 . . . . 0.0 114.253 -173.409 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.655 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -67.92 15.93 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-O 119.214 -0.422 . . . . 0.0 112.093 178.207 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.449 ' H ' ' C ' ' A' ' 144' ' ' ALA . 99.6 mtt180 50.66 47.55 24.16 Favored 'General case' 0 C--N 1.34 0.153 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 -173.333 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 12.6 t 69.16 168.65 0.29 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.242 1.017 . . . . 0.0 112.625 -174.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -55.21 -14.62 1.81 Allowed 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 116.369 1.988 . . . . 0.0 116.369 -167.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 44.3 t -49.28 -47.33 46.92 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.101 1.318 . . . . 0.0 111.422 -174.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' PHE . . . . . 0.408 ' CD1' ' O ' ' A' ' 145' ' ' ILE . 18.7 m-85 -53.83 -85.71 0.01 OUTLIER 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 126.057 1.743 . . . . 0.0 114.398 -172.136 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -82.93 -14.33 54.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 119.402 -0.333 . . . . 0.0 111.835 -178.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 35.9 mtm -111.36 -12.02 14.08 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 114.892 1.441 . . . . 0.0 114.892 -168.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -112.18 -11.83 13.71 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 120.029 1.286 . . . . 0.0 111.881 174.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 95.4 mt . . . . . 0 C--O 1.251 1.158 0 CA-C-O 117.225 -1.369 . . . . 0.0 111.109 -178.499 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 . . . . . 0 N--CA 1.474 0.765 0 CA-C-O 120.313 0.101 . . . . 0.0 111.068 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 60.3 p -148.11 155.25 43.5 Favored Pre-proline 0 CA--C 1.529 0.165 0 C-N-CA 122.739 0.416 . . . . 0.0 110.19 179.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -74.52 164.44 33.88 Favored 'Trans proline' 0 N--CA 1.453 -0.899 0 C-N-CA 123.695 2.93 . . . . 0.0 111.229 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 36.6 p 59.43 151.82 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 126.441 1.897 . . . . 0.0 114.143 -177.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -77.24 -178.74 25.01 Favored 'Cis proline' 0 N--CA 1.456 -0.72 0 CA-C-N 119.061 0.7 . . . . 0.0 110.37 -5.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 36.6 m -76.6 163.71 26.61 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 120.819 0.343 . . . . 0.0 110.898 176.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 162' ' ' TYR . . . . . 0.464 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 7.9 t80 -143.22 138.22 29.51 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.116 0.566 . . . . 0.0 110.307 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 35.9 t -124.88 142.31 40.63 Favored Pre-proline 0 N--CA 1.454 -0.267 0 C-N-CA 122.976 0.51 . . . . 0.0 111.46 177.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -66.87 -5.93 14.54 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 123.388 2.725 . . . . 0.0 111.523 175.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 66.9 p -96.6 25.36 5.19 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.826 0.45 . . . . 0.0 111.642 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -61.41 162.98 18.86 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 121.885 1.723 . . . . 0.0 110.605 170.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 32.0 t . . . . . 0 C--O 1.252 1.209 0 CA-C-O 117.522 -1.228 . . . . 0.0 110.857 -178.34 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.2 ttm . . . . . 0 N--CA 1.477 0.919 0 CA-C-O 119.567 -0.254 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.7 mm100 53.76 22.73 3.33 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 178.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -142.66 164.62 29.63 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 123.466 0.707 . . . . 0.0 110.364 -179.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -137.39 15.5 2.98 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.48 0.712 . . . . 0.0 111.126 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -123.9 34.79 4.98 Favored 'General case' 0 CA--C 1.527 0.095 0 C-N-CA 123.971 0.908 . . . . 0.0 110.503 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.421 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 12.9 t70 -73.79 -158.13 0.06 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.685 0.794 . . . . 0.0 110.385 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.421 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 13.5 t80 -55.58 -14.29 2.03 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.498 0.719 . . . . 0.0 111.142 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -51.4 -43.94 62.08 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.173 0.989 . . . . 0.0 110.609 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 44.7 m-20 -62.05 -44.2 97.2 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 118.042 0.383 . . . . 0.0 110.806 -179.125 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -64.88 -51.27 62.87 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 117.795 0.271 . . . . 0.0 110.566 -177.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.7 t -62.54 -55.09 26.08 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.05 -31.5 65.25 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.15 0.58 . . . . 0.0 111.802 -178.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 54.4 m -73.49 -43.0 61.14 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 118.387 0.54 . . . . 0.0 110.68 177.115 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.442 HD11 ' CD2' ' A' ' 53' ' ' TYR . 15.6 tp -66.72 -30.46 70.7 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -70.63 -43.83 68.44 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.167 0.987 . . . . 0.0 109.652 175.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -62.93 -26.77 68.97 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 175.302 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.49 -41.75 62.71 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 174.637 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -64.93 -28.0 69.23 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 123.087 0.555 . . . . 0.0 111.222 178.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -69.2 -14.59 63.06 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 178.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.1 mt -92.06 166.27 12.76 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 121.188 0.518 . . . . 0.0 111.158 -178.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -133.62 -1.2 3.12 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.216 176.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 34.6 t -157.7 157.57 33.76 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.693 0.797 . . . . 0.0 109.466 177.484 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.02 138.73 3.29 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.487 -0.645 . . . . 0.0 111.487 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.1 mm -119.07 45.12 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 124.534 1.134 . . . . 0.0 108.293 179.341 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.3 m -49.89 127.25 15.9 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.401 0.68 . . . . 0.0 112.103 -174.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.56 -15.08 63.47 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-O 119.012 -0.882 . . . . 0.0 113.705 -176.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.41 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 46.5 t -62.46 -42.86 99.77 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 118.966 1.383 . . . . 0.0 110.301 -178.586 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -66.99 -40.87 87.48 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.288 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 46.0 mt -60.98 -37.58 77.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 176.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -60.74 -49.23 78.34 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.042 0.537 . . . . 0.0 110.783 177.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.41 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.5 OUTLIER -61.25 -43.51 98.76 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 118.366 0.53 . . . . 0.0 110.971 179.036 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.67 -61.92 2.09 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 122.356 -0.215 . . . . 0.0 110.635 -179.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 64.1 p -55.94 -46.02 78.65 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.3 t -63.32 -44.06 96.01 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.742 -176.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -68.19 -36.22 79.24 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 118.816 -1.153 . . . . 0.0 111.209 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.42 -56.29 24.08 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 174.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.9 mt -70.32 -17.89 63.08 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.477 0.711 . . . . 0.0 112.586 -175.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -63.76 -24.46 67.77 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -150.24 -26.15 0.24 Allowed 'General case' 0 C--N 1.342 0.253 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -176.341 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.525 HG22 HG22 ' A' ' 93' ' ' THR . 32.6 mm 45.42 74.68 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 123.307 0.643 . . . . 0.0 111.484 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -148.49 21.63 1.04 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.661 0.784 . . . . 0.0 109.964 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.574 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.13 36.69 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.134 0 C-N-CA 124.439 1.095 . . . . 0.0 109.566 -171.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.457 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -51.11 -55.27 18.58 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 -175.701 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 80.7 p -75.76 -25.76 56.79 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -173.035 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.664 ' H ' ' CD ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -83.03 -44.23 15.44 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.342 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 22.2 mt -56.23 -53.82 35.08 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 CA-C-N 118.178 0.445 . . . . 0.0 109.973 172.056 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.9 mm -65.33 -48.32 83.72 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.161 0 CA-C-O 119.209 -0.424 . . . . 0.0 111.523 -175.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 44.4 t -56.22 -40.43 74.05 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.167 178.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.2 tp -68.45 -41.46 80.21 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.4 pt -74.52 -35.0 37.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 CA-C-N 119.325 0.966 . . . . 0.0 111.906 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.435 HD13 HG21 ' A' ' 104' ' ' VAL . 97.4 mt -63.77 -50.68 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 177.494 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -58.14 -43.52 87.35 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.761 178.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.442 ' CD2' HD11 ' A' ' 14' ' ' LEU . 24.0 t80 -56.23 -41.65 76.05 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 176.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.7 t -64.69 -53.84 41.07 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -70.9 -23.7 62.34 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -173.296 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 51.2 mt -82.92 -15.95 49.34 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 76.3 m -118.55 159.15 45.07 Favored Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 -169.257 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 57' ' ' CYS . 49.9 Cg_exo -59.16 -171.5 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 1 C-N-CA 126.544 4.83 . . . . 0.0 116.582 -179.375 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -47.37 -58.79 3.75 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 126.719 2.008 . . . . 0.0 114.725 -175.136 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.2 p -58.81 -22.78 59.33 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.391 0.139 . . . . 0.0 110.668 -177.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 42.0 m-70 -88.84 -27.58 20.97 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 118.72 -0.657 . . . . 0.0 110.985 -178.457 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -66.52 -46.53 75.86 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 119.568 1.077 . . . . 0.0 108.215 172.5 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.0 tp -65.67 -48.89 70.55 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.853 0.359 . . . . 0.0 110.126 178.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.01 -40.19 95.2 Favored Glycine 0 C--N 1.336 0.553 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.4 m -65.68 -43.38 89.45 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 117.676 0.738 . . . . 0.0 110.564 178.584 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 72.1 mt -59.62 -35.46 74.4 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.866 0.757 . . . . 0.0 110.877 177.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -73.73 -35.34 65.06 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.516 0.598 . . . . 0.0 111.345 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 73.7 mt -70.09 -48.01 64.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 O-C-N 121.528 -0.732 . . . . 0.0 109.831 177.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 77.8 mt -59.1 -38.39 73.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 C-N-CA 124.283 1.033 . . . . 0.0 109.18 178.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -66.52 -46.81 74.94 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 118.676 -0.678 . . . . 0.0 111.084 177.001 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.0 t -62.37 -52.72 62.5 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 118.988 0.813 . . . . 0.0 110.887 -175.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 43.4 mt -63.8 -34.76 70.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.249 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.09 -51.24 46.38 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-O 119.739 -0.478 . . . . 0.0 112.665 -178.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.671 ' CG ' HH11 ' A' ' 74' ' ' ARG . 0.0 OUTLIER -71.4 -32.34 68.31 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 117.994 0.897 . . . . 0.0 110.228 -178.055 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.66 -45.08 72.71 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 176.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.3 m-30 -61.57 -49.9 74.79 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 176.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.1 tp -60.75 -43.79 97.51 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.783 0.433 . . . . 0.0 110.931 -174.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -67.27 -45.24 77.22 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.471 178.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -64.32 -39.59 94.2 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 111.509 0.189 . . . . 0.0 111.509 -175.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.0 t -80.93 -33.79 33.83 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 118.037 0.38 . . . . 0.0 111.313 -179.13 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.7 ttt85 -67.03 -29.23 68.98 Favored 'General case' 0 C--N 1.339 0.122 0 CA-C-N 118.406 0.548 . . . . 0.0 110.405 177.013 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 24.2 t -69.97 -14.25 62.62 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 177.505 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -134.71 6.08 3.44 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -174.527 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 31.9 t -144.88 159.63 42.59 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 118.573 0.624 . . . . 0.0 111.051 -178.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -107.68 14.48 25.58 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.748 0.819 . . . . 0.0 111.073 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 33.3 m 54.31 31.94 15.32 Favored 'General case' 0 CA--C 1.527 0.085 0 C-N-CA 123.498 0.719 . . . . 0.0 111.994 -178.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 74.4 p -78.81 5.06 12.25 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.351 0.66 . . . . 0.0 112.176 -179.186 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 40.3 t -141.97 161.15 38.7 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 123.173 0.589 . . . . 0.0 110.12 178.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -119.65 -10.31 9.61 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.081 0.552 . . . . 0.0 111.386 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.452 ' N ' ' CD ' ' A' ' 91' ' ' PRO . 96.4 mttt -135.78 42.31 0.71 Allowed Pre-proline 0 CA--C 1.533 0.323 0 CA-C-O 118.901 -0.571 . . . . 0.0 112.106 -179.386 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.452 ' CD ' ' N ' ' A' ' 90' ' ' LYS . 62.2 Cg_endo -76.26 -4.06 14.6 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.856 2.371 . . . . 0.0 111.406 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 82.8 -172.02 51.46 Favored Glycine 0 C--N 1.338 0.661 0 N-CA-C 111.109 -0.796 . . . . 0.0 111.109 -178.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.525 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER 54.23 -158.67 0.18 Allowed 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.466 1.106 . . . . 0.0 113.371 176.813 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 23.3 p -50.88 -30.34 14.33 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -175.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.82 -44.75 88.84 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.597 -0.689 . . . . 0.0 110.046 176.606 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -68.02 -30.29 69.5 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.931 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.49 -45.8 85.74 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 123.287 0.635 . . . . 0.0 110.143 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.6 mt -64.46 -42.23 94.65 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 175.17 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 44.6 t-20 -60.99 -33.62 73.52 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 121.255 -0.178 . . . . 0.0 110.725 178.473 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.8 m -73.54 -40.58 63.87 Favored 'General case' 0 N--CA 1.457 -0.097 0 CA-C-O 119.492 -0.29 . . . . 0.0 110.884 179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.1 mt -62.29 -29.65 70.58 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 173.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.69 -14.92 31.46 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 118.994 -0.892 . . . . 0.0 113.919 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -100.12 -6.24 26.58 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.016 1.408 . . . . 0.0 111.966 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.435 HG21 HD13 ' A' ' 51' ' ' ILE . 27.6 m -122.16 -18.57 4.74 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.163 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -178.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.7 tp -50.89 -28.46 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 CA-C-N 118.426 0.557 . . . . 0.0 111.602 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -59.35 -53.49 57.66 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.67 0.388 . . . . 0.0 110.849 177.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -80.72 -27.91 36.78 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 119.605 -0.236 . . . . 0.0 111.476 -177.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 82.0 mt -65.28 -50.84 64.18 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 178.371 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.465 ' O ' HG13 ' A' ' 113' ' ' ILE . 83.7 mt -64.37 -64.8 0.79 Allowed 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 175.474 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.2 t -34.4 -55.44 0.53 Allowed 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 179.066 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -73.12 -39.29 65.86 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-N 119.359 0.981 . . . . 0.0 112.054 -177.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.418 ' O ' ' HE2' ' A' ' 115' ' ' LYS . . . -57.56 -49.46 76.3 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.847 0.749 . . . . 0.0 110.216 179.766 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.2 OUTLIER -76.04 -32.57 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -179.119 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.35 -28.76 67.42 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.542 0.61 . . . . 0.0 109.841 179.083 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.418 ' HE2' ' O ' ' A' ' 112' ' ' ALA . 0.4 OUTLIER -79.21 -23.04 44.06 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.833 0.853 . . . . 0.0 110.374 175.12 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.408 ' HB3' ' HB2' ' A' ' 120' ' ' HIS . 35.5 m -76.87 154.95 33.28 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 113.75 1.018 . . . . 0.0 113.75 -172.37 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -92.1 -178.35 4.95 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 170.177 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -55.61 -43.82 76.44 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.094 0.407 . . . . 0.0 111.396 -178.151 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -66.71 -43.02 85.4 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 121.716 -0.615 . . . . 0.0 110.85 -178.284 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.408 ' HB2' ' HB3' ' A' ' 116' ' ' SER . 55.7 m80 -70.25 -36.08 74.22 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 119.628 -0.225 . . . . 0.0 110.777 -178.791 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.08 -39.48 92.56 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 174.389 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -67.41 -38.65 84.95 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.689 -177.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -63.04 -44.47 95.8 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 121.209 -0.196 . . . . 0.0 111.169 175.558 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 97.5 mt -66.94 -35.92 75.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.567 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 80.0 ttt-85 -66.4 -32.19 73.42 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 122.079 -0.388 . . . . 0.0 110.181 176.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 58.3 ttp -67.19 -42.47 84.15 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 175.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 64.7 tp -57.34 -47.81 80.63 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.95 0.405 . . . . 0.0 110.221 176.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 84.1 mt -70.79 -27.79 64.16 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.443 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -69.69 -38.66 77.09 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 175.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 86.7 mt -65.14 -42.59 94.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 176.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 44.3 m0 -59.34 -47.41 85.52 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 117.807 0.276 . . . . 0.0 110.846 177.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -66.6 -39.55 88.44 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -177.056 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 77.4 mtp180 -73.68 -26.0 60.52 Favored 'General case' 0 C--O 1.231 0.09 0 C-N-CA 122.473 0.309 . . . . 0.0 111.45 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 52.9 m -78.83 -14.33 59.31 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 122.287 0.235 . . . . 0.0 111.126 175.391 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 76.67 15.9 81.2 Favored Glycine 0 CA--C 1.528 0.898 0 N-CA-C 111.317 -0.713 . . . . 0.0 111.317 -177.198 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 82.6 mt -105.84 166.0 10.79 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.433 0.693 . . . . 0.0 111.083 -175.496 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 53.46 25.93 5.1 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 178.324 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 42.2 mm-40 -73.72 4.26 5.34 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.079 0.552 . . . . 0.0 111.891 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -70.1 164.14 24.74 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.908 0.483 . . . . 0.0 111.091 -179.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 20.1 m 53.77 22.19 3.07 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.733 0.813 . . . . 0.0 112.958 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 63.9 m-85 51.35 25.65 2.68 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 124.055 0.942 . . . . 0.0 112.915 178.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 93.7 mt 53.3 25.92 4.84 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 123.668 0.787 . . . . 0.0 112.483 -177.18 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' ASN . . . . . 0.487 ' HA ' ' HB3' ' A' ' 146' ' ' ARG . 52.5 t30 -50.23 -32.87 17.68 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.105 0.562 . . . . 0.0 111.854 -176.427 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -50.24 -36.61 31.81 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.969 1.708 . . . . 0.0 111.985 -172.164 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.504 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -119.61 -6.8 11.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-O 119.512 -0.28 . . . . 0.0 111.374 170.914 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.487 ' HB3' ' HA ' ' A' ' 143' ' ' ASN . 30.9 ttt85 -54.85 -31.52 59.64 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 176.066 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 29.5 m -63.09 101.98 0.33 Allowed 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 106.433 -1.691 . . . . 0.0 106.433 167.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -55.6 -26.95 46.63 Favored 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 115.62 1.711 . . . . 0.0 115.62 -166.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 86.2 m -50.9 -42.63 59.39 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.329 0.968 . . . . 0.0 110.933 -174.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -53.58 -92.7 0.0 OUTLIER 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.808 1.243 . . . . 0.0 113.814 -171.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -80.07 -11.86 59.73 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 178.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 32.2 mtm -105.61 -8.15 18.13 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -171.318 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -71.46 -14.77 62.24 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 120.369 1.44 . . . . 0.0 110.916 170.228 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 87.4 mt . . . . . 0 C--O 1.249 1.054 0 CA-C-O 117.743 -1.122 . . . . 0.0 110.481 -179.229 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 110.784 -0.08 . . . . 0.0 110.784 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 65.9 p -140.4 153.38 68.51 Favored Pre-proline 0 CA--C 1.533 0.289 0 C-N-CA 122.762 0.425 . . . . 0.0 110.111 179.432 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -80.17 -9.34 14.02 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 123.703 2.935 . . . . 0.0 112.495 -178.498 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 42.6 p -142.39 145.15 33.54 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.088 0.404 . . . . 0.0 111.285 -176.126 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 159' ' ' SEP . . . . . 0.401 ' HA ' ' HA ' ' B' ' 160' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 160' ' ' PRO . . . . . 0.401 ' HA ' ' HA ' ' B' ' 159' ' ' SEP . 84.1 Cg_endo -72.29 177.13 36.34 Favored 'Cis proline' 0 N--CA 1.455 -0.759 0 N-CA-C 110.103 -0.768 . . . . 0.0 110.103 -7.085 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 38.1 m -68.4 154.9 40.91 Favored 'General case' 0 N--CA 1.457 -0.109 0 CA-C-O 120.679 0.276 . . . . 0.0 110.616 176.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 162' ' ' TYR . . . . . 0.423 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 3.2 t80 -150.58 138.53 20.04 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.911 0.484 . . . . 0.0 110.671 -179.145 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.4 t -133.46 134.67 24.07 Favored Pre-proline 0 N--CA 1.455 -0.195 0 C-N-CA 123.26 0.624 . . . . 0.0 111.4 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -58.42 -12.58 14.07 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.531 2.821 . . . . 0.0 112.593 174.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 2.8 m -78.21 -4.0 45.51 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 -173.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -60.3 160.53 22.92 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 123.11 2.54 . . . . 0.0 110.842 168.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 34.0 t . . . . . 0 C--O 1.251 1.136 0 CA-C-O 117.57 -1.205 . . . . 0.0 110.064 -179.521 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.5 ttm . . . . . 0 N--CA 1.476 0.868 0 N-CA-C 110.601 -0.148 . . . . 0.0 110.601 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -149.5 165.07 33.25 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.665 0.386 . . . . 0.0 110.632 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -139.78 161.9 36.44 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.288 0.635 . . . . 0.0 109.981 -179.465 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -149.25 159.02 44.63 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.992 0.517 . . . . 0.0 109.705 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 50.95 26.23 2.59 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.173 0.989 . . . . 0.0 113.014 -175.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.43 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 18.3 t70 -79.56 -154.78 0.09 Allowed 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 176.057 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.43 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 7.1 t80 -55.92 -13.65 1.99 Allowed 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.724 -0.61 . . . . 0.0 110.772 177.214 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -53.06 -37.98 62.09 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 124.367 1.067 . . . . 0.0 111.127 175.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -62.91 -45.02 94.46 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 119.217 0.917 . . . . 0.0 110.164 179.176 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -64.04 -51.34 64.6 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 117.693 0.224 . . . . 0.0 110.613 -178.496 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.2 t -64.72 -50.82 73.71 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.129 0 C-N-CA 121.002 -0.279 . . . . 0.0 110.773 -177.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.31 -29.47 69.89 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 119.537 -0.268 . . . . 0.0 111.683 -179.094 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 57.5 m -73.84 -43.55 58.34 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 118.456 0.571 . . . . 0.0 110.389 176.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.501 ' HG ' ' CD2' ' A' ' 53' ' ' TYR . 21.3 tp -66.32 -28.47 68.71 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.163 0.506 . . . . 0.0 109.741 179.228 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -70.64 -46.71 62.78 Favored 'General case' 0 C--N 1.337 0.035 0 C-N-CA 123.773 0.829 . . . . 0.0 109.35 175.654 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 64.8 m -63.4 -22.77 67.08 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.059 175.36 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -76.72 -39.56 51.49 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.484 0.314 . . . . 0.0 110.28 175.721 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.1 ttpp -69.94 -23.96 63.28 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.264 0.625 . . . . 0.0 111.05 175.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -68.92 -14.45 63.04 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.685 0.394 . . . . 0.0 111.564 176.056 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.7 mt -79.56 161.49 25.93 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 120.934 0.397 . . . . 0.0 110.724 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 65.6 tttm -129.72 -20.23 3.23 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.094 0.558 . . . . 0.0 110.471 178.474 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 38.9 t -156.9 147.56 21.55 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 123.376 0.67 . . . . 0.0 109.56 177.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.13 146.63 8.47 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-O 121.77 0.65 . . . . 0.0 112.907 175.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 29.9 mt -104.03 152.24 6.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 124.921 1.289 . . . . 0.0 107.968 174.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.0 t -140.06 125.1 18.56 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 175.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -61.39 -31.22 76.56 Favored Glycine 0 CA--C 1.524 0.615 0 CA-C-O 119.26 -0.744 . . . . 0.0 112.805 -175.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 88.8 p -63.47 -35.5 80.64 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 118.795 1.298 . . . . 0.0 110.879 -174.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.0 mmt-85 -68.39 -45.5 72.51 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 177.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 41.4 mt -62.59 -35.15 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.1 mmtt -71.22 -37.85 72.02 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 118.998 -0.525 . . . . 0.0 111.25 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.58 -42.73 91.4 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.065 0.848 . . . . 0.0 110.183 175.062 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.8 mt -64.15 -59.68 4.14 Favored 'General case' 0 N--CA 1.456 -0.156 0 O-C-N 122.611 -0.056 . . . . 0.0 111.149 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 56.3 p -56.26 -46.38 79.67 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 178.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 t -63.47 -44.69 93.69 Favored 'General case' 0 CA--C 1.521 -0.142 0 C-N-CA 119.814 -0.754 . . . . 0.0 111.295 -177.154 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -67.34 -35.95 80.43 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 118.928 -1.109 . . . . 0.0 111.12 -178.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.92 -57.56 12.51 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.743 0.306 . . . . 0.0 110.434 174.092 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 63.9 mt -70.51 -16.59 62.91 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.927 0.891 . . . . 0.0 113.045 -174.706 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -61.92 -29.56 70.3 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -178.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.5 p80 -152.62 -17.01 0.16 Allowed 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 115.243 1.572 . . . . 0.0 115.243 -177.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.565 HG22 HG22 ' A' ' 93' ' ' THR . 27.5 mm 44.82 77.07 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 121.662 0.744 . . . . 0.0 112.084 178.05 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -147.32 21.13 1.21 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.406 0.682 . . . . 0.0 110.367 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.546 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -147.41 37.62 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 C-N-CA 124.407 1.083 . . . . 0.0 109.362 -171.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.47 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -51.11 -57.6 8.29 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -175.47 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 85.2 p -74.38 -25.85 59.75 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -173.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.664 ' H ' ' CD ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.04 -45.07 15.79 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 18.9 mt -55.58 -50.87 63.73 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 172.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.436 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 14.9 mm -67.99 -48.04 76.44 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -176.3 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.2 t -55.47 -42.81 74.86 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 119.96 -0.696 . . . . 0.0 109.96 179.218 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 73.9 mt -61.27 -62.02 2.14 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.021 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.5 pt -58.77 -35.49 56.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 119.621 1.1 . . . . 0.0 112.144 -174.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.48 HD13 HG21 ' A' ' 104' ' ' VAL . 76.2 mt -60.83 -59.18 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 178.336 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -63.98 -31.88 73.22 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.769 -178.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.501 ' CD2' ' HG ' ' A' ' 14' ' ' LEU . 3.7 m-85 -66.16 -34.23 77.56 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 122.092 -0.38 . . . . 0.0 110.162 178.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 29.5 t -68.89 -46.76 67.54 Favored 'General case' 0 C--O 1.231 0.087 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 173.159 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.6 tpp180 -56.14 -37.76 69.91 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 124.959 1.303 . . . . 0.0 112.519 -177.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 69.6 mt -78.35 -14.28 59.48 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 115.068 1.507 . . . . 0.0 115.068 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.463 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 82.4 m -115.18 160.08 35.42 Favored Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -169.277 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.463 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 93.9 Cg_endo -70.89 179.79 4.03 Favored 'Trans proline' 0 C--N 1.348 0.531 1 C-N-CA 125.344 4.029 . . . . 0.0 113.028 -179.234 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.549 ' HB3' ' HE3' ' A' ' 115' ' ' LYS . 5.0 p-10 -55.53 -34.51 64.74 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 114.53 1.308 . . . . 0.0 114.53 -171.152 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.2 t -63.77 -35.3 80.13 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.902 0.774 . . . . 0.0 109.452 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 62.8 t-80 -83.99 -31.1 25.68 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.078 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -58.71 -44.97 90.52 Favored 'General case' 0 C--N 1.341 0.219 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 53.5 tp -66.92 -52.05 47.83 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 122.757 0.423 . . . . 0.0 111.187 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.83 -39.63 97.75 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 -179.132 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.0 t -70.51 -33.52 71.29 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 117.322 0.561 . . . . 0.0 110.061 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.4 mt -64.82 -33.65 76.5 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.511 173.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -66.42 -39.15 88.78 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 119.331 0.969 . . . . 0.0 109.697 174.464 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 83.9 mt -64.12 -50.29 77.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 O-C-N 122.146 -0.346 . . . . 0.0 111.116 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 60.1 mt -62.1 -34.95 66.07 Favored 'Isoleucine or valine' 0 C--O 1.231 0.115 0 C-N-CA 123.712 0.805 . . . . 0.0 109.681 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -67.76 -42.76 81.27 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.985 -0.531 . . . . 0.0 110.442 177.487 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.42 ' HA ' ' NH1' ' A' ' 74' ' ' ARG . 8.0 t -66.93 -50.65 61.7 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 119.25 -0.98 . . . . 0.0 111.338 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 47.0 mt -64.89 -35.74 76.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.201 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.0 -54.31 25.31 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.966 -0.454 . . . . 0.0 111.966 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.42 ' NH1' ' HA ' ' A' ' 71' ' ' SER . 4.0 mtp-105 -61.74 -37.53 84.57 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-N 117.294 0.547 . . . . 0.0 110.817 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.02 -44.44 72.73 Favored 'General case' 0 N--CA 1.451 -0.375 0 O-C-N 122.46 -0.15 . . . . 0.0 111.004 179.592 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.2 m-30 -61.8 -45.57 93.27 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 176.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.6 tt -58.83 -52.95 63.53 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -177.156 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -58.21 -44.97 88.4 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 121.154 -0.218 . . . . 0.0 110.556 179.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -63.61 -43.02 98.08 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -174.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.453 HG23 HH11 ' A' ' 81' ' ' ARG . 14.6 t -82.16 -26.36 33.52 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -176.667 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.453 HH11 HG23 ' A' ' 80' ' ' THR . 9.5 mpt_? -73.32 -32.94 64.89 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 118.694 0.679 . . . . 0.0 110.206 175.128 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 75.3 m -71.72 -13.96 61.88 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-N 117.587 0.176 . . . . 0.0 111.219 174.039 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -105.48 24.48 12.1 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.84 0.856 . . . . 0.0 110.876 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 33.1 t -140.93 160.83 39.23 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.104 0.562 . . . . 0.0 110.716 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -138.05 7.43 2.68 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.602 0.761 . . . . 0.0 110.491 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 86.8 p -127.23 10.26 6.82 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.5 0.72 . . . . 0.0 111.073 -179.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 54.1 p 54.92 11.65 0.51 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.667 1.587 . . . . 0.0 113.817 -176.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.1 t -84.13 160.22 20.93 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.099 0.56 . . . . 0.0 110.841 -179.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 22.4 t30 -98.7 145.4 26.93 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.2 0.6 . . . . 0.0 109.756 -178.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -82.95 150.89 62.77 Favored Pre-proline 0 CA--C 1.532 0.283 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 -177.571 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -77.53 3.97 6.37 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 124.337 3.358 . . . . 0.0 113.651 -176.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -154.25 -176.18 26.29 Favored Glycine 0 C--N 1.337 0.629 0 CA-C-N 118.568 0.622 . . . . 0.0 112.123 -177.118 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.565 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER 52.84 -152.74 0.26 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.198 0.999 . . . . 0.0 112.861 177.017 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.0 p -51.13 -27.26 8.07 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -177.127 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.3 -39.07 82.17 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.253 -0.904 . . . . 0.0 110.126 176.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 -68.55 -34.48 75.91 Favored 'General case' 0 CA--C 1.519 -0.227 0 C-N-CA 122.981 0.512 . . . . 0.0 109.801 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.436 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -63.74 -43.75 95.57 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.349 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.5 -42.89 94.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 175.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -59.98 -33.98 72.68 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 121.393 -0.123 . . . . 0.0 111.022 179.265 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.7 m -76.0 -41.47 51.03 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-O 119.535 -0.269 . . . . 0.0 111.346 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 62.6 mt -61.7 -29.74 70.29 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 119.782 -0.767 . . . . 0.0 108.985 173.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.88 -14.87 39.67 Favored Glycine 0 CA--C 1.529 0.948 0 CA-C-O 119.171 -0.794 . . . . 0.0 113.672 179.625 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.67 -6.16 25.54 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.591 1.196 . . . . 0.0 111.562 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.48 HG21 HD13 ' A' ' 51' ' ' ILE . 32.2 m -124.02 -18.12 4.05 Favored 'Isoleucine or valine' 0 C--N 1.338 0.094 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.14 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.449 HD12 ' HA ' ' A' ' 105' ' ' ILE . 11.1 tp -53.15 -31.1 17.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 CA-C-N 118.751 0.705 . . . . 0.0 111.28 -177.563 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -60.83 -55.08 37.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.884 0.474 . . . . 0.0 110.829 178.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -75.94 -31.56 59.15 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.684 0.394 . . . . 0.0 111.773 -177.434 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 58.6 mt -64.81 -50.53 66.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.428 ' HB3' ' CG2' ' A' ' 145' ' ' ILE . 97.4 mt -70.29 -50.41 39.67 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.643 -178.701 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.55 ' HB2' ' CZ ' ' A' ' 150' ' ' PHE . 88.9 p -52.21 -50.19 62.44 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 118.545 0.611 . . . . 0.0 111.852 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -68.29 -46.38 70.48 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 118.662 0.664 . . . . 0.0 111.167 -178.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -54.11 -54.12 43.9 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.844 0.458 . . . . 0.0 110.499 -179.26 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 10.8 mt -65.47 -46.0 91.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 CA-C-N 118.005 0.366 . . . . 0.0 110.801 -178.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.01 -21.47 66.4 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 119.74 -0.171 . . . . 0.0 111.292 -176.443 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.549 ' HE3' ' HB3' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -94.88 -13.68 25.25 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 117.69 0.223 . . . . 0.0 111.432 179.831 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.441 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 50.1 p -90.11 165.9 13.72 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -172.814 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -83.55 174.08 10.88 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.137 0.975 . . . . 0.0 109.894 179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.7 tt0 -55.55 -44.39 76.73 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.906 0.482 . . . . 0.0 111.851 -178.173 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -68.44 -37.46 80.26 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 121.964 -0.46 . . . . 0.0 110.606 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.441 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 56.4 m80 -71.51 -52.54 17.78 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 119.001 -0.523 . . . . 0.0 110.969 -177.773 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -36.99 65.74 Favored 'General case' 0 C--N 1.342 0.258 0 CA-C-N 119.238 0.927 . . . . 0.0 110.922 173.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.69 -43.57 98.47 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.566 178.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -64.7 -36.16 83.39 Favored 'General case' 0 C--O 1.227 -0.109 0 CA-C-O 119.549 -0.262 . . . . 0.0 111.685 177.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.4 mt -68.58 -40.5 81.96 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 178.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 15.4 ttp180 -60.55 -47.04 87.95 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.701 0.401 . . . . 0.0 110.766 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.72 -30.69 64.39 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.278 -178.139 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.415 HD23 ' C ' ' A' ' 127' ' ' LEU . 7.6 tt -60.98 -47.67 85.36 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.621 0.646 . . . . 0.0 109.481 175.388 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 87.9 mt -70.09 -32.08 69.97 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.772 -0.194 . . . . 0.0 111.062 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -66.07 -38.58 88.65 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 110.391 -0.225 . . . . 0.0 110.391 177.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 87.3 mt -69.72 -41.9 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 177.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 15.5 t90 -64.12 -30.33 71.4 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 122.586 -0.071 . . . . 0.0 111.067 179.666 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -83.08 -37.76 23.4 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 122.032 -0.418 . . . . 0.0 111.536 176.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 29.9 tpt180 -73.35 -24.07 60.3 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 122.815 0.446 . . . . 0.0 111.956 -176.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 99.8 p -65.11 -14.48 60.63 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 71.26 18.09 76.44 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 111.591 -0.603 . . . . 0.0 111.591 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 31.1 tp -71.71 -17.46 62.22 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 117.533 0.667 . . . . 0.0 111.786 -177.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -80.64 164.16 23.07 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.615 0.366 . . . . 0.0 110.442 176.23 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -133.38 -12.9 2.71 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 15.3 ptmm? -160.56 163.89 32.41 Favored 'General case' 0 N--CA 1.457 -0.086 0 C-N-CA 123.001 0.52 . . . . 0.0 110.683 178.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 18.8 m 55.03 -173.88 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.228 1.011 . . . . 0.0 113.243 177.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -138.58 161.21 37.65 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.614 0.765 . . . . 0.0 110.111 179.623 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 53.2 tp -87.26 91.76 8.83 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.692 0.397 . . . . 0.0 109.938 -177.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -71.18 -15.44 62.48 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -179.3 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -49.81 -42.58 47.36 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.329 1.052 . . . . 0.0 112.159 -172.608 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.538 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -110.36 -25.21 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.07 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 176.33 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -66.04 -20.41 66.17 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 122.944 0.497 . . . . 0.0 110.78 -176.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 80.6 p -61.39 -40.67 95.19 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 118.47 -0.776 . . . . 0.0 113.06 -178.242 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -160.32 -161.89 0.92 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 115.568 1.692 . . . . 0.0 115.568 -178.502 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 149' ' ' CYS . . . . . 0.419 ' O ' ' C ' ' A' ' 150' ' ' PHE . 31.7 t -48.35 -24.82 1.34 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.298 1.839 . . . . 0.0 113.792 -171.32 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 150' ' ' PHE . . . . . 0.55 ' CZ ' ' HB2' ' A' ' 110' ' ' SER . 20.9 m-85 -24.22 -85.26 0.0 OUTLIER 'General case' 0 C--N 1.344 0.35 0 C-N-CA 125.058 1.343 . . . . 0.0 110.188 177.363 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -101.88 -6.04 24.02 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 118.372 -0.823 . . . . 0.0 111.655 167.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 35.4 mmt -70.69 -4.02 21.46 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-N 120.335 1.425 . . . . 0.0 111.643 175.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -54.64 -20.5 8.25 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.034 0.933 . . . . 0.0 112.342 174.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 42.9 tp . . . . . 0 C--O 1.248 1.01 0 CA-C-O 117.401 -1.285 . . . . 0.0 110.811 -179.473 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 110.578 -0.156 . . . . 0.0 110.578 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 37.7 p -146.18 153.37 48.71 Favored Pre-proline 0 CA--C 1.53 0.188 0 C-N-CA 122.917 0.487 . . . . 0.0 110.243 178.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -75.9 -10.93 19.9 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.593 2.862 . . . . 0.0 112.123 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 3.7 m 54.19 26.46 6.72 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.5 0.72 . . . . 0.0 111.708 -176.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 160' ' ' PRO . . . . . 0.467 ' HG2' ' H ' ' B' ' 161' ' ' SER . 61.1 Cg_endo -68.37 -66.57 0.03 OUTLIER 'Cis proline' 0 N--CA 1.457 -0.62 0 CA-C-N 119.493 0.855 . . . . 0.0 111.23 -5.348 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 161' ' ' SER . . . . . 0.467 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 68.2 p -169.0 156.18 7.14 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 124.115 0.966 . . . . 0.0 109.377 176.037 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -158.33 139.43 13.19 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.63 0.252 . . . . 0.0 111.618 173.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 27.0 t -140.44 142.66 30.09 Favored Pre-proline 0 N--CA 1.454 -0.26 0 C-N-CA 123.749 0.82 . . . . 0.0 110.78 178.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.85 -7.71 2.55 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 123.776 2.984 . . . . 0.0 112.975 173.453 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 38.0 m -64.46 -34.03 77.25 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 122.967 0.507 . . . . 0.0 110.977 -179.382 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -73.45 176.42 9.3 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.818 3.012 . . . . 0.0 111.286 175.407 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 55.3 m . . . . . 0 C--O 1.251 1.148 0 CA-C-O 117.616 -1.183 . . . . 0.0 111.087 177.546 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.4 mmm . . . . . 0 N--CA 1.476 0.841 0 CA-C-O 119.746 -0.169 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -146.42 150.59 35.93 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.875 0.47 . . . . 0.0 109.936 -179.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -134.9 0.78 2.95 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.861 0.464 . . . . 0.0 111.497 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -71.75 -3.69 23.43 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.143 0.577 . . . . 0.0 111.521 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -125.64 10.84 7.85 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.093 0.957 . . . . 0.0 111.347 178.406 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -88.57 -134.62 0.09 Allowed 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 177.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -55.64 -16.55 4.25 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 118.438 0.563 . . . . 0.0 111.077 175.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.7 tp60 -55.32 -40.1 70.77 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 123.106 0.563 . . . . 0.0 110.81 176.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -60.96 -40.59 93.93 Favored 'General case' 0 N--CA 1.458 -0.072 0 CA-C-N 118.516 0.598 . . . . 0.0 110.781 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -64.57 -55.73 18.56 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 57.6 t -59.09 -53.97 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.123 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -178.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.03 -33.07 70.33 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.165 0.586 . . . . 0.0 111.95 -177.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 56.3 m -70.26 -44.95 67.41 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 118.784 0.72 . . . . 0.0 110.047 177.174 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.6 tp -65.72 -34.51 78.35 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.385 0.612 . . . . 0.0 109.983 -179.262 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -67.57 -42.89 81.83 Favored 'General case' 0 CA--C 1.52 -0.2 0 C-N-CA 123.866 0.866 . . . . 0.0 109.763 178.298 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.0 m -63.94 -30.19 71.3 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 175.318 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.29 -36.27 76.88 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 176.483 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.9 tttm -74.4 -33.08 62.93 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 177.032 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -82.86 -30.0 28.96 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -175.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 98.7 mt -141.97 147.22 36.61 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 123.197 0.599 . . . . 0.0 110.328 -178.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.01 155.02 36.12 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.866 0.466 . . . . 0.0 111.44 179.357 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 77.6 p -150.61 -15.04 0.23 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.434 0.694 . . . . 0.0 110.557 176.262 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 177.21 -147.27 8.2 Favored Glycine 0 C--N 1.337 0.593 0 N-CA-C 108.058 -2.017 . . . . 0.0 108.058 178.565 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.1 mm -115.34 44.7 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 178.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.3 m -50.53 127.94 18.98 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.836 0.454 . . . . 0.0 111.735 -175.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.22 -14.59 64.21 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-O 119.043 -0.865 . . . . 0.0 113.548 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 66.3 p -64.42 -42.25 96.14 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 119.272 1.536 . . . . 0.0 111.082 -177.376 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -64.3 -40.63 96.33 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 177.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 55.5 mt -64.03 -37.37 79.65 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.24 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -60.39 -47.44 86.07 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 122.722 0.409 . . . . 0.0 110.231 178.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.01 -46.53 88.79 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 118.025 0.375 . . . . 0.0 111.02 177.271 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 99.4 mt -61.6 -59.4 5.26 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 122.196 -0.315 . . . . 0.0 110.806 -177.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 67.3 p -56.36 -46.41 80.03 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.3 t -64.14 -44.28 92.65 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.182 -176.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -75.25 -18.56 60.07 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 120.205 -0.598 . . . . 0.0 112.349 -179.042 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.37 -59.25 3.56 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.699 0.681 . . . . 0.0 109.288 167.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.5 mp -70.92 -13.42 62.01 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -176.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -55.41 -26.64 42.92 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -153.08 -24.04 0.15 Allowed 'General case' 0 C--N 1.339 0.143 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -178.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.529 HG22 HG22 ' A' ' 93' ' ' THR . 35.8 mm 45.44 72.45 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-O 121.837 0.827 . . . . 0.0 111.446 -177.729 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -146.6 21.69 1.31 Allowed 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.48 1.112 . . . . 0.0 109.229 179.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.573 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.57 33.24 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.231 0 C-N-CA 124.574 1.15 . . . . 0.0 109.209 -170.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.513 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.2 OUTLIER -49.12 -55.67 11.54 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -177.062 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 80.4 p -74.66 -27.15 60.3 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -173.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.653 ' H ' ' CD ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.48 -43.17 17.54 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 -179.306 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 39.2 mt -55.75 -51.77 55.7 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.414 HD13 ' HA ' ' A' ' 47' ' ' ILE . 14.9 mm -67.43 -49.3 72.68 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -176.709 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 72.2 m -57.53 -35.33 70.16 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 119.277 -0.969 . . . . 0.0 110.404 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.5 tp -70.0 -43.87 70.52 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 118.909 -0.567 . . . . 0.0 112.261 -178.457 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 36.8 pt -73.37 -33.21 39.89 Favored 'Isoleucine or valine' 0 C--N 1.34 0.187 0 CA-C-N 119.304 0.956 . . . . 0.0 111.809 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.485 HD13 HG21 ' A' ' 104' ' ' VAL . 97.3 mt -65.66 -52.59 48.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.646 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -63.06 -29.09 70.54 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.356 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 33.3 t80 -62.75 -47.71 82.34 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 174.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.9 t -62.23 -33.07 73.89 Favored 'General case' 0 C--N 1.338 0.087 0 CA-C-O 120.581 0.229 . . . . 0.0 110.567 176.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -69.23 -40.91 77.64 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.866 0.866 . . . . 0.0 112.597 -177.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.2 mt -91.92 -14.81 28.98 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -174.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.406 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 78.7 m -100.72 159.45 29.56 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -170.622 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 57' ' ' CYS . 50.7 Cg_exo -57.94 -178.66 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.367 1 C-N-CA 126.153 4.569 . . . . 0.0 115.406 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -62.84 -46.3 88.55 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.459 1.104 . . . . 0.0 112.766 -177.037 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 50.6 m -62.54 -30.53 71.37 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 20.6 m80 -79.17 -20.58 48.1 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 119.026 -0.512 . . . . 0.0 110.756 176.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.7 tppt? -67.63 -45.86 74.13 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 173.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.4 tp -63.91 -44.48 92.83 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.404 176.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.63 -40.96 95.38 Favored Glycine 0 C--N 1.339 0.712 0 N-CA-C 110.353 -1.099 . . . . 0.0 110.353 177.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 71.0 m -60.74 -44.15 97.05 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.93 -0.557 . . . . 0.0 109.792 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 20.8 mt -57.87 -42.29 84.22 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.586 0.63 . . . . 0.0 111.477 178.107 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -68.6 -34.99 76.73 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.026 0.83 . . . . 0.0 111.328 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 71.3 mt -69.98 -50.96 44.1 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 O-C-N 122.026 -0.421 . . . . 0.0 110.385 178.006 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 74.9 mt -60.11 -35.16 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.105 0 C-N-CA 124.211 1.004 . . . . 0.0 109.546 178.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -68.2 -45.99 71.85 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.848 -0.596 . . . . 0.0 110.871 178.18 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.5 t -64.57 -53.39 48.52 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 118.569 0.622 . . . . 0.0 110.955 -178.003 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 47.3 mt -63.68 -34.32 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.32 -52.79 37.18 Favored Glycine 0 CA--C 1.524 0.64 0 CA-C-O 119.927 -0.374 . . . . 0.0 112.43 -178.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.651 ' CG ' HH11 ' A' ' 74' ' ' ARG . 0.0 OUTLIER -70.27 -33.79 72.01 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 117.961 0.88 . . . . 0.0 111.001 -178.857 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.42 -48.17 70.89 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 177.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 -60.02 -45.68 91.99 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 176.301 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -57.05 -46.19 82.64 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 119.363 -0.351 . . . . 0.0 110.601 -176.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -68.84 -41.7 78.15 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 119.732 -0.787 . . . . 0.0 111.005 178.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -65.77 -23.71 66.78 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -176.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.9 t -99.94 -21.71 15.56 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 118.583 0.629 . . . . 0.0 111.231 175.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -71.8 -29.07 64.05 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 117.908 0.322 . . . . 0.0 110.64 175.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 89.7 p -70.19 -14.36 62.59 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 177.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 47.2 t-20 -82.73 154.95 24.55 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.739 0.415 . . . . 0.0 110.25 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 51.0 m -134.36 15.51 3.76 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.545 0.738 . . . . 0.0 111.099 -178.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -130.73 164.98 23.88 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.06 0.544 . . . . 0.0 110.455 -178.374 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 54.2 m -139.11 164.49 29.64 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 123.391 0.676 . . . . 0.0 110.339 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.7 m -139.45 160.93 38.69 Favored 'General case' 0 C--O 1.232 0.144 0 C-N-CA 123.217 0.607 . . . . 0.0 110.695 -178.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 80.6 p -138.53 9.25 2.66 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.238 0.615 . . . . 0.0 111.645 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -134.22 28.92 3.72 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.508 0.723 . . . . 0.0 110.174 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -138.81 141.41 30.45 Favored Pre-proline 0 CA--C 1.531 0.226 0 C-N-CA 123.687 0.795 . . . . 0.0 109.616 -178.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -57.48 162.76 9.62 Favored 'Trans proline' 0 N--CA 1.452 -0.921 0 C-N-CA 123.662 2.908 . . . . 0.0 112.23 173.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -69.53 169.95 43.48 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 111.362 -0.695 . . . . 0.0 111.362 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.529 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -151.99 -152.27 0.42 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.455 1.102 . . . . 0.0 109.334 179.902 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.3 p -49.91 -30.09 9.5 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.194 0.906 . . . . 0.0 113.28 -177.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.56 -45.62 82.61 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.397 -0.814 . . . . 0.0 110.193 175.447 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -65.45 -31.61 72.78 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 123.579 0.752 . . . . 0.0 110.179 177.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.25 -45.29 81.07 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.617 0.767 . . . . 0.0 110.572 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.4 mt -64.31 -41.74 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 174.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -61.55 -33.48 73.92 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 120.476 0.179 . . . . 0.0 110.873 179.326 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.3 m -74.14 -41.75 61.07 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 122.085 -0.384 . . . . 0.0 110.928 179.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 61.2 mt -61.42 -30.89 70.85 Favored 'General case' 0 C--O 1.228 -0.074 0 CA-C-N 118.859 0.754 . . . . 0.0 109.014 173.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.93 -14.39 23.52 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-O 119.018 -0.879 . . . . 0.0 113.424 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -100.43 -3.94 29.94 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 118.961 1.38 . . . . 0.0 111.785 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.485 HG21 HD13 ' A' ' 51' ' ' ILE . 33.1 m -127.14 -19.98 2.24 Favored 'Isoleucine or valine' 0 C--N 1.339 0.15 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.833 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.1 tp -54.78 -28.39 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 C-N-CA 123.157 0.583 . . . . 0.0 111.891 -175.582 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -58.85 -58.23 9.56 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 120.739 0.304 . . . . 0.0 111.095 -179.058 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -78.05 -26.03 48.08 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 122.401 0.281 . . . . 0.0 111.219 -178.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.0 tt -66.45 -50.3 63.83 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.425 ' HB3' ' CG2' ' A' ' 145' ' ' ILE . 75.7 mt -69.7 -52.63 23.87 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.995 -0.526 . . . . 0.0 109.901 176.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.4 t -40.28 -49.39 2.73 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.073 0.397 . . . . 0.0 112.056 175.469 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -72.06 -48.48 43.97 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-N 118.222 0.465 . . . . 0.0 111.596 -178.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.04 -29.98 61.24 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 123.314 0.646 . . . . 0.0 112.277 179.21 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.517 HD11 HG22 ' A' ' 145' ' ' ILE . 2.5 mt -85.59 -41.18 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 118.855 0.752 . . . . 0.0 111.272 173.377 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.13 -25.93 67.21 Favored 'General case' 0 N--CA 1.454 -0.235 0 O-C-N 121.903 -0.498 . . . . 0.0 111.075 -177.061 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.21 -19.4 43.34 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.119 0.968 . . . . 0.0 110.93 177.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.48 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 24.4 p -83.44 163.13 20.72 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -172.125 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -94.62 175.45 6.66 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.676 1.191 . . . . 0.0 108.444 173.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -55.86 -38.96 70.8 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.831 0.741 . . . . 0.0 112.603 -176.292 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -73.29 -37.47 66.21 Favored 'General case' 0 C--O 1.232 0.132 0 O-C-N 121.526 -0.734 . . . . 0.0 110.514 -179.536 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.48 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 43.3 m170 -72.24 -44.12 63.34 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.856 -0.592 . . . . 0.0 110.857 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.401 ' C ' ' HD2' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -58.25 -38.66 77.33 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 119.573 1.079 . . . . 0.0 109.535 175.199 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -61.21 -44.11 97.81 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.129 177.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -64.17 -35.78 81.91 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 177.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 94.2 mt -74.59 -37.7 44.17 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.067 0 CA-C-N 118.359 0.527 . . . . 0.0 110.108 -178.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -63.68 -39.73 95.05 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 176.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 58.4 ttp -66.34 -42.43 88.14 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.369 0.268 . . . . 0.0 110.289 175.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.2 tt -59.93 -44.7 94.19 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 -178.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -69.36 -37.31 77.54 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 119.151 -0.452 . . . . 0.0 111.319 178.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -60.25 -41.6 93.54 Favored 'General case' 0 N--CA 1.457 -0.102 0 CA-C-N 118.431 0.559 . . . . 0.0 110.119 177.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.7 mt -71.4 -42.54 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 122.43 0.292 . . . . 0.0 110.585 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 10.8 t90 -67.29 -25.71 66.18 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 122.174 -0.329 . . . . 0.0 111.15 -177.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -86.0 -36.75 19.58 Favored 'General case' 0 N--CA 1.455 -0.178 0 O-C-N 121.841 -0.537 . . . . 0.0 110.959 175.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 56.8 ttm-85 -67.27 -43.12 82.61 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.967 0.507 . . . . 0.0 111.284 -179.612 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 61.0 m -78.97 -16.38 57.01 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 122.609 0.364 . . . . 0.0 111.563 179.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -82.98 -18.57 64.87 Favored Glycine 0 CA--C 1.528 0.847 0 CA-C-O 119.45 -0.639 . . . . 0.0 111.816 179.19 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 37.9 tp 60.46 140.08 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.717 1.607 . . . . 0.0 112.755 -175.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 53.4 -174.95 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.984 0.913 . . . . 0.0 112.14 -175.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -77.22 157.68 30.73 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.074 -0.391 . . . . 0.0 109.992 177.582 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -115.31 10.29 15.87 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.832 0.453 . . . . 0.0 111.935 -178.074 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 8.4 t 58.92 12.84 2.5 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 16.5 p90 -138.35 10.15 2.74 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.218 0.463 . . . . 0.0 111.712 174.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 38.7 tp -64.45 -16.62 62.75 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.716 0.407 . . . . 0.0 111.65 -177.064 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -55.94 -23.85 34.54 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.952 -0.468 . . . . 0.0 111.38 177.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -53.9 -29.29 41.29 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.215 1.406 . . . . 0.0 112.485 -173.186 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.517 HG22 HD11 ' A' ' 113' ' ' ILE . 0.1 OUTLIER -128.08 -14.45 2.98 Favored 'Isoleucine or valine' 0 C--N 1.339 0.111 0 N-CA-C 112.303 0.482 . . . . 0.0 112.303 169.408 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 31.3 tpt180 -67.96 -21.91 65.06 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 118.004 0.365 . . . . 0.0 110.623 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' SER . . . . . 0.507 ' HB3' ' CE2' ' A' ' 150' ' ' PHE . 21.9 t -61.93 158.5 16.06 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 172.172 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -55.18 -76.22 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -169.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 8.4 p -46.69 -62.77 1.23 Allowed 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 -169.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' PHE . . . . . 0.507 ' CE2' ' HB3' ' A' ' 147' ' ' SER . 12.9 m-30 -22.67 -94.56 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 126.671 1.988 . . . . 0.0 113.557 -173.242 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -101.87 -5.1 25.18 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 172.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 19.6 mmt -99.72 -2.04 36.29 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 119.653 1.115 . . . . 0.0 112.928 -174.465 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -56.09 -28.18 56.65 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 119.311 0.96 . . . . 0.0 111.085 174.209 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 65.6 tp . . . . . 0 C--O 1.254 1.306 0 CA-C-O 117.205 -1.378 . . . . 0.0 108.637 177.411 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 . . . . . 0 N--CA 1.473 0.705 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 38.0 t -150.38 142.72 15.84 Favored Pre-proline 0 CA--C 1.529 0.157 0 C-N-CA 122.864 0.466 . . . . 0.0 109.874 -178.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -72.72 156.25 53.39 Favored 'Trans proline' 0 N--CA 1.452 -0.962 0 C-N-CA 123.716 2.944 . . . . 0.0 111.058 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 46.3 p -145.28 149.6 35.15 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 123.438 0.695 . . . . 0.0 110.197 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -74.22 177.75 36.77 Favored 'Cis proline' 0 N--CA 1.454 -0.852 0 N-CA-C 110.359 -0.67 . . . . 0.0 110.359 -6.068 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 73.5 p -71.31 160.38 32.91 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 122.447 0.299 . . . . 0.0 111.229 178.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 162' ' ' TYR . . . . . 0.43 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 16.0 t80 -146.06 138.78 25.6 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.451 0.3 . . . . 0.0 111.477 -179.112 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.9 t -130.72 139.44 35.62 Favored Pre-proline 0 CA--C 1.53 0.197 0 C-N-CA 123.411 0.684 . . . . 0.0 110.619 176.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -58.77 -11.25 11.35 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.293 2.662 . . . . 0.0 112.318 173.518 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.48 14.9 6.04 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.706 0.802 . . . . 0.0 111.872 -175.206 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -59.54 163.66 12.56 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.693 2.262 . . . . 0.0 110.882 170.005 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 41.8 m . . . . . 0 C--O 1.252 1.229 0 CA-C-O 117.006 -1.473 . . . . 0.0 111.818 -178.883 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.2 mtm . . . . . 0 N--CA 1.478 0.952 0 N-CA-C 110.454 -0.202 . . . . 0.0 110.454 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 52.7 mm-40 -138.51 171.73 13.94 Favored 'General case' 0 N--CA 1.458 -0.073 0 C-N-CA 123.564 0.746 . . . . 0.0 110.269 -179.185 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -132.3 147.65 52.41 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.394 0.677 . . . . 0.0 109.488 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -135.06 8.01 3.45 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.616 0.367 . . . . 0.0 111.378 -177.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -118.35 22.16 12.28 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 122.942 0.497 . . . . 0.0 111.387 -179.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.408 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 22.5 t70 -85.9 -138.53 0.08 Allowed 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 178.004 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.408 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 18.1 t80 -55.11 -14.65 1.7 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.227 1.011 . . . . 0.0 111.254 176.776 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.6 tp60 -54.59 -40.53 68.93 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.315 0.646 . . . . 0.0 111.15 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -58.1 -46.62 85.22 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 118.924 0.784 . . . . 0.0 110.811 177.072 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -63.96 -50.48 68.44 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 117.964 0.347 . . . . 0.0 110.803 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 62.1 t -62.69 -54.46 33.63 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 -178.6 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.12 -29.79 67.64 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.288 0.635 . . . . 0.0 111.819 -177.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 72.6 m -75.12 -41.36 58.68 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.255 0.479 . . . . 0.0 110.534 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.4 tp -65.85 -33.52 76.03 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -67.42 -42.91 82.43 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.915 0.886 . . . . 0.0 109.819 175.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.7 t -60.69 -31.16 70.42 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 174.619 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.456 ' CE2' HD11 ' A' ' 68' ' ' ILE . 0.1 OUTLIER -70.88 -38.04 73.05 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 176.479 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -73.26 -24.3 60.44 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.501 0.32 . . . . 0.0 111.565 177.147 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -68.22 -23.58 64.83 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 122.971 0.508 . . . . 0.0 112.254 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.6 pp -97.18 166.35 11.61 Favored 'General case' 0 C--N 1.339 0.131 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 177.557 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.7 mtmm -128.08 -1.51 5.82 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -176.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.4 p -154.36 151.71 29.37 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 118.135 0.425 . . . . 0.0 110.641 178.626 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.32 139.34 1.13 Allowed Glycine 0 CA--C 1.524 0.648 0 C-N-CA 123.644 0.64 . . . . 0.0 112.272 178.035 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 20.8 mm -94.2 139.62 18.11 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 173.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.1 t -124.66 127.56 47.5 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 117.902 0.319 . . . . 0.0 110.203 -176.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.73 -32.44 78.09 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-O 119.497 -0.613 . . . . 0.0 112.468 -175.402 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 80.0 p -62.23 -39.28 92.29 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.404 1.102 . . . . 0.0 110.703 -175.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.4 mpt_? -68.71 -44.66 73.44 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.147 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 77.0 mt -59.91 -41.7 86.82 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.098 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -67.59 -36.97 81.89 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 118.9 -0.571 . . . . 0.0 111.569 -179.194 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.62 -41.41 88.39 Favored 'General case' 0 C--N 1.338 0.097 0 CA-C-N 119.534 1.061 . . . . 0.0 110.495 175.838 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.3 mt -62.14 -52.07 65.31 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 122.395 -0.191 . . . . 0.0 110.568 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 44.0 p -60.87 -42.01 97.08 Favored 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 122.087 -0.383 . . . . 0.0 110.753 179.506 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.9 m -55.41 -57.52 11.51 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 122.965 0.506 . . . . 0.0 111.101 179.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 63.9 m-85 -76.16 -18.65 59.01 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -173.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.43 -57.76 4.86 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 118.859 0.754 . . . . 0.0 109.141 168.221 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.5 mt -70.44 -15.2 62.8 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.851 0.86 . . . . 0.0 112.949 -175.196 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -55.6 -31.41 62.22 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -178.474 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.2 t-80 -152.74 -20.81 0.16 Allowed 'General case' 0 C--N 1.34 0.171 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.481 HG22 HG22 ' A' ' 93' ' ' THR . 35.9 mm 46.8 73.78 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-O 121.82 0.819 . . . . 0.0 111.514 -178.067 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -143.97 22.65 1.74 Allowed 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.053 1.341 . . . . 0.0 108.656 178.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.557 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.8 pt -147.17 33.42 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 C-N-CA 124.679 1.192 . . . . 0.0 109.778 -170.117 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.455 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -50.45 -54.41 22.27 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 -176.313 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 32.6 t -74.23 -32.6 63.06 Favored 'General case' 0 C--O 1.225 -0.193 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -174.575 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.707 ' H ' ' CD ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -76.77 -45.6 28.34 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -178.617 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 9.6 mm -56.44 -51.73 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 173.245 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 15.4 mm -66.84 -50.83 61.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -176.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.8 m -59.06 -33.54 70.91 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 119.635 -0.826 . . . . 0.0 110.762 179.259 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.1 tp -70.02 -43.29 71.63 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 33.1 pt -73.58 -35.13 43.91 Favored 'Isoleucine or valine' 0 C--N 1.341 0.226 0 CA-C-N 119.427 1.012 . . . . 0.0 111.481 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.46 HD13 HG21 ' A' ' 104' ' ' VAL . 97.6 mt -64.2 -52.53 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.213 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.424 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 38.8 t70 -63.44 -31.65 72.87 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.068 179.706 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -60.18 -46.13 90.77 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 175.001 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -64.64 -37.07 86.33 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-O 120.796 0.331 . . . . 0.0 110.578 177.154 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.424 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 52.3 tpt85 -67.15 -34.75 78.24 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 124.207 1.003 . . . . 0.0 112.834 -176.728 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 71.7 mt -92.25 -14.67 28.56 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -176.464 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 66.6 m -110.65 150.84 42.31 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -170.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -74.76 -170.67 0.8 Allowed 'Trans proline' 0 CA--C 1.536 0.617 1 C-N-CA 125.65 4.234 . . . . 0.0 114.303 -177.273 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -34.72 -64.38 0.26 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 128.122 2.569 . . . . 0.0 115.027 -175.044 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 37.5 m -58.09 -28.18 64.36 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 122.505 0.322 . . . . 0.0 110.896 -174.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -90.32 -16.73 28.66 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 118.522 -0.751 . . . . 0.0 111.923 -179.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -70.95 -42.32 69.95 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 169.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 59.9 tp -66.93 -47.49 71.53 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 176.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.64 -46.04 93.86 Favored Glycine 0 C--N 1.338 0.662 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 178.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 92.2 p -63.07 -41.45 99.44 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 117.574 0.687 . . . . 0.0 110.163 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 31.4 mt -61.68 -40.25 94.3 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 119.06 0.845 . . . . 0.0 111.487 177.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -67.84 -34.47 76.77 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 119.721 1.146 . . . . 0.0 111.147 177.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.456 HD11 ' CE2' ' A' ' 17' ' ' PHE . 69.3 mt -68.3 -49.05 70.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 O-C-N 121.72 -0.613 . . . . 0.0 110.497 177.172 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.25 -34.6 64.79 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.077 0 C-N-CA 124.13 0.972 . . . . 0.0 109.39 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -67.95 -44.17 77.41 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.162 0.585 . . . . 0.0 110.505 177.554 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 14.3 m -67.64 -49.88 60.71 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 119.725 -0.79 . . . . 0.0 111.038 -177.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 67.5 mt -67.11 -38.13 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 179.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.15 -46.7 78.2 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 -178.163 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.408 HH22 ' C ' ' B' ' 166' ' ' SEP . 9.4 mtp-105 -69.22 -36.72 77.52 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 117.257 0.528 . . . . 0.0 110.773 178.384 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.16 -40.08 86.59 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 177.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.4 m-30 -64.99 -48.2 74.82 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 175.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.3 tp -56.9 -43.42 81.35 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 123.367 0.417 . . . . 0.0 109.968 -177.447 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -67.3 -42.43 83.75 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 122.523 -0.111 . . . . 0.0 110.874 178.198 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -62.8 -40.9 98.8 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 111.444 0.164 . . . . 0.0 111.444 -176.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.5 t -84.02 -26.99 28.68 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.409 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 13.7 tpp180 -75.07 -24.13 58.13 Favored 'General case' 0 C--N 1.34 0.193 0 CA-C-N 118.26 0.482 . . . . 0.0 110.807 175.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.4 t -68.21 -15.05 63.42 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 122.646 0.378 . . . . 0.0 111.055 176.284 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -101.82 158.84 15.83 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.48 0.712 . . . . 0.0 110.146 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 22.8 t -76.86 159.5 30.0 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.921 0.488 . . . . 0.0 110.78 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -76.77 157.72 31.42 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.039 0.447 . . . . 0.0 110.578 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 82.9 p -151.35 163.74 38.24 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.956 0.502 . . . . 0.0 110.419 179.266 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 79.6 p -144.13 5.25 1.29 Allowed 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.006 0.522 . . . . 0.0 111.75 179.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 80.1 p -91.8 -1.96 57.12 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 122.92 0.488 . . . . 0.0 111.974 -178.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -148.13 160.2 43.15 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.878 0.471 . . . . 0.0 110.159 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 25.8 pttm -95.51 154.67 39.23 Favored Pre-proline 0 C--O 1.233 0.228 0 C-N-CA 123.631 0.772 . . . . 0.0 110.678 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.47 157.67 60.1 Favored 'Trans proline' 0 N--CA 1.453 -0.867 0 C-N-CA 123.394 2.729 . . . . 0.0 110.976 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -173.94 23.14 0.07 OUTLIER Glycine 0 CA--C 1.529 0.948 0 CA-C-O 119.785 -0.453 . . . . 0.0 112.236 -178.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.481 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -145.67 -151.12 0.36 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.371 0.668 . . . . 0.0 109.883 -176.848 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 23.0 p -48.61 -30.62 5.57 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.107 0.867 . . . . 0.0 113.248 -178.354 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.64 -46.62 81.77 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.313 -0.867 . . . . 0.0 109.922 175.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 41.0 t60 -65.81 -32.05 73.36 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.949 -0.568 . . . . 0.0 109.955 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.27 -45.35 88.43 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 123.686 0.794 . . . . 0.0 110.597 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.4 mt -63.01 -42.72 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.171 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 174.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -59.83 -35.31 74.48 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 121.232 -0.187 . . . . 0.0 111.156 179.125 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.6 m -72.49 -41.33 66.1 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-O 119.588 -0.244 . . . . 0.0 111.235 178.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 55.3 mt -60.97 -29.62 69.77 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 119.459 -0.896 . . . . 0.0 108.955 174.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.8 -14.45 16.02 Favored Glycine 0 CA--C 1.533 1.159 0 CA-C-O 118.928 -0.929 . . . . 0.0 113.923 178.131 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -104.64 -3.73 23.39 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.261 1.531 . . . . 0.0 112.135 -178.809 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.46 HG21 HD13 ' A' ' 51' ' ' ILE . 35.5 m -123.61 -17.06 4.66 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.149 0 C-N-CA 122.784 0.433 . . . . 0.0 111.949 -178.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -48.3 -28.64 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -58.73 -59.05 6.03 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 117.917 0.326 . . . . 0.0 111.497 -178.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -70.97 -30.71 67.06 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 117.841 0.291 . . . . 0.0 110.711 -177.171 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.1 mp -63.02 -55.14 28.24 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.497 -0.287 . . . . 0.0 110.44 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.417 ' HB3' ' CG2' ' A' ' 145' ' ' ILE . 62.3 mt -71.36 -49.18 44.9 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 118.137 0.426 . . . . 0.0 110.965 -178.105 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.534 ' HB2' ' CE1' ' A' ' 150' ' ' PHE . 66.0 p -49.94 -52.04 36.5 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 119.003 -0.522 . . . . 0.0 112.327 178.297 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -72.53 -41.99 65.24 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 119.187 0.903 . . . . 0.0 111.709 -177.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.69 -41.76 82.29 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.575 0.625 . . . . 0.0 111.221 -178.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 10.5 mt -78.55 -35.14 18.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 118.822 0.737 . . . . 0.0 111.12 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.01 -30.14 70.63 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 120.316 -0.554 . . . . 0.0 111.119 -178.228 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.42 -19.89 48.89 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.141 0.576 . . . . 0.0 110.303 176.353 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 40.3 m -78.16 156.14 30.05 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -173.38 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.1 t-20 -88.75 176.48 7.06 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 169.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -55.65 -38.47 69.61 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.916 0.78 . . . . 0.0 111.433 -178.073 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -66.62 -43.51 84.57 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.662 -0.649 . . . . 0.0 111.01 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -72.74 -35.01 67.43 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 119.493 -0.289 . . . . 0.0 110.683 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -41.57 87.98 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 118.828 0.74 . . . . 0.0 109.139 172.698 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -66.45 -39.21 88.74 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.222 -178.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -61.81 -39.95 93.53 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 119.372 -0.347 . . . . 0.0 111.196 175.433 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.2 mt -73.36 -34.97 44.93 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.11 0 CA-C-N 118.437 0.562 . . . . 0.0 109.709 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -66.65 -39.32 88.17 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 122.224 -0.298 . . . . 0.0 110.52 177.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 25.6 ttt -64.19 -46.28 84.63 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 176.426 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.5 tt -55.88 -47.45 77.34 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.942 0.497 . . . . 0.0 110.663 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.1 mt -75.51 -30.9 59.96 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -177.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -65.71 -41.99 91.66 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 177.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 95.3 mt -69.61 -38.73 77.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 177.487 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 44.2 t90 -60.04 -34.99 74.14 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 117.674 0.215 . . . . 0.0 110.666 177.276 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -72.85 -42.59 63.58 Favored 'General case' 0 N--CA 1.456 -0.13 0 O-C-N 122.37 -0.206 . . . . 0.0 110.663 177.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 57.4 mmm-85 -75.57 -14.15 60.38 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 60.2 p -59.78 -17.72 37.86 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -179.125 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 148.23 1.58 0.47 Allowed Glycine 0 CA--C 1.532 1.141 0 CA-C-O 119.558 -0.579 . . . . 0.0 113.217 178.29 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 74.9 mt -72.8 164.06 27.16 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.139 0.969 . . . . 0.0 110.546 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -71.17 164.23 26.05 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.842 0.457 . . . . 0.0 110.88 -177.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -74.09 -6.02 45.1 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.054 0.541 . . . . 0.0 112.229 -176.131 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -138.94 156.9 46.89 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 123.133 0.573 . . . . 0.0 109.964 178.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 94.0 p -151.95 170.2 20.43 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 123.038 0.535 . . . . 0.0 110.354 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -111.73 9.16 20.88 Favored 'General case' 0 CA--C 1.528 0.096 0 C-N-CA 123.233 0.613 . . . . 0.0 111.634 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 84.9 mt -81.23 146.19 30.58 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 122.412 0.285 . . . . 0.0 110.678 -179.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' ASN . . . . . 0.464 ' HA ' ' HB3' ' A' ' 146' ' ' ARG . 53.5 t30 -114.81 -2.9 12.84 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.384 0.673 . . . . 0.0 111.215 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -47.49 -39.73 16.7 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 126.295 1.838 . . . . 0.0 113.223 -167.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.524 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -122.75 -9.24 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.152 0 CA-C-N 117.725 0.239 . . . . 0.0 111.497 170.579 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.464 ' HB3' ' HA ' ' A' ' 143' ' ' ASN . 49.1 tpt85 -65.27 -26.13 67.95 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-O 119.332 -0.366 . . . . 0.0 110.567 -177.333 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 147' ' ' SER . . . . . 0.59 ' HB3' ' CE2' ' A' ' 150' ' ' PHE . 28.7 t -65.05 135.94 56.17 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 170.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 66.4 tttp -55.92 -50.6 70.26 Favored 'General case' 0 C--O 1.23 0.061 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -168.248 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 83.7 m -42.14 -57.92 2.32 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.143 0.429 . . . . 0.0 112.059 -169.2 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' PHE . . . . . 0.59 ' CE2' ' HB3' ' A' ' 147' ' ' SER . 14.5 m-85 -35.78 -102.46 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 127.748 2.419 . . . . 0.0 114.038 -174.017 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -85.93 -7.12 58.89 Favored 'General case' 0 C--N 1.331 -0.203 0 O-C-N 121.457 -0.777 . . . . 0.0 113.068 175.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 18.5 mmt -104.62 -3.64 23.53 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -172.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -62.47 -23.9 67.16 Favored 'General case' 0 C--N 1.345 0.383 0 CA-C-N 120.154 1.343 . . . . 0.0 111.344 173.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 63.1 tp . . . . . 0 C--O 1.251 1.143 0 CA-C-O 117.658 -1.163 . . . . 0.0 109.676 179.682 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 52.7 p90 . . . . . 0 N--CA 1.474 0.732 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 156' ' ' SER . . . . . 0.632 ' H ' ' CD ' ' B' ' 157' ' ' PRO . 88.1 p -132.24 -23.48 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.464 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 -178.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 157' ' ' PRO . . . . . 0.632 ' CD ' ' H ' ' B' ' 156' ' ' SER . 82.2 Cg_endo -77.15 170.83 18.94 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 CA-C-N 122.022 1.758 . . . . 0.0 110.958 179.18 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 81.1 p -124.46 179.1 5.07 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.485 0.714 . . . . 0.0 110.144 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -71.25 169.94 66.79 Favored 'Cis proline' 0 N--CA 1.454 -0.819 0 N-CA-C 110.251 -0.711 . . . . 0.0 110.251 -5.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 31.9 t -66.57 137.96 57.14 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -146.5 141.22 26.84 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 122.813 0.445 . . . . 0.0 111.44 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 16.4 t -133.8 145.69 57.08 Favored Pre-proline 0 C--O 1.233 0.213 0 C-N-CA 123.617 0.767 . . . . 0.0 111.093 -175.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.32 1.98 2.17 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 123.476 2.784 . . . . 0.0 111.341 177.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 24.2 p -72.08 -28.13 63.12 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 118.711 -0.661 . . . . 0.0 112.011 176.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 166' ' ' SEP . . . . . 0.408 ' C ' HH22 ' A' ' 74' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -69.6 175.94 7.31 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 123.921 3.08 . . . . 0.0 111.916 174.461 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 69.5 m . . . . . 0 C--O 1.25 1.094 0 CA-C-O 117.745 -1.121 . . . . 0.0 110.528 178.709 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.5 ptp . . . . . 0 N--CA 1.478 0.937 0 CA-C-O 120.445 0.164 . . . . 0.0 110.676 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -137.41 153.71 50.1 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 123.291 0.636 . . . . 0.0 109.871 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 65.9 tt0 -129.96 142.74 50.6 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.489 0.716 . . . . 0.0 109.134 177.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 27.8 t70 60.25 155.87 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.868 1.267 . . . . 0.0 112.885 -174.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -140.73 19.46 2.34 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 122.801 0.441 . . . . 0.0 111.723 -177.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -81.79 -141.68 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.607 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -55.77 -13.05 1.51 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.546 0.739 . . . . 0.0 111.557 177.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -52.93 -44.53 67.11 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.512 0.725 . . . . 0.0 110.94 177.209 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -58.13 -41.74 84.33 Favored 'General case' 0 C--O 1.227 -0.095 0 CA-C-N 118.542 0.61 . . . . 0.0 111.523 177.609 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -64.86 -53.17 50.95 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 118.166 0.439 . . . . 0.0 110.302 -178.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.1 t -61.69 -53.73 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -178.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.51 -32.31 68.71 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 123.236 0.614 . . . . 0.0 111.916 -178.113 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 55.7 m -72.59 -44.95 61.34 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 118.403 0.547 . . . . 0.0 110.444 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.9 tp -65.47 -32.45 74.08 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.115 0.416 . . . . 0.0 109.975 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -67.81 -45.64 74.17 Favored 'General case' 0 N--CA 1.458 -0.058 0 C-N-CA 123.876 0.871 . . . . 0.0 109.777 176.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.0 t -63.43 -27.9 69.6 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.225 176.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.25 -43.57 70.28 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 175.646 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -70.72 -26.63 63.48 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.014 0.926 . . . . 0.0 112.359 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -56.41 -31.83 64.27 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -175.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.8 tp -159.5 155.72 26.95 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 118.32 0.509 . . . . 0.0 110.085 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -71.3 141.91 50.48 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 176.001 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 59.0 m -142.83 168.43 19.72 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 121.071 0.463 . . . . 0.0 111.341 -175.494 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -75.99 25.08 1.55 Allowed Glycine 0 CA--C 1.529 0.95 0 C-N-CA 124.212 0.91 . . . . 0.0 112.431 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.8 mm 57.65 49.08 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 124.074 0.95 . . . . 0.0 111.082 -178.054 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.3 t -57.98 132.74 54.35 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.785 0.434 . . . . 0.0 111.01 -178.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.89 -27.62 71.5 Favored Glycine 0 C--N 1.339 0.697 0 C-N-CA 123.582 0.61 . . . . 0.0 113.177 -175.066 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.431 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 39.6 t -59.08 -43.84 91.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 117.901 0.851 . . . . 0.0 111.515 -174.725 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -65.5 -42.32 92.27 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -179.199 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 52.9 mt -62.53 -41.34 91.64 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.183 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.2 mmtt -64.59 -35.68 81.76 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 119.327 -0.368 . . . . 0.0 111.383 -179.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.431 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -65.93 -46.25 78.91 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 118.712 0.687 . . . . 0.0 110.115 174.025 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.22 -56.28 23.53 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 121.237 -0.185 . . . . 0.0 110.627 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.433 HG21 ' OG ' ' A' ' 71' ' ' SER . 77.3 p -58.13 -48.29 80.69 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.455 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 t -63.02 -44.0 97.16 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 120.084 -0.646 . . . . 0.0 111.389 -176.469 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -73.57 -22.48 60.05 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.652 0.66 . . . . 0.0 112.418 -178.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.82 -56.45 9.1 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 118.991 0.814 . . . . 0.0 109.172 168.421 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 55.7 mt -68.89 -15.84 63.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.157 0.983 . . . . 0.0 112.666 -175.449 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -59.81 -25.81 65.26 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.6 t-160 -150.23 -27.81 0.24 Allowed 'General case' 0 C--N 1.34 0.16 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -176.331 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.489 HG22 HG22 ' A' ' 93' ' ' THR . 42.2 mm 45.21 74.18 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-O 121.815 0.817 . . . . 0.0 111.899 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -149.41 22.84 0.92 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.435 1.094 . . . . 0.0 109.61 179.383 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.541 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -147.7 39.54 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 124.69 1.196 . . . . 0.0 109.131 -170.413 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.427 ' HB3' ' HA ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -52.33 -54.87 26.08 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -174.002 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.405 ' N ' ' HG2' ' A' ' 43' ' ' GLU . 78.9 p -75.77 -27.06 57.9 Favored 'General case' 0 CA--C 1.521 -0.166 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -172.29 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.699 ' H ' ' CD ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -81.49 -43.83 18.26 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.146 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 36.7 mt -55.91 -53.5 37.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 171.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' A' ' 47' ' ' ILE . 16.0 mm -66.58 -47.87 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 CA-C-O 119.078 -0.487 . . . . 0.0 112.027 -176.084 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 73.6 m -59.15 -35.5 73.62 Favored 'General case' 0 C--O 1.23 0.054 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.153 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.3 tp -68.53 -43.49 76.62 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 119.17 -0.443 . . . . 0.0 112.055 -178.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 33.2 pt -74.03 -33.33 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 119.217 0.917 . . . . 0.0 112.265 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.482 HD13 HG21 ' A' ' 104' ' ' VAL . 97.1 mt -66.3 -50.32 68.99 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 177.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -57.86 -42.1 83.81 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.266 178.153 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -58.39 -41.09 84.08 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 175.467 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.5 t -63.31 -46.22 87.73 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -178.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -80.47 -23.14 40.39 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -175.572 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.3 mt -84.87 -19.51 32.25 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 179.163 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.4 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 72.9 m -104.2 156.22 36.07 Favored Pre-proline 0 CA--C 1.534 0.339 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -170.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 57' ' ' CYS . 85.4 Cg_exo -50.74 176.36 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.537 1 C-N-CA 126.498 4.798 . . . . 0.0 115.997 175.067 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.454 ' HB2' ' HE3' ' A' ' 115' ' ' LYS . 10.4 p-10 -56.18 -49.61 73.53 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 125.905 1.682 . . . . 0.0 114.069 -174.019 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 52.8 m -62.75 -27.55 69.36 Favored 'General case' 0 CA--C 1.522 -0.101 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -81.95 -18.68 42.7 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 118.688 -0.673 . . . . 0.0 111.057 178.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -74.72 -40.2 61.44 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 119.381 0.991 . . . . 0.0 108.525 171.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 61.5 tp -64.35 -51.49 63.08 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 174.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.5 -36.82 90.81 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.765 -0.934 . . . . 0.0 110.765 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.7 t -60.58 -48.4 81.94 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.976 0.388 . . . . 0.0 110.137 177.012 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 31.1 mt -59.88 -35.55 75.06 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 118.55 0.614 . . . . 0.0 111.357 178.115 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -67.68 -37.23 82.04 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.117 0.872 . . . . 0.0 110.789 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 66.8 mt -70.31 -47.97 63.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 O-C-N 121.683 -0.635 . . . . 0.0 110.219 178.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 85.6 mt -59.98 -38.85 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 C-N-CA 123.993 0.917 . . . . 0.0 109.279 178.162 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -65.99 -42.97 89.12 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 118.787 -0.625 . . . . 0.0 110.555 178.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.433 ' OG ' HG21 ' A' ' 33' ' ' THR . 6.6 t -65.66 -54.6 25.37 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.621 0.646 . . . . 0.0 111.74 -177.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 55.8 mt -62.82 -33.48 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.18 -50.99 41.53 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-O 119.612 -0.549 . . . . 0.0 112.451 -179.449 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.634 ' CG ' HH11 ' A' ' 74' ' ' ARG . 0.0 OUTLIER -70.82 -33.6 70.85 Favored 'General case' 0 CA--C 1.523 -0.07 0 CA-C-N 118.184 0.992 . . . . 0.0 110.72 -178.475 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.79 -44.49 77.26 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 177.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -62.83 -47.02 85.23 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 176.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.5 tp -57.42 -46.57 83.37 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 123.38 0.425 . . . . 0.0 110.379 -176.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -68.61 -44.45 74.27 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.094 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -68.9 -21.65 64.22 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -176.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 6.9 t -96.55 -28.01 14.58 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-N 118.675 0.67 . . . . 0.0 111.978 178.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 -80.72 -21.47 41.14 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 118.657 0.662 . . . . 0.0 111.58 176.555 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 95.2 p -68.55 -14.1 62.78 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 175.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -100.52 163.63 12.27 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.347 0.659 . . . . 0.0 110.186 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 53.7 m -133.8 158.82 42.4 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.15 0.58 . . . . 0.0 110.547 -179.162 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 50.0 t-20 -81.35 141.39 34.05 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.7 0.4 . . . . 0.0 110.573 -179.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.6 t -153.59 -13.33 0.14 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.935 0.494 . . . . 0.0 111.417 178.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 77.8 p -158.31 163.46 37.33 Favored 'General case' 0 CA--C 1.527 0.081 0 C-N-CA 123.085 0.554 . . . . 0.0 110.236 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 51.0 m -71.25 148.31 47.33 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.735 0.302 . . . . 0.0 110.54 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -152.17 159.21 43.65 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.869 0.467 . . . . 0.0 109.949 -178.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -80.55 154.15 73.73 Favored Pre-proline 0 CA--C 1.532 0.281 0 C-N-CA 123.02 0.528 . . . . 0.0 110.628 179.412 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -69.43 155.88 65.79 Favored 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 123.393 2.729 . . . . 0.0 110.816 178.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 134.92 -160.88 24.45 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 111.833 -0.507 . . . . 0.0 111.833 179.228 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.489 HG22 HG22 ' A' ' 40' ' ' ILE . 0.6 OUTLIER 54.07 -173.37 0.04 OUTLIER 'General case' 0 C--O 1.227 -0.094 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -179.816 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 23.1 p -50.29 -32.03 15.89 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.058 1.343 . . . . 0.0 113.758 -172.266 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.14 -48.04 81.87 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.648 0.658 . . . . 0.0 109.973 176.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 30.3 m80 -75.34 -21.42 58.39 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.586 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.0 -44.88 83.49 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.469 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.2 mt -64.26 -43.7 97.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 174.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -58.97 -33.74 70.99 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.48 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.8 m -73.75 -42.6 60.88 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-O 119.301 -0.381 . . . . 0.0 110.887 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 56.8 mt -60.83 -29.55 69.56 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-N 119.053 0.842 . . . . 0.0 109.233 174.136 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.21 -14.31 25.17 Favored Glycine 0 CA--C 1.531 1.038 0 CA-C-O 119.104 -0.831 . . . . 0.0 113.635 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.8 -4.58 27.72 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.873 1.337 . . . . 0.0 112.044 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.482 HG21 HD13 ' A' ' 51' ' ' ILE . 27.0 m -126.18 -18.44 2.97 Favored 'Isoleucine or valine' 0 C--N 1.337 0.056 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -178.611 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.0 tp -49.62 -27.84 3.33 Favored 'Isoleucine or valine' 0 C--N 1.339 0.15 0 C-N-CA 123.753 0.821 . . . . 0.0 112.293 -175.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.9 pt20 -61.97 -49.69 75.1 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 117.764 0.256 . . . . 0.0 110.709 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -70.12 -36.51 74.86 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 -177.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.5 mt -63.81 -53.41 51.26 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.612 -177.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.432 ' O ' HG13 ' A' ' 113' ' ' ILE . 65.2 mt -66.05 -64.41 0.86 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.536 -0.745 . . . . 0.0 109.358 177.572 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.489 ' HB2' ' CE1' ' A' ' 150' ' ' PHE . 84.6 p -39.91 -49.69 2.44 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.666 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -71.66 -44.41 64.33 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 119.496 1.044 . . . . 0.0 111.404 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.13 -43.02 82.0 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.717 0.689 . . . . 0.0 110.874 -178.54 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.1 OUTLIER -76.88 -32.92 20.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 CA-C-N 119.01 0.823 . . . . 0.0 111.953 178.661 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.95 -30.05 68.41 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.34 0.518 . . . . 0.0 110.902 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.454 ' HE3' ' HB2' ' A' ' 59' ' ' ASP . 0.8 OUTLIER -77.62 -19.46 55.47 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.328 0.651 . . . . 0.0 110.227 175.577 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 56.0 m -81.29 153.96 26.81 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -173.23 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -92.35 177.61 6.09 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 170.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -55.36 -36.33 66.21 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.001 0.819 . . . . 0.0 111.608 -177.582 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -67.27 -47.13 71.58 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.779 -0.576 . . . . 0.0 110.382 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -70.11 -33.48 71.9 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 119.474 -0.298 . . . . 0.0 110.519 -179.404 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -42.25 93.21 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 118.591 0.632 . . . . 0.0 109.325 173.553 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -66.44 -40.25 89.37 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.149 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp -61.74 -43.83 98.08 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 119.661 -0.209 . . . . 0.0 110.996 176.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 95.6 mt -69.81 -38.38 75.77 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -63.95 -40.89 97.48 Favored 'General case' 0 CA--C 1.523 -0.091 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 60.9 ttp -63.27 -43.92 96.58 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 177.562 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 8.2 tt -58.76 -45.01 90.73 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 97.1 mt -73.19 -32.9 65.09 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -66.28 -38.76 88.54 Favored 'General case' 0 N--CA 1.458 -0.051 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 177.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 90.9 mt -73.17 -35.03 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.179 0 C-N-CA 122.54 0.336 . . . . 0.0 110.16 178.044 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 87.2 t90 -64.66 -38.17 90.08 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 117.942 0.337 . . . . 0.0 110.187 177.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -73.53 -36.77 65.74 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.206 0.202 . . . . 0.0 110.549 177.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 49.1 ttm-85 -67.66 -30.31 69.82 Favored 'General case' 0 CA--C 1.527 0.06 0 C-N-CA 123.255 0.622 . . . . 0.0 110.879 178.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 51.0 m -82.58 -8.2 59.61 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.357 0.663 . . . . 0.0 111.719 177.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -66.87 163.08 44.88 Favored Glycine 0 CA--C 1.528 0.851 0 N-CA-C 112.142 -0.383 . . . . 0.0 112.142 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 37.8 tp -88.79 -8.58 54.14 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.025 0.53 . . . . 0.0 111.081 -178.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -138.84 163.88 31.11 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.181 0.592 . . . . 0.0 110.166 -178.011 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -84.89 160.45 20.14 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.821 0.449 . . . . 0.0 111.532 -179.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 95.8 mttt 58.9 163.51 0.04 OUTLIER 'General case' 0 C--N 1.341 0.218 0 C-N-CA 125.651 1.581 . . . . 0.0 113.334 -178.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 96.9 p -90.26 168.4 11.95 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.024 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -138.92 15.45 2.67 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.185 0.594 . . . . 0.0 111.335 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 85.9 mt -124.2 142.36 51.3 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.162 0.585 . . . . 0.0 110.425 -177.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' ASN . . . . . 0.415 ' HA ' ' HB3' ' A' ' 146' ' ' ARG . 51.3 p-10 -82.5 -13.36 56.81 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.349 0.659 . . . . 0.0 111.812 178.487 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -47.2 -38.3 11.76 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 126.062 1.745 . . . . 0.0 113.898 -167.344 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.527 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -125.35 -14.35 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 CA-C-N 117.914 0.325 . . . . 0.0 110.506 170.193 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.547 ' C ' ' H ' ' A' ' 148' ' ' LYS . 28.0 ttt180 -63.13 -14.65 51.15 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 123.408 0.683 . . . . 0.0 110.86 -178.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 9.3 t -68.99 18.62 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 120.769 0.318 . . . . 0.0 111.632 169.248 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.547 ' H ' ' C ' ' A' ' 146' ' ' ARG . 67.6 mttm 55.63 -74.25 0.01 OUTLIER 'General case' 0 C--N 1.34 0.193 0 C-N-CA 128.347 2.659 . . . . 0.0 116.534 175.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 26.7 p -37.81 -32.23 0.06 Allowed 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -168.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' PHE . . . . . 0.489 ' CE1' ' HB2' ' A' ' 110' ' ' SER . 31.2 m-85 -48.06 -91.07 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.192 1.397 . . . . 0.0 113.568 178.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -77.05 -14.65 59.79 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.747 176.159 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 20.3 mmt -88.05 -20.8 25.27 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -172.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -74.79 -14.38 60.69 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.432 1.014 . . . . 0.0 112.122 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 98.1 mt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 117.242 -1.361 . . . . 0.0 110.599 -178.124 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 . . . . . 0 N--CA 1.475 0.815 0 CA-C-O 119.805 -0.141 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 54.6 m -112.0 151.54 43.63 Favored Pre-proline 0 C--O 1.233 0.211 0 C-N-CA 122.566 0.346 . . . . 0.0 111.035 -177.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -75.01 -179.16 4.72 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 124.214 3.276 . . . . 0.0 110.892 177.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 30.9 p -65.44 161.31 20.18 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 122.956 0.502 . . . . 0.0 110.998 177.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 160' ' ' PRO . . . . . 0.442 ' HG2' ' H ' ' B' ' 161' ' ' SER . 59.4 Cg_endo -67.75 -60.43 0.08 OUTLIER 'Cis proline' 0 N--CA 1.453 -0.902 0 CA-C-N 118.947 0.66 . . . . 0.0 110.868 -5.202 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 161' ' ' SER . . . . . 0.442 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 34.2 t -175.53 168.3 3.21 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 125.14 1.376 . . . . 0.0 108.079 178.369 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 162' ' ' TYR . . . . . 0.415 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 48.4 t80 -152.02 132.92 14.17 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.187 -0.321 . . . . 0.0 111.804 171.551 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.1 t -135.29 140.98 36.07 Favored Pre-proline 0 N--CA 1.455 -0.224 0 C-N-CA 123.181 0.592 . . . . 0.0 110.791 177.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -65.71 -6.56 14.22 Favored 'Trans proline' 0 N--CA 1.45 -1.052 0 C-N-CA 122.734 2.29 . . . . 0.0 111.302 177.115 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 71.1 p -92.02 11.88 23.77 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 113.345 0.868 . . . . 0.0 113.345 -177.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -57.28 148.92 67.83 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 122.543 2.162 . . . . 0.0 110.096 169.111 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 51.1 m . . . . . 0 C--O 1.25 1.079 0 CA-C-O 117.281 -1.342 . . . . 0.0 111.043 -178.862 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.5 tpt . . . . . 0 N--CA 1.476 0.838 0 N-CA-C 110.847 -0.057 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -132.28 4.64 4.05 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.503 0.721 . . . . 0.0 110.004 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.56 153.03 35.04 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.477 1.111 . . . . 0.0 109.79 -177.828 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 32.9 t0 53.16 27.41 5.89 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.794 0.838 . . . . 0.0 112.987 177.63 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -84.68 38.08 0.68 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.424 0.69 . . . . 0.0 110.907 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.436 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 14.1 t70 -77.18 -154.37 0.06 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.783 0.833 . . . . 0.0 110.297 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.436 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 10.6 t80 -55.59 -14.49 2.15 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.863 0.865 . . . . 0.0 111.297 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -55.27 -35.25 64.83 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.908 0.883 . . . . 0.0 111.485 176.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.6 m-20 -61.82 -45.46 93.72 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.359 0.981 . . . . 0.0 109.292 178.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -66.18 -48.39 70.87 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 110.557 -0.164 . . . . 0.0 110.557 -177.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.6 t -65.92 -54.67 24.82 Favored 'Isoleucine or valine' 0 C--N 1.339 0.118 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 -178.363 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.59 -31.76 69.76 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.828 0.451 . . . . 0.0 111.737 -178.192 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 69.5 m -73.63 -40.35 63.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 120.214 -0.595 . . . . 0.0 110.336 176.8 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.9 tp -66.28 -31.86 72.93 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.009 0.433 . . . . 0.0 109.852 179.093 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -69.74 -44.19 70.78 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.787 0.835 . . . . 0.0 109.683 175.155 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.2 t -63.26 -26.06 68.61 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 175.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.506 ' CE2' HD11 ' A' ' 68' ' ' ILE . 0.2 OUTLIER -71.19 -45.81 62.61 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 174.992 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -60.91 -31.64 71.14 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.865 0.466 . . . . 0.0 110.783 177.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -69.28 -14.12 62.77 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 94.3 mt -69.22 -46.26 67.81 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 118.844 0.747 . . . . 0.0 111.174 -177.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 94.0 mttt 47.64 24.54 0.55 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.367 1.067 . . . . 0.0 113.707 -179.274 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 96.1 p -143.75 -16.9 0.61 Allowed 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 113.952 1.093 . . . . 0.0 113.952 -176.417 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 173.6 -133.21 2.51 Favored Glycine 0 CA--C 1.523 0.585 0 CA-C-N 119.407 1.003 . . . . 0.0 111.9 179.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.8 mt -131.71 150.61 34.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 124.503 1.121 . . . . 0.0 109.33 -173.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.5 m -139.3 123.88 18.38 Favored 'General case' 0 CA--C 1.523 -0.093 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 176.143 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.14 -26.96 73.35 Favored Glycine 0 CA--C 1.525 0.714 0 CA-C-O 119.489 -0.617 . . . . 0.0 112.682 -174.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.425 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 83.4 p -65.28 -35.22 80.34 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 118.398 1.099 . . . . 0.0 109.87 -179.173 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.6 mmt-85 -68.08 -46.0 72.23 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 73.0 mt -60.87 -36.38 71.29 Favored 'Isoleucine or valine' 0 C--O 1.231 0.1 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.104 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.9 mmtt -69.26 -40.86 77.58 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 119.009 -0.52 . . . . 0.0 111.504 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.39 -38.48 87.61 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.188 0.904 . . . . 0.0 110.953 176.153 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.7 mt -63.32 -57.84 9.06 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 122.161 0.184 . . . . 0.0 110.797 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.417 HG21 ' HB2' ' A' ' 71' ' ' SER . 33.4 p -56.27 -42.12 76.95 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 118.074 0.397 . . . . 0.0 111.272 177.028 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.0 m -55.65 -55.08 36.38 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 119.01 -0.519 . . . . 0.0 110.913 -179.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -67.86 -37.18 81.5 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.326 -0.949 . . . . 0.0 111.584 -176.513 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.09 -58.66 7.22 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 118.063 0.392 . . . . 0.0 110.978 177.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.45 HD21 ' HB1' ' A' ' 75' ' ' ALA . 8.2 mp -67.95 -25.09 65.28 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -178.034 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -71.71 -19.15 62.1 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 117.857 0.299 . . . . 0.0 111.091 176.31 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -146.74 52.83 1.1 Allowed 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.36 0.264 . . . . 0.0 111.456 -175.123 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.534 HG22 HG22 ' A' ' 93' ' ' THR . 33.3 mm -65.06 76.18 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-O 121.757 0.789 . . . . 0.0 109.908 171.133 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -144.13 10.96 1.53 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.597 1.559 . . . . 0.0 109.063 174.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.464 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -146.15 95.26 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 C-N-CA 125.68 1.592 . . . . 0.0 107.935 -176.572 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.561 ' CD ' ' H ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -91.76 -79.27 0.38 Allowed 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -177.18 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.561 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 46.1 m -57.72 -21.31 40.14 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 123.554 0.741 . . . . 0.0 112.96 -174.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.558 ' HD2' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -76.02 -54.07 7.41 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.349 0.659 . . . . 0.0 110.346 178.632 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 6.2 mt -56.36 -44.25 79.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 173.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.5 mm -67.14 -47.38 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.166 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.082 -179.185 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 42.7 t -58.95 -34.49 71.83 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-N 118.406 0.548 . . . . 0.0 109.968 178.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.9 tp -68.71 -45.42 71.64 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.811 -179.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.9 pt -72.3 -34.93 50.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 119.415 1.007 . . . . 0.0 112.183 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.494 HD13 HG21 ' A' ' 104' ' ' VAL . 96.3 mt -64.55 -51.71 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 178.655 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -64.91 -27.92 69.18 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.078 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -61.94 -46.81 87.68 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 175.009 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.7 t -61.86 -38.8 89.63 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.39 175.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -61.24 -42.77 99.19 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.621 0.769 . . . . 0.0 112.602 -176.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 83.7 mt -86.23 -14.76 42.9 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 -175.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.421 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 76.0 m -105.21 155.74 37.31 Favored Pre-proline 0 CA--C 1.533 0.309 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -170.569 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.421 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 92.3 Cg_endo -69.17 -176.44 1.32 Allowed 'Trans proline' 0 N--CA 1.459 -0.532 1 C-N-CA 125.431 4.088 . . . . 0.0 113.142 -178.882 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -54.82 -44.32 73.75 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.382 1.473 . . . . 0.0 113.98 -171.638 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.0 m -58.03 -29.32 65.25 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -92.86 -14.48 27.63 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 118.892 -0.575 . . . . 0.0 111.672 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -65.85 -49.0 69.73 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 169.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 44.5 tp -67.74 -48.21 67.1 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.346 179.334 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -56.84 -43.64 92.27 Favored Glycine 0 C--N 1.337 0.598 0 N-CA-C 110.73 -0.948 . . . . 0.0 110.73 179.397 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.2 t -67.5 -35.46 79.18 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.699 -0.667 . . . . 0.0 110.91 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 35.9 mt -60.9 -34.58 74.87 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 119.649 1.113 . . . . 0.0 110.66 173.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -71.67 -32.47 67.91 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.887 0.767 . . . . 0.0 111.347 175.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.506 HD11 ' CE2' ' A' ' 17' ' ' PHE . 92.6 mt -70.7 -44.07 76.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 CA-C-N 118.798 0.726 . . . . 0.0 110.413 176.163 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.1 mt -63.65 -35.41 72.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 177.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -70.07 -39.49 75.6 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 119.057 -0.496 . . . . 0.0 111.252 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.417 ' HB2' HG21 ' A' ' 33' ' ' THR . 95.8 p -69.72 -55.33 10.23 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 118.907 0.776 . . . . 0.0 110.5 -176.418 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 39.3 mt -64.75 -33.42 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.279 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.42 -52.21 45.59 Favored Glycine 0 CA--C 1.524 0.622 0 CA-C-O 119.846 -0.419 . . . . 0.0 112.239 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.651 ' CG ' HH11 ' A' ' 74' ' ' ARG . 0.0 OUTLIER -72.06 -31.24 65.94 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 118.061 0.931 . . . . 0.0 111.115 -178.703 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.45 ' HB1' HD21 ' A' ' 37' ' ' LEU . . . -70.49 -41.89 72.08 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 177.732 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -62.84 -48.49 78.82 Favored 'General case' 0 CA--C 1.519 -0.22 0 O-C-N 122.153 -0.342 . . . . 0.0 110.094 175.052 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 55.1 tp -58.04 -44.03 87.18 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 123.312 0.383 . . . . 0.0 110.277 -176.679 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -66.12 -46.02 79.06 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 110.598 -0.149 . . . . 0.0 110.598 179.254 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -64.39 -34.8 79.0 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -176.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.4 t -85.93 -23.7 26.86 Favored 'General case' 0 CA--C 1.527 0.082 0 CA-C-N 118.147 0.43 . . . . 0.0 112.022 -178.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.5 tpp180 -83.18 -30.73 27.56 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 118.328 0.513 . . . . 0.0 112.003 176.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 74.1 m -77.78 -14.25 59.64 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 122.459 0.303 . . . . 0.0 111.785 178.25 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 61.0 m-20 -105.53 161.12 14.63 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 122.911 0.485 . . . . 0.0 110.308 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 21.8 t 58.92 173.25 0.07 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.109 0.964 . . . . 0.0 112.759 -177.372 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -129.93 5.49 4.99 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.045 0.938 . . . . 0.0 109.804 176.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 81.3 p -143.42 19.08 1.88 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.836 0.854 . . . . 0.0 110.945 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 30.4 m 57.83 25.39 11.93 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.74 0.816 . . . . 0.0 112.317 -176.744 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 42.4 m 59.09 169.38 0.06 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.968 1.307 . . . . 0.0 113.217 -177.141 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -95.46 137.51 34.42 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.803 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm 59.06 151.41 0.08 OUTLIER Pre-proline 0 CA--C 1.534 0.356 0 C-N-CA 125.697 1.599 . . . . 0.0 113.001 -174.628 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -74.16 157.06 46.63 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 123.226 2.618 . . . . 0.0 110.888 177.425 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 162.44 174.8 32.77 Favored Glycine 0 CA--C 1.529 0.907 0 N-CA-C 111.394 -0.682 . . . . 0.0 111.394 178.263 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.534 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER 50.0 -154.31 0.13 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.76 0.824 . . . . 0.0 112.913 175.501 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.6 p -52.53 -29.08 23.41 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -175.593 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.65 -44.57 85.97 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 118.842 0.746 . . . . 0.0 109.802 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -67.58 -30.44 70.05 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 120.99 0.424 . . . . 0.0 110.041 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.5 -43.63 80.42 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.344 -178.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.0 mt -63.66 -43.06 97.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 108.741 -0.836 . . . . 0.0 108.741 173.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -60.71 -32.76 71.99 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-O 120.572 0.225 . . . . 0.0 110.774 178.237 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.9 m -74.18 -40.25 62.65 Favored 'General case' 0 C--N 1.338 0.087 0 O-C-N 121.851 -0.531 . . . . 0.0 110.837 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 44.2 mt -61.56 -30.67 70.81 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 119.637 -0.825 . . . . 0.0 108.884 172.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.12 -14.6 18.7 Favored Glycine 0 CA--C 1.531 1.065 0 CA-C-O 119.027 -0.874 . . . . 0.0 114.019 178.334 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -102.48 -3.87 26.24 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 118.921 1.36 . . . . 0.0 112.307 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.494 HG21 HD13 ' A' ' 51' ' ' ILE . 27.8 m -123.9 -18.98 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.508 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.2 tp -49.99 -27.46 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 123.846 0.859 . . . . 0.0 112.796 -178.455 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.413 ' HA ' ' HB1' ' A' ' 144' ' ' ALA . 21.4 pt20 -63.38 -46.54 86.02 Favored 'General case' 0 N--CA 1.453 -0.289 0 O-C-N 122.008 -0.433 . . . . 0.0 110.988 178.097 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -74.26 -39.04 63.27 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -178.212 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 97.1 mt -62.4 -51.02 69.22 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.419 -177.209 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.424 ' O ' HG13 ' A' ' 113' ' ' ILE . 78.5 mt -66.3 -59.15 3.99 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.391 -0.814 . . . . 0.0 109.806 177.559 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.1 p -48.5 -46.04 37.85 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.526 1.057 . . . . 0.0 112.361 -175.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 -70.97 -45.57 63.85 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 119.192 0.906 . . . . 0.0 111.0 179.016 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.93 -37.83 74.8 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 119.02 -0.514 . . . . 0.0 112.035 -178.148 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -82.51 -32.29 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.154 0 C-N-CA 119.312 -0.955 . . . . 0.0 111.888 176.901 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.9 -29.45 66.64 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.469 -179.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.9 -16.56 53.26 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 122.853 0.461 . . . . 0.0 110.754 176.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 15.7 m -77.52 157.91 30.17 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -172.395 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -95.02 178.7 5.47 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 169.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -55.66 -39.58 71.1 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.64 -0.663 . . . . 0.0 111.949 -177.345 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -69.84 -37.25 76.12 Favored 'General case' 0 N--CA 1.456 -0.154 0 O-C-N 121.792 -0.567 . . . . 0.0 110.842 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -77.0 -39.15 51.44 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.169 -0.444 . . . . 0.0 111.322 -176.666 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.66 -34.35 78.0 Favored 'General case' 0 CA--C 1.522 -0.118 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 174.644 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -63.42 -45.06 92.72 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.478 176.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -61.95 -41.25 97.76 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.994 0.361 . . . . 0.0 111.436 177.294 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 95.6 mt -68.04 -40.58 83.37 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.117 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.6 tmm_? -62.51 -43.2 99.39 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 178.258 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -61.61 -45.68 93.04 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.387 0.675 . . . . 0.0 110.681 179.037 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.0 tt -60.49 -46.23 90.89 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.462 0.305 . . . . 0.0 110.458 177.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 98.1 mt -69.19 -29.98 68.07 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 119.796 -0.145 . . . . 0.0 111.363 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -66.75 -42.25 86.51 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 177.215 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.5 mt -64.99 -40.74 90.1 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 176.203 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -65.2 -29.81 70.65 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.323 0.249 . . . . 0.0 111.232 179.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -77.4 -40.84 42.2 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 122.076 -0.39 . . . . 0.0 110.947 177.666 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -74.05 -27.42 60.91 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -178.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 97.0 p -76.86 -16.86 59.29 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 118.387 0.54 . . . . 0.0 111.446 177.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 72.82 161.21 5.88 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 123.62 0.628 . . . . 0.0 112.21 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 7.4 mp -112.19 4.34 17.78 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.215 0.606 . . . . 0.0 110.588 178.495 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 54.81 18.41 2.14 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.835 0.854 . . . . 0.0 112.369 -175.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 33.1 tp60 -152.72 153.52 33.39 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.603 1.161 . . . . 0.0 108.204 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -63.91 139.73 58.8 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 120.803 0.335 . . . . 0.0 110.83 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 93.1 p -161.46 171.8 17.54 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.333 0.653 . . . . 0.0 110.404 -178.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -140.11 -1.26 1.57 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.599 0.36 . . . . 0.0 111.417 176.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 73.2 mt 49.31 35.55 7.92 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.435 0.694 . . . . 0.0 111.649 -178.551 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -54.16 -20.77 7.29 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.491 0.716 . . . . 0.0 111.941 -175.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.413 ' HB1' ' HA ' ' A' ' 106' ' ' GLN . . . -41.93 -41.73 2.56 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 125.765 1.626 . . . . 0.0 112.036 -176.705 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 1.9 pp -127.93 -13.92 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 173.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 58.5 mmm-85 -63.64 -15.49 58.41 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.685 0.675 . . . . 0.0 109.777 174.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 35.6 t -71.11 -24.8 62.36 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 176.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.452 ' HG3' ' H ' ' A' ' 149' ' ' CYS . 4.0 tppt? -149.52 170.92 17.51 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 -173.016 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 149' ' ' CYS . . . . . 0.452 ' H ' ' HG3' ' A' ' 148' ' ' LYS . 71.4 m -55.39 -13.39 1.41 Allowed 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 125.101 1.361 . . . . 0.0 112.854 -178.061 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 150' ' ' PHE . . . . . 0.432 ' CD2' ' HB3' ' A' ' 148' ' ' LYS . 24.4 m-85 -29.36 -66.55 0.09 Allowed 'General case' 0 C--N 1.341 0.215 0 C-N-CA 124.945 1.298 . . . . 0.0 109.954 177.463 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -114.96 -10.79 12.24 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.701 166.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 33.9 mmt -72.96 -0.95 15.14 Favored 'General case' 0 C--N 1.345 0.407 0 CA-C-N 119.561 1.073 . . . . 0.0 112.868 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -55.91 -16.01 4.13 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.459 0.572 . . . . 0.0 111.823 174.511 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 95.9 mt . . . . . 0 C--O 1.251 1.139 0 CA-C-O 117.603 -1.189 . . . . 0.0 109.642 177.905 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 . . . . . 0 N--CA 1.471 0.613 0 N-CA-C 110.747 -0.094 . . . . 0.0 110.747 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 63.6 m -75.0 151.61 86.3 Favored Pre-proline 0 C--O 1.233 0.214 0 CA-C-O 119.626 -0.226 . . . . 0.0 111.217 -178.625 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -61.12 167.64 8.8 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.554 2.836 . . . . 0.0 113.066 177.215 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 10.9 m 62.16 118.69 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.466 1.506 . . . . 0.0 112.975 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 160' ' ' PRO . . . . . 0.425 ' HD2' ' N ' ' A' ' 27' ' ' SER . 67.1 Cg_endo -67.5 173.09 36.86 Favored 'Cis proline' 0 N--CA 1.455 -0.785 0 N-CA-C 109.167 -1.128 . . . . 0.0 109.167 -10.848 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 79.5 p -63.46 152.78 37.41 Favored 'General case' 0 N--CA 1.455 -0.186 0 O-C-N 121.983 -0.448 . . . . 0.0 110.451 179.147 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 162' ' ' TYR . . . . . 0.469 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 10.1 t80 -141.78 136.99 31.25 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.41 0.284 . . . . 0.0 111.439 -178.556 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 31.3 t -133.15 143.96 50.62 Favored Pre-proline 0 N--CA 1.455 -0.214 0 C-N-CA 123.262 0.625 . . . . 0.0 110.815 178.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -58.6 -11.29 11.07 Favored 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 123.251 2.634 . . . . 0.0 112.653 173.139 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 69.9 p -89.61 21.08 3.62 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.199 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -58.05 155.94 31.55 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 122.646 2.231 . . . . 0.0 110.779 171.563 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 78.2 p . . . . . 0 C--O 1.252 1.23 0 CA-C-O 116.94 -1.505 . . . . 0.0 111.151 -176.547 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.4 ttp . . . . . 0 N--CA 1.476 0.875 0 CA-C-O 119.96 -0.067 . . . . 0.0 111.053 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -146.01 167.36 23.52 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 123.15 0.58 . . . . 0.0 110.473 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -147.64 146.47 29.35 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.82 0.448 . . . . 0.0 110.165 -178.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -131.88 0.04 3.86 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.603 0.761 . . . . 0.0 110.875 177.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -90.78 33.61 0.93 Allowed 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.005 0.922 . . . . 0.0 110.808 177.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.445 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 17.5 t70 -74.82 -157.04 0.06 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.853 0.861 . . . . 0.0 109.932 179.07 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.445 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 10.9 t80 -55.34 -15.1 2.22 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 121.712 -0.618 . . . . 0.0 111.386 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -55.27 -36.39 66.06 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 123.392 0.677 . . . . 0.0 110.681 175.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 42.9 m-20 -66.55 -44.86 81.21 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 118.952 0.796 . . . . 0.0 109.999 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -65.95 -47.85 73.3 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 117.903 0.32 . . . . 0.0 110.719 -176.65 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 98.6 t -65.27 -55.57 19.66 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -179.278 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.64 -31.07 65.91 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -178.375 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 62.3 m -74.6 -42.01 59.42 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 118.11 0.414 . . . . 0.0 111.051 177.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.7 tp -67.62 -31.08 70.86 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.476 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -68.76 -42.34 77.63 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.852 0.861 . . . . 0.0 109.653 174.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.0 t -62.84 -29.36 70.68 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 174.292 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.471 ' CD2' HD11 ' A' ' 68' ' ' ILE . 0.1 OUTLIER -72.75 -36.61 67.74 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.182 0.193 . . . . 0.0 110.538 176.232 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -67.19 -34.23 77.07 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 122.435 0.294 . . . . 0.0 110.217 175.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -74.78 -18.93 60.4 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.722 0.409 . . . . 0.0 111.696 178.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.5 tp -78.01 146.43 35.37 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -147.81 -12.38 0.38 Allowed 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.292 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 78.1 p -77.66 -20.25 54.03 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 117.907 0.321 . . . . 0.0 111.775 -178.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 164.73 -143.81 8.83 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 109.953 -1.259 . . . . 0.0 109.953 177.434 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.2 mm -117.62 145.1 23.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 C-N-CA 125.607 1.563 . . . . 0.0 107.615 -179.21 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.8 m -136.84 138.07 40.4 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.806 0.336 . . . . 0.0 110.588 179.68 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.76 -21.55 65.35 Favored Glycine 0 CA--C 1.523 0.538 0 CA-C-O 119.11 -0.828 . . . . 0.0 112.751 -178.175 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.417 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 59.6 p -66.19 -45.67 80.0 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.838 1.319 . . . . 0.0 110.907 -175.32 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.43 ' HB3' ' CD2' ' A' ' 17' ' ' PHE . 8.4 mpt_? -68.06 -41.47 81.95 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 74.3 mt -61.68 -39.49 83.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.2 mmtt -63.57 -45.55 89.92 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.556 0.742 . . . . 0.0 110.759 179.01 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.59 -39.09 91.21 Favored 'General case' 0 C--N 1.339 0.125 0 CA-C-N 118.226 0.466 . . . . 0.0 111.715 179.325 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 93.0 mt -65.79 -53.86 34.71 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 119.408 -0.33 . . . . 0.0 111.249 -179.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.427 HG21 ' HB2' ' A' ' 71' ' ' SER . 41.1 p -57.81 -41.25 81.79 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 118.491 0.587 . . . . 0.0 110.959 177.056 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.1 m -55.85 -57.78 10.63 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.307 179.5 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -68.67 -31.29 70.3 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 118.993 -1.083 . . . . 0.0 111.777 -175.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.84 -59.2 5.59 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.304 0.502 . . . . 0.0 109.739 174.472 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.469 HD21 ' HB1' ' A' ' 75' ' ' ALA . 8.7 mp -72.06 -14.35 61.84 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -177.152 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -57.76 -26.73 62.27 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -179.411 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -151.97 -24.4 0.18 Allowed 'General case' 0 C--N 1.339 0.135 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -177.288 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.542 HG22 HG22 ' A' ' 93' ' ' THR . 25.8 mm 44.2 73.06 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-O 121.708 0.766 . . . . 0.0 111.186 -177.813 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -147.89 22.19 1.11 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.936 0.894 . . . . 0.0 109.556 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.549 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.3 pt -148.51 35.46 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 C-N-CA 124.562 1.145 . . . . 0.0 109.354 -170.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.425 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -50.99 -55.5 17.05 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 123.887 0.875 . . . . 0.0 113.262 -176.015 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 57.5 p -75.61 -28.32 58.82 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -173.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.673 ' H ' ' CD ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -79.51 -45.82 18.59 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -179.833 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 14.8 mt -55.69 -50.26 68.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 118.019 0.372 . . . . 0.0 110.169 172.358 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.443 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 12.9 mm -66.74 -50.2 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.225 0 CA-C-O 119.341 -0.361 . . . . 0.0 111.894 -176.634 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.4 m -57.07 -34.28 68.12 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 118.962 0.801 . . . . 0.0 110.491 178.416 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.3 tp -70.06 -45.02 67.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -179.187 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 38.2 pt -72.01 -32.57 44.37 Favored 'Isoleucine or valine' 0 C--N 1.341 0.202 0 CA-C-N 119.472 1.033 . . . . 0.0 111.848 -179.512 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.481 HD13 HG21 ' A' ' 104' ' ' VAL . 92.7 mt -66.53 -48.46 80.42 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.329 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -63.8 -25.81 68.34 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.876 177.227 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -66.37 -43.57 85.6 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 173.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.5 m -59.36 -38.07 79.48 Favored 'General case' 0 C--N 1.341 0.229 0 O-C-N 122.15 -0.344 . . . . 0.0 110.645 174.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -68.17 -43.17 78.79 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.35 1.06 . . . . 0.0 112.859 -177.109 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 73.4 mt -89.55 -15.26 33.3 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -173.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 86.2 m -104.11 159.13 30.33 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -171.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -57.11 177.45 0.19 Allowed 'Trans proline' 0 N--CA 1.46 -0.468 1 C-N-CA 125.524 4.149 . . . . 0.0 115.071 179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.446 ' HB3' ' HE3' ' A' ' 115' ' ' LYS . 72.3 m-20 -58.06 -47.26 83.68 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.19 1.396 . . . . 0.0 112.873 -178.024 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.9 m -60.06 -25.14 65.13 Favored 'General case' 0 N--CA 1.457 -0.096 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.308 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 6.2 m80 -86.92 -14.8 40.81 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.707 -0.663 . . . . 0.0 111.172 178.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -72.87 -43.53 62.45 Favored 'General case' 0 C--N 1.342 0.245 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 170.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.2 tp -65.61 -45.4 83.28 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.869 174.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.93 -42.37 98.22 Favored Glycine 0 C--N 1.336 0.534 0 N-CA-C 111.294 -0.723 . . . . 0.0 111.294 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 89.3 p -67.18 -35.55 79.88 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 117.623 0.712 . . . . 0.0 110.292 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 33.7 mt -60.65 -39.01 86.75 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 119.267 -0.973 . . . . 0.0 110.285 173.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -67.31 -35.72 80.01 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.476 1.035 . . . . 0.0 111.772 176.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.471 HD11 ' CD2' ' A' ' 17' ' ' PHE . 87.2 mt -69.03 -45.68 79.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 O-C-N 121.705 -0.622 . . . . 0.0 111.144 176.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 72.9 mt -63.24 -32.94 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 C-N-CA 123.619 0.768 . . . . 0.0 109.263 177.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -71.42 -40.43 70.46 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.188 0.595 . . . . 0.0 110.44 177.304 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.427 ' HB2' HG21 ' A' ' 33' ' ' THR . 98.6 p -69.45 -54.37 14.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 119.165 0.893 . . . . 0.0 110.523 -177.336 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 39.7 mt -65.07 -33.83 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 117.76 0.255 . . . . 0.0 110.555 176.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.57 -53.01 38.01 Favored Glycine 0 C--N 1.337 0.626 0 N-CA-C 111.909 -0.476 . . . . 0.0 111.909 -179.346 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.435 ' NH2' ' C ' ' B' ' 166' ' ' SEP . 6.3 mtp-105 -66.49 -36.13 81.98 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 117.308 0.554 . . . . 0.0 110.445 178.397 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.469 ' HB1' HD21 ' A' ' 37' ' ' LEU . . . -65.45 -45.95 81.79 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 178.549 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.8 m-30 -62.94 -44.87 94.89 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 175.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.1 tp -55.96 -44.89 78.92 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 -177.361 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -69.64 -39.98 76.8 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.806 178.315 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -70.26 -15.02 62.85 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -178.134 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.6 t -107.48 -19.09 13.68 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.876 0.762 . . . . 0.0 111.928 173.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 -84.1 -41.83 16.71 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 123.026 0.53 . . . . 0.0 111.697 177.72 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 37.4 m -110.05 -6.06 15.24 Favored 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -173.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -140.65 165.95 26.08 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.673 0.389 . . . . 0.0 110.31 -177.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 49.3 m -145.54 160.14 42.08 Favored 'General case' 0 CA--C 1.528 0.135 0 C-N-CA 123.279 0.631 . . . . 0.0 110.222 -179.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -150.99 158.87 44.69 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 13.7 t 58.47 178.18 0.07 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.42 1.088 . . . . 0.0 113.023 -178.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 78.1 p -119.05 6.5 11.31 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 124.128 0.971 . . . . 0.0 110.963 179.251 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 54.0 m -137.41 163.08 31.91 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.901 0.88 . . . . 0.0 109.408 178.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -134.51 9.09 3.67 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 122.336 0.254 . . . . 0.0 111.517 -177.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.431 ' N ' ' CD ' ' A' ' 91' ' ' PRO . 65.1 tttp -72.7 -40.15 6.3 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-O 118.432 -0.794 . . . . 0.0 112.842 -178.725 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 90' ' ' LYS . 31.5 Cg_exo -62.84 -21.92 73.47 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 122.402 2.068 . . . . 0.0 112.976 178.074 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 75.28 152.92 3.61 Favored Glycine 0 CA--C 1.53 0.98 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 -176.56 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.542 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -156.62 -154.92 0.5 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.356 0.662 . . . . 0.0 110.226 -179.424 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.8 p -50.49 -29.49 10.59 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -176.064 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.22 -45.73 86.95 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.851 0.75 . . . . 0.0 109.872 175.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 27.8 m80 -68.4 -28.6 67.24 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.311 177.509 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.443 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -65.25 -46.26 81.26 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 178.187 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 95.0 mt -63.32 -42.73 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.077 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 175.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -61.81 -33.0 73.35 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 122.359 -0.213 . . . . 0.0 111.261 179.115 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.8 m -74.35 -41.09 61.63 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.552 -0.261 . . . . 0.0 110.96 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 45.5 mt -60.87 -31.05 70.52 Favored 'General case' 0 C--O 1.226 -0.158 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 173.357 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.8 -14.4 9.89 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-O 119.021 -0.877 . . . . 0.0 113.813 178.342 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -103.41 -4.93 23.44 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.177 1.488 . . . . 0.0 112.371 -179.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.481 HG21 HD13 ' A' ' 51' ' ' ILE . 32.4 m -123.18 -18.18 4.43 Favored 'Isoleucine or valine' 0 C--N 1.339 0.141 0 C-N-CA 122.824 0.45 . . . . 0.0 111.964 -179.168 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.8 tp -50.94 -25.2 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 C-N-CA 123.984 0.913 . . . . 0.0 112.601 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.436 ' HA ' ' HB1' ' A' ' 144' ' ' ALA . 22.8 pt20 -64.86 -49.15 71.67 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 118.079 0.399 . . . . 0.0 111.52 178.419 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -69.6 -39.85 77.0 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 -177.611 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 10.7 mp -66.33 -50.91 61.98 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.189 -176.156 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 65.8 mt -63.99 -60.75 2.87 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 118.767 -0.635 . . . . 0.0 109.78 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 89.4 p -54.88 -41.91 71.45 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 118.622 -1.231 . . . . 0.0 112.318 -172.388 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -69.79 -40.68 75.86 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-N 119.413 1.006 . . . . 0.0 111.385 178.217 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.34 -42.62 96.06 Favored 'General case' 0 N--CA 1.457 -0.102 0 CA-C-N 118.531 0.605 . . . . 0.0 110.618 -179.217 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -38.57 53.53 Favored 'Isoleucine or valine' 0 C--N 1.338 0.093 0 C-N-CA 120.003 -0.679 . . . . 0.0 111.636 178.58 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.99 -25.36 66.27 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 119.607 -0.837 . . . . 0.0 110.094 178.45 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.446 ' HE3' ' HB3' ' A' ' 59' ' ' ASP . 7.8 tmtt? -75.32 -23.12 57.25 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 125.018 1.327 . . . . 0.0 111.144 175.401 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.401 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 55.7 p -86.14 159.68 19.46 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -170.151 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.7 p30 -102.33 -175.02 2.71 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 170.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -55.75 -39.01 70.57 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.996 0.816 . . . . 0.0 112.445 -177.228 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -70.73 -46.4 63.1 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 121.54 -0.725 . . . . 0.0 110.45 -178.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.401 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 35.9 m170 -72.37 -32.49 66.48 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 119.106 -0.474 . . . . 0.0 111.257 -178.085 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -37.65 82.79 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 176.157 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -62.67 -41.94 99.35 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 110.248 -0.279 . . . . 0.0 110.248 177.122 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -61.79 -41.5 97.81 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 117.827 0.285 . . . . 0.0 111.072 176.222 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.5 mt -69.51 -39.02 78.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 CA-C-N 118.004 0.366 . . . . 0.0 110.196 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 37.9 ttt180 -63.86 -40.74 97.27 Favored 'General case' 0 C--O 1.23 0.068 0 C-N-CA 122.56 0.344 . . . . 0.0 110.47 178.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 16.0 tmm? -68.01 -41.97 81.38 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 122.701 0.4 . . . . 0.0 110.253 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.1 tt -60.34 -43.62 96.27 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 176.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 86.2 mt -70.8 -30.27 66.68 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 119.524 -0.274 . . . . 0.0 111.468 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -66.8 -40.76 88.22 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.334 0.515 . . . . 0.0 109.96 177.007 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.2 mt -69.43 -36.92 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 176.468 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 57.3 t90 -63.68 -35.64 81.2 Favored 'General case' 0 N--CA 1.455 -0.204 0 O-C-N 122.358 -0.214 . . . . 0.0 110.436 178.088 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -72.38 -38.57 68.46 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 176.417 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 22.9 tpp180 -67.2 -27.64 67.42 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 122.345 0.258 . . . . 0.0 111.211 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 63.5 m -74.18 -13.96 60.88 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 123.193 0.597 . . . . 0.0 111.979 178.494 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 76.05 -179.35 47.78 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 -177.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.49 ' HG ' ' H ' ' A' ' 138' ' ' GLN . 40.1 tp -150.12 148.95 29.59 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 122.406 -0.467 . . . . 0.0 109.914 -179.033 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -132.78 15.89 4.32 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.414 0.686 . . . . 0.0 111.107 -178.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' GLN . . . . . 0.49 ' H ' ' HG ' ' A' ' 136' ' ' LEU . 24.0 mp0 -127.75 163.85 23.43 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 124.392 1.077 . . . . 0.0 108.844 178.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -69.32 -54.17 15.95 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-O 119.241 -0.409 . . . . 0.0 111.405 -176.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 30.7 m 41.57 -151.64 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.246 1.018 . . . . 0.0 112.6 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -140.19 148.76 42.05 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 174.057 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.653 HD23 ' H ' ' A' ' 142' ' ' LEU . 1.9 pt? -109.47 -7.43 15.17 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 122.781 0.432 . . . . 0.0 111.856 179.623 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 52.9 p-10 -101.41 7.62 42.53 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.779 0.832 . . . . 0.0 111.399 178.718 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.436 ' HB1' ' HA ' ' A' ' 106' ' ' GLN . . . -45.65 -33.78 3.09 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 126.258 1.823 . . . . 0.0 113.068 -173.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.655 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -69.67 18.52 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 C-N-CA 123.119 0.567 . . . . 0.0 111.802 176.123 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.435 ' H ' ' C ' ' A' ' 144' ' ' ALA . 82.5 mtp180 48.5 51.28 15.61 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 123.397 0.679 . . . . 0.0 109.719 -172.412 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 14.2 t 69.45 161.0 0.2 Allowed 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.669 1.188 . . . . 0.0 112.769 -174.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -55.63 -15.23 2.74 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 115.781 1.771 . . . . 0.0 115.781 -168.514 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 76.6 m -49.3 -43.45 43.32 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 119.791 1.178 . . . . 0.0 111.164 -175.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -53.24 -87.37 0.0 OUTLIER 'General case' 0 C--O 1.228 -0.034 0 C-N-CA 126.399 1.88 . . . . 0.0 113.646 -173.001 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -82.4 -14.56 55.0 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -178.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 34.8 mtm -110.03 -11.48 14.62 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 -168.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -110.18 -14.65 14.15 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 120.18 1.355 . . . . 0.0 112.273 174.278 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 83.9 mt . . . . . 0 C--O 1.252 1.217 0 CA-C-O 117.511 -1.233 . . . . 0.0 110.738 179.159 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 . . . . . 0 N--CA 1.478 0.929 0 N-CA-C 110.656 -0.127 . . . . 0.0 110.656 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 156' ' ' SER . . . . . 0.454 ' N ' ' HD2' ' B' ' 157' ' ' PRO . 30.5 m -93.7 -45.21 0.3 Allowed Pre-proline 0 CA--C 1.533 0.317 0 CA-C-O 118.601 -0.714 . . . . 0.0 112.31 177.491 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 157' ' ' PRO . . . . . 0.454 ' HD2' ' N ' ' B' ' 156' ' ' SER . 96.3 Cg_endo -76.49 178.69 7.23 Favored 'Trans proline' 0 N--CA 1.454 -0.849 0 C-N-CA 122.441 2.094 . . . . 0.0 110.119 175.474 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 5.2 m 56.86 42.57 26.28 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.873 0.469 . . . . 0.0 110.718 -177.255 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 160' ' ' PRO . . . . . 0.417 ' HD2' ' N ' ' A' ' 27' ' ' SER . 58.6 Cg_endo -67.89 -58.5 0.14 OUTLIER 'Cis proline' 0 N--CA 1.456 -0.687 0 N-CA-C 110.452 -0.634 . . . . 0.0 110.452 -4.297 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 161' ' ' SER . . . . . 0.406 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 36.8 t -171.55 141.13 1.46 Allowed 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.695 1.198 . . . . 0.0 108.415 174.718 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -156.54 133.31 10.26 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 118.362 0.528 . . . . 0.0 112.12 174.117 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 25.8 t -134.67 144.63 51.53 Favored Pre-proline 0 N--CA 1.454 -0.228 0 C-N-CA 123.765 0.826 . . . . 0.0 110.76 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -66.65 -1.62 6.12 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.257 2.638 . . . . 0.0 111.638 177.504 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 34.9 p -72.19 -23.53 61.27 Favored 'General case' 0 C--N 1.338 0.093 0 O-C-N 121.845 -0.534 . . . . 0.0 112.042 177.804 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 166' ' ' SEP . . . . . 0.435 ' C ' ' NH2' ' A' ' 74' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -69.21 166.35 27.2 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 123.869 3.046 . . . . 0.0 112.243 177.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 43.9 m . . . . . 0 C--O 1.251 1.176 0 CA-C-O 117.172 -1.394 . . . . 0.0 112.035 -179.388 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.3 tpp . . . . . 0 N--CA 1.475 0.798 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -149.05 148.85 30.19 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 123.013 0.525 . . . . 0.0 109.915 179.405 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -141.18 169.37 17.73 Favored 'General case' 0 CA--C 1.527 0.089 0 C-N-CA 123.434 0.694 . . . . 0.0 109.726 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -139.56 161.24 37.98 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.089 0.556 . . . . 0.0 110.219 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -140.34 12.08 2.36 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.611 0.764 . . . . 0.0 111.251 -175.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -91.25 -123.12 0.07 Allowed 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -57.11 -17.81 12.21 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.109 0.413 . . . . 0.0 111.196 176.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.4 tp60 -56.61 -45.31 81.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.218 -0.42 . . . . 0.0 110.31 175.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -57.51 -39.98 77.71 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.306 176.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -64.35 -54.04 39.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.888 0.767 . . . . 0.0 110.766 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 59.4 t -63.5 -50.44 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.179 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 -178.295 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.72 -32.26 69.03 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 123.268 0.627 . . . . 0.0 111.432 -179.019 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 52.3 m -72.27 -43.91 63.6 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 122.025 -0.422 . . . . 0.0 110.145 176.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 21.0 tp -64.73 -29.33 70.31 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 120.426 -0.51 . . . . 0.0 109.999 179.279 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -70.44 -41.81 72.35 Favored 'General case' 0 C--N 1.338 0.074 0 C-N-CA 123.667 0.787 . . . . 0.0 110.57 175.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.9 p -63.96 -29.0 70.2 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.067 174.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -33.41 63.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.316 0.647 . . . . 0.0 110.241 174.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -67.67 -38.19 83.39 Favored 'General case' 0 C--N 1.339 0.123 0 C-N-CA 123.384 0.674 . . . . 0.0 110.514 178.291 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -77.3 -7.58 56.24 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 122.379 0.272 . . . . 0.0 110.643 175.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 18.2 tp 53.25 49.4 19.93 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 124.467 1.107 . . . . 0.0 111.427 179.052 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -69.0 -6.28 26.91 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 89.0 p -149.78 162.8 39.55 Favored 'General case' 0 CA--C 1.528 0.126 0 O-C-N 122.061 -0.4 . . . . 0.0 111.0 -179.107 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.86 66.06 3.92 Favored Glycine 0 C--N 1.337 0.614 0 N-CA-C 111.211 -0.756 . . . . 0.0 111.211 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.4 mm 56.66 37.49 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 C-N-CA 123.452 0.701 . . . . 0.0 110.699 -177.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.0 t -59.5 137.73 57.92 Favored 'General case' 0 C--O 1.23 0.073 0 CA-C-O 120.968 0.413 . . . . 0.0 111.719 -175.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.95 -23.1 67.3 Favored Glycine 0 CA--C 1.526 0.721 0 CA-C-O 119.27 -0.739 . . . . 0.0 113.715 -173.582 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.465 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 38.5 t -59.01 -40.82 86.12 Favored 'General case' 0 N--CA 1.458 -0.065 0 CA-C-N 118.658 1.229 . . . . 0.0 110.633 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -69.45 -39.05 78.01 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -178.005 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 69.4 mt -65.61 -36.19 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -69.17 -36.06 76.97 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 119.459 -0.305 . . . . 0.0 111.369 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.465 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -65.85 -44.48 85.37 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 118.332 0.514 . . . . 0.0 110.342 174.626 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.7 mt -62.56 -52.33 63.86 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 122.291 -0.256 . . . . 0.0 110.957 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.431 HG21 ' HB2' ' A' ' 71' ' ' SER . 27.3 p -59.77 -50.72 72.7 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 118.413 0.552 . . . . 0.0 111.936 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.3 t -61.26 -45.13 95.76 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 120.092 -0.643 . . . . 0.0 111.623 -174.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -75.63 -21.46 57.7 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -178.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.06 -57.12 8.45 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 119.172 0.897 . . . . 0.0 109.031 167.699 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.3 mp -69.05 -14.75 63.21 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -177.005 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -64.94 -16.83 63.78 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.991 0.814 . . . . 0.0 113.065 178.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -140.4 -41.63 0.42 Allowed 'General case' 0 C--N 1.34 0.185 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -178.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.541 HG22 HG22 ' A' ' 93' ' ' THR . 44.8 mm 43.06 67.0 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-O 122.352 1.072 . . . . 0.0 111.07 -172.358 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -147.34 20.65 1.21 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 114.709 -1.132 . . . . 0.0 108.865 179.149 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.603 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.38 33.85 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 C-N-CA 125.157 1.383 . . . . 0.0 109.456 -171.471 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.519 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.3 OUTLIER -49.57 -55.64 12.77 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -177.131 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 83.6 p -75.38 -24.73 57.28 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -173.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.638 ' HD3' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -84.95 -42.72 14.68 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 -179.511 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 30.8 mt -56.21 -52.82 46.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 118.277 0.489 . . . . 0.0 109.752 171.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.439 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 15.4 mm -66.17 -48.94 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 CA-C-O 119.335 -0.364 . . . . 0.0 111.643 -177.22 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.0 t -56.53 -37.15 70.08 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 119.891 -0.724 . . . . 0.0 110.101 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.3 tp -70.55 -40.19 73.51 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 118.624 -0.703 . . . . 0.0 112.782 -177.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.8 pt -73.67 -37.52 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 119.775 1.17 . . . . 0.0 111.965 178.771 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.432 HD13 HG21 ' A' ' 104' ' ' VAL . 93.9 mt -63.4 -49.2 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.099 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.418 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -59.41 -41.43 89.48 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.855 177.587 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -55.73 -40.12 72.04 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 176.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.6 t -68.0 -53.63 24.53 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 179.375 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -68.63 -24.6 64.58 Favored 'General case' 0 C--O 1.228 -0.074 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -172.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 47.1 mt -80.56 -15.89 55.54 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 83.1 m -121.74 164.26 26.07 Favored Pre-proline 0 CA--C 1.536 0.426 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -169.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_exo -55.57 -177.83 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.407 1 C-N-CA 126.001 4.467 . . . . 0.0 116.072 -179.383 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -56.19 -40.44 73.97 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 125.611 1.565 . . . . 0.0 113.427 -176.291 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 74.9 m -61.5 -23.1 65.67 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 19.3 m80 -87.59 -23.63 24.24 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 118.906 -0.568 . . . . 0.0 110.928 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -67.18 -42.21 84.61 Favored 'General case' 0 C--N 1.343 0.321 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 169.633 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.7 tp -66.84 -51.99 48.92 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 120.915 0.388 . . . . 0.0 110.365 177.699 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.43 -39.65 90.91 Favored Glycine 0 C--N 1.336 0.574 0 N-CA-C 110.246 -1.142 . . . . 0.0 110.246 178.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 40.1 t -63.24 -45.65 90.6 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 117.483 0.641 . . . . 0.0 110.767 178.336 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 33.9 mt -57.93 -38.2 75.5 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 118.854 0.752 . . . . 0.0 111.403 178.146 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -74.45 -31.51 62.29 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 119.492 -0.883 . . . . 0.0 112.16 178.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 81.0 mt -73.47 -41.65 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 118.92 0.782 . . . . 0.0 110.669 176.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.8 mt -62.71 -40.06 87.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 176.401 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -66.8 -42.77 85.42 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 119.278 -0.391 . . . . 0.0 110.959 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.431 ' HB2' HG21 ' A' ' 33' ' ' THR . 84.1 p -66.93 -56.52 9.88 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 118.338 0.517 . . . . 0.0 111.148 -174.789 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 38.3 mt -65.19 -31.17 52.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 176.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.89 -52.92 37.64 Favored Glycine 0 CA--C 1.522 0.489 0 CA-C-O 119.751 -0.471 . . . . 0.0 112.191 -179.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.661 ' CG ' HH11 ' A' ' 74' ' ' ARG . 0.0 OUTLIER -72.28 -31.1 65.44 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 117.992 0.896 . . . . 0.0 110.824 -179.242 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.74 -46.61 74.87 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 176.314 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -62.32 -45.23 94.15 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 175.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -57.34 -43.08 83.12 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -178.316 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -67.16 -41.17 86.45 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 121.38 -0.128 . . . . 0.0 110.902 178.584 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -64.58 -40.41 95.48 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 119.51 -0.281 . . . . 0.0 111.227 -178.184 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.3 t -82.78 -18.85 39.14 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 118.192 0.451 . . . . 0.0 111.496 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 56.6 ttp180 -76.23 -31.25 58.29 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 122.078 -0.389 . . . . 0.0 110.417 171.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.5 t -76.92 -33.72 57.72 Favored 'General case' 0 C--O 1.231 0.129 0 C-N-CA 122.764 0.426 . . . . 0.0 111.94 -179.263 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -153.73 154.12 33.47 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 80.2 p -116.06 160.42 20.33 Favored 'General case' 0 C--O 1.231 0.091 0 C-N-CA 122.981 0.512 . . . . 0.0 111.586 -177.159 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 -140.4 172.4 12.78 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.714 0.805 . . . . 0.0 109.772 -178.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.8 m -126.34 159.36 33.39 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 122.825 0.45 . . . . 0.0 110.746 -178.059 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 31.9 m -81.52 12.3 3.87 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.417 0.687 . . . . 0.0 111.929 -178.422 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.8 p -86.11 -1.66 57.6 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.249 0.62 . . . . 0.0 112.239 -179.216 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -132.19 -15.24 2.93 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.594 0.357 . . . . 0.0 111.572 178.586 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -146.99 153.72 45.93 Favored Pre-proline 0 C--N 1.342 0.249 0 C-N-CA 123.685 0.794 . . . . 0.0 109.722 179.764 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -72.48 -13.23 27.6 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.959 2.439 . . . . 0.0 111.138 176.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 163.98 172.4 31.42 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 109.744 -1.342 . . . . 0.0 109.744 178.097 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.541 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -153.68 -156.97 0.74 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 117.155 0.478 . . . . 0.0 110.528 178.247 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 26.7 p -47.91 -32.64 6.57 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 -176.204 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.76 -46.9 80.2 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.582 -0.699 . . . . 0.0 110.137 176.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 67.2 m80 -67.24 -28.78 68.33 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.299 0.639 . . . . 0.0 110.202 177.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.439 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -66.22 -45.45 80.64 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 122.434 0.294 . . . . 0.0 110.546 177.681 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 93.3 mt -62.89 -42.41 96.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 175.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -61.48 -33.69 74.2 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.779 -0.191 . . . . 0.0 111.389 178.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.3 m -73.21 -42.29 62.81 Favored 'General case' 0 C--O 1.227 -0.084 0 C-N-CA 122.332 0.253 . . . . 0.0 111.185 179.177 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 44.9 mt -60.85 -30.78 70.32 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 173.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.17 -14.65 19.22 Favored Glycine 0 CA--C 1.534 1.237 0 CA-C-O 118.826 -0.986 . . . . 0.0 113.81 178.095 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -100.59 -6.92 24.6 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 119.061 1.431 . . . . 0.0 111.805 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.432 HG21 HD13 ' A' ' 51' ' ' ILE . 35.3 m -121.15 -18.31 5.35 Favored 'Isoleucine or valine' 0 C--N 1.338 0.108 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.422 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.7 tp -53.69 -26.03 12.74 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 C-N-CA 122.92 0.488 . . . . 0.0 111.817 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.422 ' HA ' ' HB1' ' A' ' 144' ' ' ALA . 16.4 pt20 -59.49 -61.42 2.64 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 122.77 0.428 . . . . 0.0 110.614 176.199 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -71.13 -28.27 64.17 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.929 -0.482 . . . . 0.0 111.332 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.51 -55.67 25.25 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.38 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 59.9 mt -62.95 -58.14 8.36 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 118.44 -0.791 . . . . 0.0 110.428 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 91.1 p -55.27 -43.13 74.43 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 118.857 -1.137 . . . . 0.0 112.133 -172.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -70.69 -41.67 71.7 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 119.237 0.926 . . . . 0.0 111.077 177.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.17 -37.25 71.82 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 119.157 -0.449 . . . . 0.0 111.359 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.429 HG21 ' HB2' ' A' ' 151' ' ' ALA . 0.0 OUTLIER -80.91 -35.31 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.101 0 C-N-CA 119.572 -0.851 . . . . 0.0 112.135 175.583 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.09 -25.4 65.31 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 119.813 -0.755 . . . . 0.0 111.125 -178.191 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.52 -14.3 38.08 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.293 0.637 . . . . 0.0 111.225 177.008 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.435 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 46.3 p -71.42 156.49 39.41 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -170.462 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 68.4 m-20 -96.36 177.89 5.55 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 106.908 -1.515 . . . . 0.0 106.908 168.564 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -56.26 -45.1 80.19 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.738 0.699 . . . . 0.0 111.149 -177.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -64.99 -41.13 95.68 Favored 'General case' 0 CA--C 1.53 0.173 0 O-C-N 121.974 -0.454 . . . . 0.0 110.481 -179.651 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.435 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 31.6 m170 -69.42 -37.35 77.41 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 119.295 -0.383 . . . . 0.0 110.882 -178.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -41.16 96.83 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 174.551 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -64.4 -39.54 94.06 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.568 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -64.21 -41.08 97.21 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 121.15 -0.22 . . . . 0.0 111.19 176.191 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.9 mt -69.8 -37.39 73.34 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.087 0 CA-C-N 118.281 0.492 . . . . 0.0 109.719 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 80.5 ttt-85 -64.8 -38.1 89.84 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 177.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 65.6 ttp -66.05 -40.76 91.23 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 55.1 tp -60.4 -44.62 95.51 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 110.53 -0.174 . . . . 0.0 110.53 178.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.9 mt -68.06 -35.59 78.47 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 122.094 0.158 . . . . 0.0 111.028 179.039 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -65.72 -36.01 82.38 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 110.332 -0.248 . . . . 0.0 110.332 178.567 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 88.2 mt -69.81 -42.61 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 176.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 48.9 m0 -64.39 -29.77 70.82 Favored 'General case' 0 C--O 1.226 -0.169 0 O-C-N 122.303 -0.248 . . . . 0.0 110.88 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -78.81 -34.52 45.27 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 122.102 -0.374 . . . . 0.0 110.784 176.202 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 8.4 tpm_? -73.54 -25.92 60.62 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 122.942 0.497 . . . . 0.0 111.598 -179.159 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 83.1 p -58.83 -23.71 60.94 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 64.43 -170.22 22.43 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 123.599 0.618 . . . . 0.0 112.599 177.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.424 ' N ' HD22 ' A' ' 136' ' ' LEU . 3.2 mm? 55.9 -176.4 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.773 1.229 . . . . 0.0 112.177 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 53.71 -166.94 0.07 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.257 1.023 . . . . 0.0 112.809 178.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -62.22 156.28 22.38 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.656 0.783 . . . . 0.0 110.115 178.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -134.6 167.59 20.52 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 123.156 0.582 . . . . 0.0 110.61 -177.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 25.2 m 56.5 19.28 4.03 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.131 0.973 . . . . 0.0 113.59 -179.419 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -93.98 1.47 56.26 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.804 0.441 . . . . 0.0 111.128 178.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.414 HD22 ' N ' ' A' ' 142' ' ' LEU . 3.4 mm? -76.94 5.76 7.41 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.327 0.651 . . . . 0.0 111.447 -176.736 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -58.23 -10.58 2.06 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.68 0.792 . . . . 0.0 112.623 179.245 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.455 ' C ' ' H ' ' A' ' 146' ' ' ARG . . . -39.76 -32.83 0.16 Allowed 'General case' 0 C--N 1.342 0.267 0 C-N-CA 126.989 2.116 . . . . 0.0 113.099 177.891 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.414 ' O ' ' CD1' ' A' ' 150' ' ' PHE . 0.2 OUTLIER -67.84 16.81 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-N 118.035 0.379 . . . . 0.0 111.809 177.269 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.455 ' H ' ' C ' ' A' ' 144' ' ' ALA . 83.8 mtp180 51.59 49.9 19.91 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.29 0.636 . . . . 0.0 109.611 -173.428 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 16.1 t 69.95 147.85 0.07 Allowed 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.741 1.216 . . . . 0.0 112.887 -174.354 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -41.38 -36.81 0.9 Allowed 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 -166.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 69.3 m -43.57 -29.07 0.44 Allowed 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 -168.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' PHE . . . . . 0.414 ' CD1' ' O ' ' A' ' 145' ' ' ILE . 14.0 m-85 -49.76 -82.29 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.982 1.713 . . . . 0.0 113.317 179.405 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 151' ' ' ALA . . . . . 0.429 ' HB2' HG21 ' A' ' 113' ' ' ILE . . . -82.74 -13.41 56.38 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 122.213 -0.305 . . . . 0.0 111.534 178.081 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 18.6 mmt -97.07 -21.41 17.39 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 -169.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -77.86 -18.84 55.79 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 119.807 1.185 . . . . 0.0 113.149 -175.553 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 2.1 pt? . . . . . 0 C--O 1.25 1.096 0 CA-C-O 117.592 -1.194 . . . . 0.0 111.335 -177.979 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 . . . . . 0 N--CA 1.472 0.638 0 N-CA-C 110.67 -0.122 . . . . 0.0 110.67 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 156' ' ' SER . . . . . 0.675 ' H ' ' CD ' ' B' ' 157' ' ' PRO . 42.8 m -133.46 -27.68 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.471 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -179.245 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 157' ' ' PRO . . . . . 0.675 ' CD ' ' H ' ' B' ' 156' ' ' SER . 65.9 Cg_endo -78.9 173.48 13.5 Favored 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 122.033 1.822 . . . . 0.0 111.217 179.586 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 64.2 p -127.36 147.54 50.26 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 123.187 0.595 . . . . 0.0 110.304 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -72.44 176.77 38.24 Favored 'Cis proline' 0 N--CA 1.454 -0.84 0 N-CA-C 109.806 -0.882 . . . . 0.0 109.806 -5.561 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 47.5 m -68.01 155.18 40.07 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 174.368 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 162' ' ' TYR . . . . . 0.416 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 15.8 t80 -139.95 127.42 21.5 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 120.574 0.225 . . . . 0.0 110.938 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.9 t -124.17 124.54 25.88 Favored Pre-proline 0 C--O 1.234 0.276 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.543 177.316 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.18 -12.66 35.8 Favored 'Trans proline' 0 N--CA 1.449 -1.143 0 C-N-CA 122.386 2.057 . . . . 0.0 109.828 -179.371 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 22.5 m -59.88 -23.33 63.37 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 123.536 0.735 . . . . 0.0 111.853 -174.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -57.56 153.91 39.31 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 124.407 3.405 . . . . 0.0 112.073 177.325 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 21.6 m . . . . . 0 C--O 1.251 1.177 0 CA-C-O 117.617 -1.182 . . . . 0.0 111.114 -178.041 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -146.2 168.21 21.58 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.183 0.593 . . . . 0.0 110.481 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -143.4 152.76 41.95 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.48 0.712 . . . . 0.0 109.577 -179.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -137.95 164.65 28.49 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 122.843 0.457 . . . . 0.0 110.875 -178.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -122.26 17.96 10.68 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.589 0.756 . . . . 0.0 111.073 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -82.45 -141.22 0.05 Allowed 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -55.41 -15.42 2.62 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.179 0.592 . . . . 0.0 111.714 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 34.3 tp60 -55.27 -41.26 71.99 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.137 0.575 . . . . 0.0 110.362 176.369 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -63.96 -37.89 89.08 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 118.246 0.475 . . . . 0.0 110.615 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -64.72 -55.38 20.29 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.536 0.607 . . . . 0.0 109.899 179.19 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 66.5 t -60.72 -53.08 53.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -177.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.53 -35.73 70.66 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.118 0.567 . . . . 0.0 111.627 -178.228 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 77.5 m -69.12 -44.95 71.36 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-N 118.352 0.524 . . . . 0.0 110.452 177.281 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 20.7 tp -66.46 -29.16 69.23 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.487 -179.237 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.4 -45.16 66.52 Favored 'General case' 0 CA--C 1.523 -0.079 0 C-N-CA 123.787 0.835 . . . . 0.0 109.85 177.692 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 72.8 m -61.44 -29.35 69.89 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 173.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.86 -32.47 61.9 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 120.601 0.238 . . . . 0.0 110.623 175.494 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -71.61 -31.13 66.57 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 123.348 0.659 . . . . 0.0 110.57 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -70.51 -19.82 62.89 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 122.636 0.374 . . . . 0.0 111.275 177.312 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 44.3 tp -85.81 144.7 27.58 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.092 0.557 . . . . 0.0 109.845 -179.096 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -104.99 -21.01 13.36 Favored 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -175.463 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.1 p -160.45 160.9 32.66 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 122.974 0.509 . . . . 0.0 110.452 179.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.67 139.55 6.29 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 111.083 -0.807 . . . . 0.0 111.083 -179.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.6 mm -109.27 146.35 14.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 C-N-CA 123.988 0.915 . . . . 0.0 108.713 179.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 42.9 t -138.98 121.67 16.37 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.266 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.72 -20.08 63.64 Favored Glycine 0 CA--C 1.523 0.562 0 CA-C-O 119.229 -0.762 . . . . 0.0 112.208 -176.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.445 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 47.7 t -65.42 -42.34 92.58 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 118.611 1.205 . . . . 0.0 109.853 177.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.4 mmp_? -60.42 -48.16 82.94 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 176.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.5 mt -63.15 -34.33 66.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.201 -177.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 23.0 mmtp -69.1 -39.67 78.85 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 118.83 -0.605 . . . . 0.0 110.777 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.445 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.3 OUTLIER -65.22 -42.58 93.29 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.359 0.982 . . . . 0.0 110.225 175.296 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.5 mt -62.45 -56.91 13.65 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 122.487 -0.133 . . . . 0.0 110.82 -178.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.555 HG21 ' HB2' ' A' ' 71' ' ' SER . 41.6 p -55.29 -42.97 74.34 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 121.986 -0.447 . . . . 0.0 111.593 176.469 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.9 m -55.37 -55.92 26.06 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 119.279 -0.391 . . . . 0.0 111.131 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -79.07 -18.54 53.24 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -173.006 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.26 -56.0 8.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 119.041 0.837 . . . . 0.0 109.15 167.356 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 50.0 mt -72.92 -14.58 61.5 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.913 0.885 . . . . 0.0 113.154 -174.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -55.37 -30.33 60.14 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -178.622 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -153.1 -20.78 0.15 Allowed 'General case' 0 C--N 1.341 0.214 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 -178.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.491 HG22 HG22 ' A' ' 93' ' ' THR . 35.0 mm 45.75 74.15 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-O 121.837 0.827 . . . . 0.0 111.173 -177.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -134.52 6.74 3.53 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.177 0.991 . . . . 0.0 109.835 178.299 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.491 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -142.5 108.64 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 124.888 1.275 . . . . 0.0 108.359 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.57 ' CD ' ' H ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -102.13 -82.77 0.47 Allowed 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -178.54 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.57 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 99.2 p -55.86 -24.48 37.09 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 123.504 0.722 . . . . 0.0 112.569 -174.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.641 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -70.86 -56.42 6.33 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 177.812 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.432 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 6.5 mt -57.52 -40.64 75.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 123.179 0.591 . . . . 0.0 110.556 175.495 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 14.8 mm -69.68 -51.71 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-O 119.275 -0.393 . . . . 0.0 111.481 -178.441 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.4 m -60.63 -27.13 67.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 118.821 0.737 . . . . 0.0 110.03 177.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.9 tp -70.39 -45.01 66.83 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 118.72 -0.657 . . . . 0.0 111.778 178.265 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 25.7 pt -74.91 -33.83 31.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 119.581 1.082 . . . . 0.0 111.437 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.41 HD13 HG21 ' A' ' 104' ' ' VAL . 96.2 mt -65.63 -52.19 53.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -65.18 -29.46 70.28 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.071 178.082 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -59.13 -42.54 90.87 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 173.349 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.6 m -58.33 -49.36 77.47 Favored 'General case' 0 C--N 1.338 0.093 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 174.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 52.5 tpt85 -56.15 -30.55 62.35 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.803 0.841 . . . . 0.0 112.486 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 80.3 mt -90.59 -14.59 32.15 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -179.065 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 50.7 m -97.05 159.01 32.38 Favored Pre-proline 0 CA--C 1.531 0.231 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -171.509 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -75.79 -139.54 0.02 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.707 1 C-N-CA 125.723 4.282 . . . . 0.0 109.063 172.581 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -56.12 -19.6 13.96 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.002 0.819 . . . . 0.0 112.125 178.713 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.8 m -59.46 -25.69 64.61 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.755 0.422 . . . . 0.0 109.961 173.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -55.28 -64.64 0.78 Allowed 'General case' 0 C--N 1.341 0.204 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 172.543 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.3 ttpt -50.44 -75.68 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.871 -179.305 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 33.0 tp -74.27 -43.14 58.14 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 119.102 -1.039 . . . . 0.0 111.639 -168.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.57 -48.32 44.28 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -174.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.9 m -70.66 -38.61 73.8 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 118.504 -1.278 . . . . 0.0 110.041 -178.304 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 66' ' ' LEU . 60.7 mt -58.26 -42.08 85.69 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 118.293 -1.363 . . . . 0.0 110.826 177.32 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -68.66 -40.03 80.38 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.324 0.966 . . . . 0.0 112.168 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 79.0 mt -66.89 -42.09 88.52 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-N 118.395 0.543 . . . . 0.0 111.15 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.2 mt -66.89 -29.94 47.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.537 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -76.75 -37.85 55.2 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-O 119.041 -0.504 . . . . 0.0 111.975 178.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.555 ' HB2' HG21 ' A' ' 33' ' ' THR . 61.2 p -70.78 -52.68 19.09 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 119.286 0.948 . . . . 0.0 110.324 178.297 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 53.1 mt -67.81 -36.21 75.05 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 178.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.9 -46.79 64.45 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 -178.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 28.2 mtt-85 -63.05 -43.51 98.44 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 117.623 0.711 . . . . 0.0 109.942 176.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.33 -40.54 93.82 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.769 -0.196 . . . . 0.0 110.694 -178.35 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -63.96 -45.62 88.3 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 175.584 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.8 tp -57.88 -41.62 82.91 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 -177.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -67.94 -41.36 82.66 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 117.725 0.238 . . . . 0.0 110.397 177.373 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -60.07 -39.72 87.02 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.877 -0.147 . . . . 0.0 111.074 -177.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 9.3 t -87.31 -20.34 26.94 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 117.995 0.362 . . . . 0.0 111.702 178.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 67.2 ttp85 -71.14 -27.72 63.77 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 118.371 0.532 . . . . 0.0 110.185 174.047 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.7 t -55.86 -22.59 26.05 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -151.92 125.74 9.05 Favored 'General case' 0 N--CA 1.456 -0.142 0 O-C-N 121.909 -0.495 . . . . 0.0 110.193 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 33.8 t -152.29 162.56 40.97 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.707 0.403 . . . . 0.0 110.695 -179.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -140.88 20.43 2.31 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.549 0.74 . . . . 0.0 110.275 178.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 23.4 m 55.95 13.04 1.01 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.397 1.079 . . . . 0.0 113.409 -177.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 69.1 m -147.21 151.66 37.08 Favored 'General case' 0 C--O 1.23 0.074 0 C-N-CA 123.939 0.896 . . . . 0.0 109.636 178.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.1 m -147.93 153.35 38.94 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 120.755 0.312 . . . . 0.0 110.939 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 50.2 t30 -152.83 142.5 21.92 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 176.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 83.3 tttt 43.64 62.39 9.24 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 123.703 0.801 . . . . 0.0 110.502 -177.245 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -67.35 164.67 29.71 Favored 'Trans proline' 0 N--CA 1.451 -0.991 0 C-N-CA 123.897 3.064 . . . . 0.0 111.766 -174.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -169.1 -171.66 35.05 Favored Glycine 0 CA--C 1.527 0.784 0 N-CA-C 110.309 -1.116 . . . . 0.0 110.309 -179.508 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.491 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER 50.95 -160.25 0.08 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.082 0.953 . . . . 0.0 113.444 177.58 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 28.6 p -49.3 -30.31 7.25 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -175.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.4 -46.69 79.03 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 118.787 0.722 . . . . 0.0 110.073 177.147 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 43.0 t60 -69.52 -27.53 65.26 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 121.038 0.447 . . . . 0.0 110.21 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.09 -42.69 79.97 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.185 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.3 mt -64.77 -41.78 93.14 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.163 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 173.293 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -59.82 -33.3 71.57 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 110.782 -0.081 . . . . 0.0 110.782 178.502 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 88.6 m -75.57 -42.72 51.41 Favored 'General case' 0 N--CA 1.457 -0.075 0 CA-C-O 119.526 -0.273 . . . . 0.0 111.026 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 49.6 mt -60.54 -29.02 68.87 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 173.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.4 -15.38 31.28 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-O 119.154 -0.803 . . . . 0.0 113.563 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -98.28 -6.28 31.36 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.961 1.38 . . . . 0.0 111.684 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.41 HG21 HD13 ' A' ' 51' ' ' ILE . 31.1 m -123.71 -22.68 2.66 Favored 'Isoleucine or valine' 0 C--O 1.23 0.027 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -178.84 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.42 HD12 ' HA ' ' A' ' 105' ' ' ILE . 11.0 tp -55.87 -26.49 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 C-N-CA 122.935 0.494 . . . . 0.0 111.44 -177.237 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -61.93 -59.08 5.65 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.144 0.578 . . . . 0.0 111.198 178.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -73.75 -29.87 62.47 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 122.168 0.187 . . . . 0.0 110.766 -179.107 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.0 tt -63.03 -56.64 15.21 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.41 ' O ' HG13 ' A' ' 113' ' ' ILE . 49.5 mt -61.2 -57.98 10.2 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 118.695 -0.669 . . . . 0.0 110.261 176.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 55.9 p -54.84 -44.26 73.76 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 119.605 -0.838 . . . . 0.0 112.053 -172.067 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -69.04 -42.46 76.31 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-N 119.13 0.877 . . . . 0.0 110.794 177.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.28 -50.89 70.1 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.85 0.46 . . . . 0.0 111.603 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.444 HG21 ' HB2' ' A' ' 151' ' ' ALA . 0.0 OUTLIER -69.94 -35.46 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 O-C-N 121.781 -0.575 . . . . 0.0 111.224 179.253 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.65 -24.6 64.56 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.05 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.62 -14.21 38.04 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.071 0.548 . . . . 0.0 110.827 178.387 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.436 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 29.5 p -79.46 157.4 27.51 Favored 'General case' 0 N--CA 1.457 -0.102 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 -171.274 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -90.16 173.42 8.18 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 172.163 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 85.2 mt-30 -55.56 -45.78 77.26 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.772 0.714 . . . . 0.0 111.679 -176.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -63.99 -39.03 93.21 Favored 'General case' 0 N--CA 1.454 -0.244 0 O-C-N 121.719 -0.613 . . . . 0.0 110.404 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.436 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 31.7 m170 -70.83 -45.43 64.56 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.125 -178.148 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -35.95 71.69 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-N 118.839 0.745 . . . . 0.0 109.984 174.542 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.31 -41.99 88.91 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.237 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.6 mtpp -61.57 -44.26 97.35 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.349 175.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 98.0 mt -65.28 -38.23 82.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 43.7 ttt85 -62.26 -39.34 92.57 Favored 'General case' 0 CA--C 1.521 -0.145 0 C-N-CA 122.693 0.397 . . . . 0.0 109.932 177.286 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 51.1 ttp -66.09 -44.03 85.56 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.547 -0.168 . . . . 0.0 110.547 178.625 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.3 mp -57.83 -46.34 84.86 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 177.581 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.9 mt -73.66 -32.7 64.13 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -177.052 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -70.27 -35.66 73.9 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 118.673 0.67 . . . . 0.0 110.029 179.028 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.6 mt -70.8 -40.68 76.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 36.5 t-105 -64.39 -34.65 78.66 Favored 'General case' 0 N--CA 1.456 -0.13 0 O-C-N 122.306 -0.246 . . . . 0.0 110.381 177.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -70.7 -41.07 72.44 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 122.948 0.499 . . . . 0.0 110.481 178.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 63.2 ttp180 -63.9 -41.18 97.77 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.307 0.243 . . . . 0.0 110.616 179.284 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 59.4 m -77.12 -14.78 59.75 Favored 'General case' 0 CA--C 1.527 0.093 0 C-N-CA 122.608 0.363 . . . . 0.0 111.763 178.033 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -82.77 -7.36 87.45 Favored Glycine 0 CA--C 1.526 0.765 0 CA-C-O 119.754 -0.47 . . . . 0.0 112.236 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 68.7 mt 53.93 -163.03 0.11 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.851 0.86 . . . . 0.0 111.199 -177.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 0.407 ' CG ' ' N ' ' A' ' 138' ' ' GLN . 35.4 t80 56.79 -166.51 0.13 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.598 0.759 . . . . 0.0 111.367 -178.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 138' ' ' GLN . . . . . 0.407 ' N ' ' CG ' ' A' ' 137' ' ' PHE . 54.3 mm-40 -63.68 159.1 19.82 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.071 0.548 . . . . 0.0 111.199 -179.677 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 47.3 tttp -68.29 169.79 9.91 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 122.879 0.471 . . . . 0.0 110.173 -179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 36.6 m 59.0 43.1 18.21 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 123.051 0.54 . . . . 0.0 110.405 -175.158 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -63.1 -9.3 10.06 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.619 1.167 . . . . 0.0 111.519 -179.2 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.2 tp -135.97 132.17 36.03 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 176.482 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 52.9 p-10 -101.22 -5.39 25.62 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -177.01 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.402 ' C ' ' H ' ' A' ' 146' ' ' ARG . . . -42.86 -38.67 2.25 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 125.39 1.476 . . . . 0.0 113.499 -176.094 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.482 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -72.13 27.87 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 C-N-CA 123.66 0.784 . . . . 0.0 112.13 175.929 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.402 ' H ' ' C ' ' A' ' 144' ' ' ALA . 18.4 mmt85 52.07 21.62 1.61 Allowed 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 124.198 0.999 . . . . 0.0 110.501 -169.477 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 6.0 t 52.35 24.83 3.1 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.964 1.305 . . . . 0.0 114.001 -177.171 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -140.69 -153.18 0.45 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -175.34 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 35.5 t -41.04 -30.1 0.13 Allowed 'General case' 0 C--N 1.34 0.182 0 C-N-CA 127.447 2.299 . . . . 0.0 115.629 -169.516 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -31.83 -72.83 0.04 OUTLIER 'General case' 0 C--N 1.34 0.178 0 C-N-CA 124.573 1.149 . . . . 0.0 111.255 -178.509 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 151' ' ' ALA . . . . . 0.444 ' HB2' HG21 ' A' ' 113' ' ' ILE . . . -112.32 -13.89 13.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 118.989 -0.529 . . . . 0.0 111.439 168.399 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 20.7 mmt -79.84 -9.4 59.66 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.206 0.912 . . . . 0.0 111.977 -177.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 31.3 t70 59.19 0.06 0.17 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 63.6 tp . . . . . 0 C--O 1.25 1.096 0 CA-C-O 117.628 -1.177 . . . . 0.0 109.587 177.276 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 85.6 t80 . . . . . 0 N--CA 1.472 0.649 0 N-CA-C 110.807 -0.071 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 61.9 m -147.44 146.93 26.51 Favored Pre-proline 0 C--N 1.341 0.237 0 C-N-CA 123.183 0.593 . . . . 0.0 109.538 178.202 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -76.79 163.83 30.89 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 123.654 2.903 . . . . 0.0 111.432 177.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 75.4 p 54.32 147.16 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 127.37 2.268 . . . . 0.0 115.695 177.416 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -85.14 -165.43 3.67 Favored 'Cis proline' 0 N--CA 1.458 -0.59 0 CA-C-N 121.16 1.45 . . . . 0.0 112.233 3.424 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 13.0 t -107.26 173.79 6.17 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.876 0.87 . . . . 0.0 111.713 -178.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -131.92 143.06 49.86 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 124.577 1.151 . . . . 0.0 109.265 176.037 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 26.7 t -121.25 137.07 26.32 Favored Pre-proline 0 N--CA 1.451 -0.386 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 176.728 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -66.47 -9.74 25.21 Favored 'Trans proline' 0 N--CA 1.447 -1.253 0 C-N-CA 122.912 2.408 . . . . 0.0 111.205 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 71.7 p -74.95 -19.79 59.96 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-O 118.801 -0.619 . . . . 0.0 111.76 -178.251 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -75.66 169.45 22.28 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 123.723 2.949 . . . . 0.0 110.213 174.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 70.4 m . . . . . 0 C--O 1.252 1.197 0 CA-C-O 117.079 -1.439 . . . . 0.0 110.88 178.612 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.7 mtm . . . . . 0 N--CA 1.476 0.868 0 N-CA-C 111.144 0.054 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 -145.95 150.56 36.29 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.721 0.408 . . . . 0.0 110.266 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -148.84 159.61 44.0 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.365 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -135.14 1.59 2.97 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 113.167 0.802 . . . . 0.0 113.167 -176.628 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.6 p-10 -127.53 21.53 6.55 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.87 0.468 . . . . 0.0 111.88 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -78.75 -153.15 0.07 Allowed 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.029 0.932 . . . . 0.0 110.536 177.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -54.16 -14.49 1.13 Allowed 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.477 0.711 . . . . 0.0 110.58 175.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -54.7 -36.29 64.52 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 123.041 0.537 . . . . 0.0 110.352 174.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -56.76 -48.56 77.57 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-N 119.138 0.881 . . . . 0.0 109.812 176.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -65.3 -50.32 66.15 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 120.408 0.147 . . . . 0.0 111.2 -177.023 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 62.1 t -64.56 -53.08 46.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 O-C-N 122.368 -0.208 . . . . 0.0 110.488 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.65 -31.54 70.76 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 119.588 -0.244 . . . . 0.0 111.441 -178.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 53.3 m -71.46 -40.97 69.96 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.487 177.123 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.9 tp -66.37 -33.38 75.59 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.629 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -67.4 -42.62 83.0 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.894 0.878 . . . . 0.0 110.079 175.271 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 66.3 m -63.8 -27.47 69.21 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 174.206 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.425 ' CE2' HD11 ' A' ' 68' ' ' ILE . 0.1 OUTLIER -68.99 -39.59 79.26 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 175.199 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -66.73 -30.25 70.43 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 122.614 0.366 . . . . 0.0 111.02 175.144 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -70.11 -27.55 64.67 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 122.576 0.351 . . . . 0.0 111.663 178.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 8.8 mp -85.53 141.41 29.9 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 175.232 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -143.38 14.21 1.8 Allowed 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 122.37 0.268 . . . . 0.0 111.67 -176.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 83.1 p -133.89 7.47 3.75 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -174.226 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 166.95 144.92 4.28 Favored Glycine 0 CA--C 1.524 0.623 0 CA-C-N 118.628 0.649 . . . . 0.0 111.775 179.303 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 17.1 mm -76.66 152.52 5.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 174.158 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.3 t -145.1 137.78 26.19 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 118.099 0.409 . . . . 0.0 111.067 -178.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -61.89 -37.97 95.24 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-O 119.267 -0.74 . . . . 0.0 112.793 -176.178 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.427 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 35.6 t -56.2 -44.06 79.08 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 118.438 1.119 . . . . 0.0 111.419 -173.417 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? -69.42 -44.85 70.55 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 -178.714 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 91.1 mt -58.52 -38.49 70.84 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.199 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.2 mmtp -73.39 -35.65 65.91 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-O 118.605 -0.712 . . . . 0.0 111.849 -178.467 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.427 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.1 OUTLIER -65.18 -38.47 90.61 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-N 119.516 1.053 . . . . 0.0 110.095 174.646 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.0 mt -64.06 -55.7 20.3 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 119.386 -0.34 . . . . 0.0 110.802 178.786 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.409 HG21 ' HB2' ' A' ' 71' ' ' SER . 41.3 p -58.01 -42.42 85.18 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 118.622 0.646 . . . . 0.0 111.066 177.765 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.3 m -55.65 -58.14 9.05 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 119.101 -0.476 . . . . 0.0 111.057 -179.071 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -69.12 -31.64 70.47 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 118.74 -1.184 . . . . 0.0 111.367 -175.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.54 -59.81 4.78 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.994 177.359 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.487 HD21 ' HB1' ' A' ' 75' ' ' ALA . 6.8 mp -68.93 -23.24 64.14 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 122.268 0.227 . . . . 0.0 111.525 -177.577 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -72.38 -18.77 61.71 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 122.205 -0.309 . . . . 0.0 111.26 176.023 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -148.6 52.53 0.99 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 117.758 0.254 . . . . 0.0 111.648 -175.142 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.508 HG22 HG22 ' A' ' 93' ' ' THR . 35.8 mm -62.84 80.96 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 121.494 0.664 . . . . 0.0 110.425 172.075 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -153.28 20.21 0.56 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.421 1.489 . . . . 0.0 108.541 175.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.579 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -148.94 34.89 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 C-N-CA 125.343 1.457 . . . . 0.0 109.114 -171.284 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.5 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -49.28 -55.28 13.22 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -176.408 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 86.6 p -75.97 -24.27 55.4 Favored 'General case' 0 CA--C 1.522 -0.106 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -173.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.644 ' H ' ' CD ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -86.0 -39.16 17.15 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 119.286 -0.388 . . . . 0.0 110.108 -179.686 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 24.3 mt -59.11 -51.65 70.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.096 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 170.684 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.436 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 11.5 mm -65.55 -47.26 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-O 119.281 -0.39 . . . . 0.0 111.187 -178.122 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 48.3 t -55.82 -38.29 69.82 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.232 176.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.6 tp -68.54 -43.6 76.34 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 118.954 -0.546 . . . . 0.0 112.458 -177.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 38.5 pt -73.09 -37.31 52.77 Favored 'Isoleucine or valine' 0 C--N 1.343 0.286 0 CA-C-N 119.495 1.043 . . . . 0.0 111.993 -179.105 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.0 mt -64.26 -50.42 76.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.469 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 38.9 t70 -63.72 -31.05 72.1 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.451 178.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -58.98 -45.19 91.18 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 173.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.9 t -67.94 -31.3 70.94 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 111.656 0.243 . . . . 0.0 111.656 177.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.469 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 53.0 tpt85 -71.12 -36.29 72.08 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.911 0.884 . . . . 0.0 112.716 -177.708 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 78.5 mt -93.77 -14.71 25.93 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 -176.072 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 92.1 m -104.73 155.85 36.85 Favored Pre-proline 0 C--N 1.331 -0.206 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -171.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -66.11 -176.69 0.66 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 1 C-N-CA 125.349 4.033 . . . . 0.0 114.004 -178.825 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.405 ' HB3' ' HE3' ' A' ' 115' ' ' LYS . 53.0 m-20 -56.44 -44.44 80.45 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 125.654 1.582 . . . . 0.0 114.367 -172.289 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.4 p -57.45 -30.27 64.88 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 178.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -86.94 -13.4 44.79 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-O 118.472 -0.775 . . . . 0.0 111.62 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -74.19 -37.5 63.91 Favored 'General case' 0 C--N 1.342 0.252 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 169.31 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.3 mt -65.07 -51.77 59.52 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.145 173.241 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.38 -39.28 90.21 Favored Glycine 0 C--N 1.337 0.635 0 N-CA-C 110.323 -1.111 . . . . 0.0 110.323 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.5 t -55.71 -59.21 5.18 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 176.421 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 32.5 mt -49.39 -43.47 44.33 Favored 'General case' 0 C--O 1.228 -0.054 0 CA-C-O 118.837 -0.601 . . . . 0.0 111.625 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -66.96 -34.11 77.06 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 119.24 -0.984 . . . . 0.0 111.471 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.425 HD11 ' CE2' ' A' ' 17' ' ' PHE . 69.3 mt -72.13 -48.63 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 O-C-N 122.003 -0.436 . . . . 0.0 111.19 178.069 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 1.8 mp -59.46 -37.18 68.56 Favored 'Isoleucine or valine' 0 C--N 1.339 0.119 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -71.33 -39.42 71.37 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 119.414 -0.327 . . . . 0.0 111.285 -177.482 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.447 ' HB3' ' CE2' ' B' ' 162' ' ' TYR . 89.9 p -69.34 -52.96 22.2 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.527 0.603 . . . . 0.0 111.012 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 35.1 mt -66.47 -36.31 77.0 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 CA-C-N 118.166 0.439 . . . . 0.0 110.205 179.286 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.91 -44.6 91.49 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.651 -0.579 . . . . 0.0 111.651 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.426 ' CD ' ' HD3' ' B' ' 167' ' ' PRO . 32.6 ttm105 -67.39 -40.12 85.63 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 117.107 0.453 . . . . 0.0 110.528 178.078 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.487 ' HB1' HD21 ' A' ' 37' ' ' LEU . . . -68.78 -41.29 78.99 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.43 -179.018 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -64.15 -49.2 73.04 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 175.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.45 -46.51 83.54 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -62.49 -44.68 95.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 122.439 -0.163 . . . . 0.0 110.797 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -64.89 -40.1 94.57 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -176.175 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.7 t -84.61 -20.15 31.86 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -177.601 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 25.9 mmm180 -87.42 -23.14 24.6 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-N 118.775 0.716 . . . . 0.0 111.651 174.483 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 28.2 t -74.97 -12.32 60.31 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.833 0.453 . . . . 0.0 111.763 177.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -131.68 168.46 17.71 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.479 0.712 . . . . 0.0 110.186 -177.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 34.3 t -78.11 148.42 34.2 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 178.243 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 51.5 p30 -149.52 167.16 27.04 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.304 0.641 . . . . 0.0 110.759 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.7 m -145.59 165.28 29.13 Favored 'General case' 0 C--O 1.231 0.119 0 C-N-CA 122.976 0.51 . . . . 0.0 110.914 -177.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 44.6 m -72.39 164.35 26.49 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 122.979 0.512 . . . . 0.0 110.887 178.504 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 93.1 p -145.96 170.36 16.78 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 122.964 0.505 . . . . 0.0 110.487 -178.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -121.17 -12.96 8.6 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 122.592 0.357 . . . . 0.0 111.945 -179.257 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.575 ' H ' ' CD ' ' A' ' 91' ' ' PRO . 23.7 tptm -151.66 -42.12 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.342 0 CA-C-O 118.595 -0.717 . . . . 0.0 112.095 177.207 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.575 ' CD ' ' H ' ' A' ' 90' ' ' LYS . 40.8 Cg_exo -60.11 159.67 25.28 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.597 2.198 . . . . 0.0 111.956 173.453 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -170.04 156.31 26.88 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 111.429 -0.668 . . . . 0.0 111.429 178.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.508 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -155.39 -153.37 0.44 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.786 0.834 . . . . 0.0 109.422 -179.65 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 28.4 p -47.81 -31.55 5.08 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -177.24 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.43 -44.23 91.84 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.272 -0.892 . . . . 0.0 110.244 176.681 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -72.26 -25.58 61.67 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 122.612 0.365 . . . . 0.0 110.225 177.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.436 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -65.24 -45.36 84.94 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.026 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.14 -43.13 98.71 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.28 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -60.57 -33.51 72.81 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.803 -0.181 . . . . 0.0 111.344 178.56 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.4 m -74.76 -40.75 61.02 Favored 'General case' 0 C--N 1.338 0.072 0 CA-C-O 119.686 -0.197 . . . . 0.0 110.974 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 48.7 mt -61.94 -29.45 70.24 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 173.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.76 -14.54 16.01 Favored Glycine 0 CA--C 1.53 1.027 0 CA-C-O 118.911 -0.939 . . . . 0.0 113.829 178.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -102.2 -6.6 23.0 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.085 1.442 . . . . 0.0 112.002 -179.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 35.4 m -121.29 -16.78 6.13 Favored 'Isoleucine or valine' 0 C--N 1.338 0.079 0 C-N-CA 122.917 0.487 . . . . 0.0 111.904 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.6 tp -52.79 -27.34 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 C-N-CA 123.039 0.536 . . . . 0.0 111.642 179.262 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -60.6 -58.45 8.44 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 122.598 0.359 . . . . 0.0 110.965 178.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -74.53 -29.36 61.35 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 122.403 0.281 . . . . 0.0 111.092 -177.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 49.2 tp -63.92 -54.87 27.82 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 179.521 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.451 ' O ' HG13 ' A' ' 113' ' ' ILE . 87.0 mt -63.0 -63.86 1.08 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.51 -0.757 . . . . 0.0 109.156 176.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.509 ' HB2' ' CZ ' ' A' ' 150' ' ' PHE . 87.5 p -40.49 -49.48 2.9 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -177.633 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -73.6 -38.74 65.02 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 119.821 1.191 . . . . 0.0 112.109 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.52 -48.14 82.8 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.802 0.728 . . . . 0.0 110.706 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.2 OUTLIER -76.01 -34.62 27.39 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 117.963 0.347 . . . . 0.0 111.774 -179.69 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.72 -27.51 67.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 119.585 -0.846 . . . . 0.0 109.81 179.204 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.405 ' HE3' ' HB3' ' A' ' 59' ' ' ASP . 3.3 tmtt? -78.43 -26.94 46.44 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.308 0.643 . . . . 0.0 110.986 175.679 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.436 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 53.6 p -69.05 153.17 44.23 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -168.217 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -89.58 175.76 7.15 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 125.045 1.338 . . . . 0.0 108.439 172.5 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -55.84 -41.96 75.07 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 119.253 0.933 . . . . 0.0 111.838 -178.545 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -69.25 -38.89 78.66 Favored 'General case' 0 C--O 1.232 0.173 0 O-C-N 121.666 -0.646 . . . . 0.0 110.479 179.711 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.436 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 46.9 m170 -72.19 -39.19 68.79 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 119.397 -0.335 . . . . 0.0 111.188 -178.314 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.84 -36.41 83.4 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 176.474 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -62.09 -44.46 96.62 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.43 177.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -63.15 -43.89 97.06 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 117.545 0.157 . . . . 0.0 111.394 177.727 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.6 mt -68.03 -38.69 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-N 117.781 0.264 . . . . 0.0 110.546 -179.293 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -68.68 -33.97 74.88 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.3 0.24 . . . . 0.0 110.504 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 64.1 ttp -68.31 -43.87 76.68 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 176.483 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.41 HD23 ' C ' ' A' ' 127' ' ' LEU . 7.6 tt -57.8 -47.46 82.52 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 178.115 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.4 mt -71.9 -31.23 66.2 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 111.76 0.281 . . . . 0.0 111.76 -179.257 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -65.54 -39.83 92.19 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 118.29 0.496 . . . . 0.0 109.787 177.65 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.5 mt -70.54 -39.41 76.09 Favored 'Isoleucine or valine' 0 C--N 1.339 0.147 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 176.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 70.4 t-105 -65.87 -24.74 66.93 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.673 0.389 . . . . 0.0 111.147 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -87.77 -34.09 18.44 Favored 'General case' 0 N--CA 1.453 -0.3 0 O-C-N 122.124 -0.36 . . . . 0.0 111.07 174.44 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -72.14 -24.25 61.42 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 122.923 0.489 . . . . 0.0 111.439 -178.214 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 96.6 p -63.39 -14.65 52.5 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 117.914 0.324 . . . . 0.0 111.744 176.156 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 81.57 3.41 90.63 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-O 119.448 -0.64 . . . . 0.0 113.183 176.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 46.9 tp -147.46 143.89 28.22 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 118.313 1.056 . . . . 0.0 110.104 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -145.41 -179.07 6.41 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.193 0.597 . . . . 0.0 110.735 -177.712 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 7.3 pm0 -64.04 170.46 3.57 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 123.481 0.712 . . . . 0.0 112.447 -176.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 49.7 mmtm -66.73 165.2 15.48 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.3 0.64 . . . . 0.0 111.059 179.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 10.0 t 59.72 -177.7 0.09 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.669 0.788 . . . . 0.0 111.74 -175.32 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -71.8 162.13 29.91 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.136 0.493 . . . . 0.0 111.725 -177.113 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -106.54 25.93 10.56 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.816 0.846 . . . . 0.0 111.644 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 143' ' ' ASN . . . . . 0.454 ' HA ' ' HB3' ' A' ' 146' ' ' ARG . 25.9 t-20 -55.9 -16.39 4.6 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.734 0.814 . . . . 0.0 112.41 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -46.43 -36.69 6.79 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.98 1.712 . . . . 0.0 112.141 -172.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.581 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -121.09 -14.15 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-O 119.632 -0.223 . . . . 0.0 111.568 170.95 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.454 ' C ' ' H ' ' A' ' 148' ' ' LYS . 37.4 ttp180 -62.09 -14.58 37.97 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 117.925 0.33 . . . . 0.0 110.986 179.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 10.4 t -61.2 2.07 0.15 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 120.534 0.207 . . . . 0.0 111.528 169.311 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.454 ' H ' ' C ' ' A' ' 146' ' ' ARG . 40.0 ttmt 62.94 -50.35 0.19 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 128.536 2.734 . . . . 0.0 116.919 172.716 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 26.1 p -47.36 -34.89 7.47 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.466 1.03 . . . . 0.0 112.014 -172.133 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' PHE . . . . . 0.509 ' CZ ' ' HB2' ' A' ' 110' ' ' SER . 35.2 m-85 -55.17 -100.27 0.0 OUTLIER 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 125.679 1.592 . . . . 0.0 113.86 -177.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -69.38 -14.06 62.7 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -178.54 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 23.4 mtm -106.96 -12.5 15.43 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.298 1.221 . . . . 0.0 114.298 -172.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -125.54 -14.3 6.36 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 120.231 1.378 . . . . 0.0 112.174 172.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 30.1 tp . . . . . 0 C--O 1.25 1.099 0 C-N-CA 125.39 1.476 . . . . 0.0 112.25 -179.522 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 53.4 p90 . . . . . 0 N--CA 1.473 0.714 0 N-CA-C 110.632 -0.136 . . . . 0.0 110.632 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 46.3 t -154.26 146.56 17.36 Favored Pre-proline 0 CA--C 1.53 0.205 0 C-N-CA 122.793 0.437 . . . . 0.0 110.131 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -72.4 1.24 6.37 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 123.492 2.795 . . . . 0.0 112.12 176.642 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 73.5 p -133.14 170.29 15.62 Favored 'General case' 0 C--O 1.232 0.144 0 C-N-CA 123.54 0.736 . . . . 0.0 109.978 179.633 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.36 -49.65 0.19 OUTLIER 'Cis proline' 0 N--CA 1.454 -0.824 0 CA-C-N 119.436 0.834 . . . . 0.0 111.357 -3.309 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 38.8 t -177.97 152.08 0.72 Allowed 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.046 0.938 . . . . 0.0 109.351 176.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 162' ' ' TYR . . . . . 0.447 ' CE2' ' HB3' ' A' ' 71' ' ' SER . 44.5 t80 -152.25 125.86 8.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.732 0.301 . . . . 0.0 110.933 169.516 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 9.3 t -131.93 148.77 71.18 Favored Pre-proline 0 N--CA 1.453 -0.32 0 C-N-CA 124.607 1.163 . . . . 0.0 109.558 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_exo -58.22 -1.46 0.65 Allowed 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 123.607 2.871 . . . . 0.0 112.954 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 28.0 m -76.58 -34.38 58.43 Favored 'General case' 0 N--CA 1.456 -0.159 0 O-C-N 122.226 -0.297 . . . . 0.0 111.139 -179.136 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 167' ' ' PRO . . . . . 0.426 ' HD3' ' CD ' ' A' ' 74' ' ' ARG . 41.9 Cg_endo -81.55 -7.17 12.68 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 123.605 2.87 . . . . 0.0 113.694 -173.868 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 C--O 1.252 1.235 0 CA-C-O 117.016 -1.469 . . . . 0.0 111.145 -174.932 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 12.4 t70 . . . . . 0 CA--C 1.537 0.443 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -55.21 -14.19 1.61 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.167 0.587 . . . . 0.0 110.876 178.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -52.89 -37.09 60.13 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 124.396 1.078 . . . . 0.0 111.214 175.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -65.18 -43.88 90.27 Favored 'General case' 0 N--CA 1.457 -0.101 0 CA-C-N 119.328 0.967 . . . . 0.0 110.342 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -65.65 -50.52 64.68 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -177.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 99.7 t -63.13 -54.52 32.32 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -178.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.51 -33.62 70.03 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 119.437 -0.316 . . . . 0.0 111.654 -178.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 67.1 m -70.65 -43.98 68.04 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 118.62 0.646 . . . . 0.0 110.495 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.3 tp -65.59 -33.99 77.19 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.208 0.528 . . . . 0.0 110.064 -179.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -66.62 -45.72 78.16 Favored 'General case' 0 CA--C 1.522 -0.101 0 C-N-CA 124.164 0.985 . . . . 0.0 110.063 177.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 74.2 m -65.43 -26.36 67.93 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 110.371 -0.233 . . . . 0.0 110.371 176.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -68.03 -45.06 75.02 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 174.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt . . . . . 0 CA--C 1.529 0.157 0 C-N-CA 123.768 0.827 . . . . 0.0 111.659 177.663 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 18.7 mm . . . . . 0 CA--C 1.529 0.151 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.5 m -51.7 132.06 30.67 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.354 0.661 . . . . 0.0 112.049 -174.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -70.04 -16.0 72.41 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-O 118.909 -0.939 . . . . 0.0 113.366 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.422 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 41.2 t -65.93 -42.79 89.63 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-N 118.974 1.387 . . . . 0.0 110.625 -177.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -68.04 -37.46 81.36 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 62.8 mt -63.59 -41.71 93.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -58.39 -43.28 88.46 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 118.561 -0.733 . . . . 0.0 111.967 176.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.401 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -65.62 -43.54 89.23 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 119.735 1.152 . . . . 0.0 111.102 178.459 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.3 mt -61.44 -57.08 13.65 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.612 0.244 . . . . 0.0 110.413 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 43.3 p -56.69 -41.17 76.9 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.474 0.31 . . . . 0.0 111.748 177.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.9 m -56.02 -56.23 23.29 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 119.143 -0.456 . . . . 0.0 110.698 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -67.27 -33.64 75.75 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 118.971 -1.091 . . . . 0.0 111.548 -175.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.52 -59.76 4.89 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 118.225 0.466 . . . . 0.0 110.817 174.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 53.9 mt -71.62 -14.66 62.13 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.181 0.992 . . . . 0.0 112.889 -173.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -55.82 -34.85 65.75 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -178.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -153.11 -17.9 0.15 Allowed 'General case' 0 C--N 1.34 0.155 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -177.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 31.3 mm 47.75 75.91 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-O 121.829 0.823 . . . . 0.0 111.417 -178.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -132.09 8.19 4.37 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.911 0.884 . . . . 0.0 109.83 177.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.548 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.8 pt -144.54 123.72 6.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 C-N-CA 125.301 1.44 . . . . 0.0 108.145 -178.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.22 -66.72 1.04 Allowed 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 179.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 50.8 m -66.85 -22.47 65.99 Favored 'General case' 0 N--CA 1.46 0.051 0 C-N-CA 122.714 0.406 . . . . 0.0 111.844 -174.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.618 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -75.17 -52.99 9.59 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 123.996 0.918 . . . . 0.0 109.203 179.012 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.435 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 10.8 mt -58.95 -45.81 91.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 C-N-CA 123.041 0.536 . . . . 0.0 110.025 175.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.419 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 12.3 mm -69.59 -46.28 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-O 119.298 -0.382 . . . . 0.0 111.517 -177.046 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 40.4 t -58.68 -36.59 74.44 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 118.712 0.687 . . . . 0.0 109.697 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.9 tp -67.87 -45.01 75.74 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 118.754 -0.641 . . . . 0.0 112.282 -178.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 28.5 pt -73.41 -37.07 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-N 119.608 1.095 . . . . 0.0 111.893 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.444 HD13 HG21 ' A' ' 104' ' ' VAL . 97.4 mt -63.25 -52.65 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -66.91 -25.63 66.47 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.516 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -61.49 -43.68 98.44 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 173.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.3 t -64.51 -42.78 95.59 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 120.747 0.308 . . . . 0.0 110.346 175.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.64 -48.91 76.51 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 124.809 1.244 . . . . 0.0 112.536 -176.042 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 78.4 mt -81.89 -14.59 55.98 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -174.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 78.9 m -108.91 156.17 39.51 Favored Pre-proline 0 CA--C 1.535 0.375 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -169.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_exo -55.77 -179.87 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.351 1 C-N-CA 126.069 4.513 . . . . 0.0 115.409 176.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -55.46 -43.65 75.67 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.574 1.55 . . . . 0.0 114.036 -174.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.9 p -58.7 -28.44 65.79 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 31.8 m80 -92.02 -14.93 28.6 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 118.861 -0.59 . . . . 0.0 111.208 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.403 ' HB2' ' HE2' ' A' ' 115' ' ' LYS . 35.5 mmtp -69.15 -47.47 64.95 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 169.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.1 tp -66.14 -45.41 81.11 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.383 177.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.94 -43.65 96.65 Favored Glycine 0 C--N 1.336 0.556 0 N-CA-C 111.124 -0.79 . . . . 0.0 111.124 178.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.7 t -67.0 -37.72 84.72 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 117.579 0.689 . . . . 0.0 110.608 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 28.5 mt -57.89 -39.58 78.21 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.317 0.962 . . . . 0.0 110.579 174.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -71.57 -32.03 67.63 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.251 0.932 . . . . 0.0 111.835 178.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 83.7 mt -70.96 -47.02 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 O-C-N 121.609 -0.682 . . . . 0.0 110.18 176.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 79.7 mt -61.02 -36.05 69.64 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 C-N-CA 124.208 1.003 . . . . 0.0 109.156 176.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -62.9 -50.05 72.39 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 123.729 0.812 . . . . 0.0 110.656 176.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.5 t -70.47 -49.07 52.37 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 118.887 -1.125 . . . . 0.0 111.952 -175.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 46.2 mt -65.33 -37.55 80.4 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.8 -48.97 58.28 Favored Glycine 0 CA--C 1.523 0.583 0 CA-C-O 119.596 -0.558 . . . . 0.0 112.309 -178.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.5 mtp-105 -66.12 -38.53 88.43 Favored 'General case' 0 CA--C 1.522 -0.106 0 CA-C-N 117.845 0.823 . . . . 0.0 110.92 178.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.74 -42.57 81.62 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 121.091 -0.243 . . . . 0.0 110.47 178.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.0 m-30 -61.39 -47.52 85.42 Favored 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 175.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.0 tp -59.09 -44.94 91.97 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.743 0.417 . . . . 0.0 110.813 -176.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -67.62 -41.65 83.63 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.631 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 59.2 tt0 -65.95 -38.96 89.94 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.502 -176.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.3 t -82.93 -23.17 33.61 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 117.928 0.331 . . . . 0.0 111.303 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 28.9 ttp180 . . . . . 0 N--CA 1.463 0.177 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 172.204 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.531 0.229 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.9 p -50.95 -30.01 13.76 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.088 0.955 . . . . 0.0 113.416 -175.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.98 -46.83 89.14 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 118.753 0.706 . . . . 0.0 109.579 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -74.72 -23.09 58.52 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.987 178.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.419 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -64.29 -45.59 87.33 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 175.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.77 -42.25 91.99 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -59.35 -34.97 73.03 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 121.303 -0.159 . . . . 0.0 110.969 178.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.3 m -76.61 -40.77 48.36 Favored 'General case' 0 C--O 1.227 -0.098 0 O-C-N 122.288 -0.258 . . . . 0.0 111.244 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.8 mt -61.41 -29.49 69.97 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 174.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.47 -14.58 28.25 Favored Glycine 0 CA--C 1.529 0.95 0 CA-C-O 119.016 -0.88 . . . . 0.0 113.816 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -100.51 -6.79 24.94 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 118.776 1.288 . . . . 0.0 111.689 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.444 HG21 HD13 ' A' ' 51' ' ' ILE . 27.3 m -123.72 -18.28 4.13 Favored 'Isoleucine or valine' 0 C--N 1.339 0.134 0 N-CA-C 112.5 0.555 . . . . 0.0 112.5 -178.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -54.53 -28.08 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 118.48 0.582 . . . . 0.0 111.548 -177.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -62.29 -51.79 66.29 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.778 0.431 . . . . 0.0 111.215 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -77.94 -28.49 49.62 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 122.093 -0.379 . . . . 0.0 111.008 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.0 mt -65.25 -49.78 68.32 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 178.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 69.2 mt -65.56 -60.14 3.24 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 118.5 -0.762 . . . . 0.0 110.31 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.9 p -53.67 -40.37 65.87 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 119.011 -1.076 . . . . 0.0 112.199 -173.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -72.67 -45.0 61.11 Favored 'General case' 0 C--N 1.342 0.24 0 CA-C-N 119.44 1.018 . . . . 0.0 111.095 178.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.409 ' O ' ' HE3' ' A' ' 115' ' ' LYS . . . -55.96 -33.98 65.26 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.148 0.579 . . . . 0.0 111.635 177.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -79.2 -41.97 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 CA-C-N 119.345 0.975 . . . . 0.0 112.019 173.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.54 -27.08 66.66 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.001 0.364 . . . . 0.0 111.746 -177.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.409 ' HE3' ' O ' ' A' ' 112' ' ' ALA . 0.1 OUTLIER -81.33 -18.41 45.8 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.647 0.779 . . . . 0.0 110.653 177.933 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.2 m -80.44 164.63 22.91 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -173.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -101.4 -179.41 4.02 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 169.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 15.9 tp60 -51.33 -39.92 58.01 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.639 0.654 . . . . 0.0 111.592 -178.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -69.08 -54.56 14.38 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -177.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -64.87 -35.87 82.52 Favored 'General case' 0 C--N 1.339 0.131 0 O-C-N 122.2 -0.312 . . . . 0.0 110.4 -178.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 11.9 ttpt -56.71 -51.9 67.04 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 175.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.5 -35.29 78.91 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.885 -176.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -63.59 -39.64 94.91 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 122.215 -0.303 . . . . 0.0 111.239 175.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.5 mt -68.88 -37.38 77.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 49.7 tpt85 -60.89 -41.41 95.97 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 122.792 0.437 . . . . 0.0 109.967 175.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 65.9 ttp -68.42 -37.67 80.5 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 122.62 0.368 . . . . 0.0 110.611 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 8.4 tt -59.48 -51.71 68.72 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.4 mt -71.03 -25.87 62.85 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 120.444 -0.502 . . . . 0.0 111.446 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 13.4 t70 . . . . . 0 N--CA 1.455 -0.179 0 CA-C-N 118.285 0.493 . . . . 0.0 109.874 175.775 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 160' ' ' PRO . . . . . 0.422 ' HD2' ' N ' ' A' ' 27' ' ' SER . 80.7 Cg_endo . . . . . 0 N--CA 1.451 -0.975 0 N-CA-C 109.742 -0.907 . . . . 0.0 109.742 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 45.5 m -65.74 144.9 56.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -151.23 142.6 23.4 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.634 0.254 . . . . 0.0 111.326 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 36.5 p -144.09 159.71 51.83 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-O 120.996 0.427 . . . . 0.0 111.328 177.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -57.02 -0.91 0.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 124.335 3.357 . . . . 0.0 113.464 174.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 26.9 m . . . . . 0 N--CA 1.455 -0.215 0 CA-C-N 118.045 0.384 . . . . 0.0 110.877 178.823 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 36.2 t70 . . . . . 0 N--CA 1.455 -0.218 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -56.97 -17.12 8.53 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.018 0.372 . . . . 0.0 110.469 174.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -55.52 -42.75 74.95 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.109 0.564 . . . . 0.0 110.327 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -56.55 -43.32 79.82 Favored 'General case' 0 C--N 1.337 0.064 0 CA-C-N 118.264 0.484 . . . . 0.0 110.506 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -66.91 -52.68 40.22 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 110.576 -0.157 . . . . 0.0 110.576 -177.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 67.1 t -61.44 -53.49 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 -179.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.6 -34.66 71.37 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.921 0.488 . . . . 0.0 111.906 -177.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 78.4 m -72.03 -41.03 67.97 Favored 'General case' 0 CA--C 1.523 -0.079 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.707 177.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.3 tp -65.36 -33.05 75.04 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -68.42 -44.76 74.31 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.934 0.894 . . . . 0.0 109.941 176.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 72.1 m -64.36 -26.31 68.41 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 175.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.1 -45.82 69.28 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 174.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt . . . . . 0 CA--C 1.53 0.201 0 C-N-CA 122.967 0.507 . . . . 0.0 111.197 177.698 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 15.8 mm . . . . . 0 CA--C 1.529 0.161 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.4 m -54.88 132.05 45.65 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.045 0.538 . . . . 0.0 111.988 -176.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.14 -19.23 63.6 Favored Glycine 0 C--N 1.338 0.658 0 C-N-CA 124.542 1.067 . . . . 0.0 113.208 -178.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.45 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 63.1 p -67.32 -39.54 85.89 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 118.707 1.253 . . . . 0.0 110.649 -176.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -67.55 -40.24 84.97 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 178.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.5 mt -63.72 -39.48 85.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 177.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 47.5 mmtt -63.41 -40.19 96.53 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-O 118.939 -0.553 . . . . 0.0 110.77 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.95 -47.29 75.15 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 118.822 0.737 . . . . 0.0 110.554 175.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.7 mt -59.23 -58.77 7.16 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 122.452 -0.155 . . . . 0.0 110.833 -178.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.4 p -57.39 -49.13 77.17 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 t -62.53 -43.98 97.48 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 119.965 -0.694 . . . . 0.0 111.282 -175.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -77.27 -21.38 53.72 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -178.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.29 -55.81 10.83 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 119.029 0.831 . . . . 0.0 110.019 169.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.5 mt -65.46 -26.14 67.81 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.178 0.991 . . . . 0.0 111.334 -176.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -76.06 -16.81 59.86 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.077 0.551 . . . . 0.0 111.654 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -145.65 48.95 1.24 Allowed 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.206 0.203 . . . . 0.0 111.436 -173.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.634 HG22 HG22 ' A' ' 93' ' ' THR . 43.9 mm -63.07 79.05 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-O 121.468 0.651 . . . . 0.0 110.45 171.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -153.36 18.15 0.55 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.068 1.747 . . . . 0.0 108.538 176.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.576 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.8 OUTLIER -147.09 36.88 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.065 0 C-N-CA 125.542 1.537 . . . . 0.0 108.541 -171.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.469 ' HB2' ' HB2' ' A' ' 97' ' ' ALA . 0.0 OUTLIER -51.37 -53.81 32.75 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -175.237 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 85.6 p -75.4 -23.62 57.08 Favored 'General case' 0 CA--C 1.522 -0.107 0 O-C-N 121.577 -0.702 . . . . 0.0 112.369 -173.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.626 ' H ' ' HD3' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -86.25 -41.61 14.47 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 -179.323 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 45.4 mt -57.37 -50.84 75.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 171.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.509 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 13.9 mm -66.85 -50.4 65.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 CA-C-O 119.128 -0.463 . . . . 0.0 112.094 -177.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 87.6 p -58.95 -31.98 69.2 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 118.973 -1.091 . . . . 0.0 110.438 178.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 57.1 tp -68.97 -44.7 72.4 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 118.765 -0.636 . . . . 0.0 112.145 178.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.0 pt -72.01 -34.71 51.49 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 119.682 1.128 . . . . 0.0 112.0 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.472 HD13 HG21 ' A' ' 104' ' ' VAL . 96.4 mt -64.86 -50.83 73.32 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.103 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 177.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -58.43 -41.2 84.48 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.498 177.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -57.95 -40.86 81.57 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 176.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.2 t -64.21 -53.57 47.09 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 121.245 -0.182 . . . . 0.0 111.42 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -72.4 -23.42 61.09 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 113.761 1.022 . . . . 0.0 113.761 -172.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.9 mt -84.03 -15.06 48.96 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.415 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 95.0 m -112.45 158.31 37.66 Favored Pre-proline 0 CA--C 1.533 0.318 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -171.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.415 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 74.3 Cg_endo -66.51 -177.47 0.91 Allowed 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 125.09 3.86 . . . . 0.0 113.486 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -55.18 -41.15 71.52 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.114 1.365 . . . . 0.0 114.26 -171.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.4 p -59.74 -32.33 70.46 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 28.9 m170 -88.99 -15.95 32.9 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 119.086 -0.483 . . . . 0.0 111.527 -178.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -68.87 -46.35 68.68 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 170.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 64.3 tp -66.5 -46.66 75.5 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.81 0.338 . . . . 0.0 110.111 177.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.81 -44.07 96.14 Favored Glycine 0 C--N 1.337 0.592 0 N-CA-C 110.7 -0.96 . . . . 0.0 110.7 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.3 t -66.18 -38.53 88.24 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 117.467 0.633 . . . . 0.0 110.367 -179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 66' ' ' LEU . 23.3 mt -58.62 -40.12 82.4 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 119.123 0.874 . . . . 0.0 110.717 175.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -69.02 -32.46 71.99 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 119.137 0.881 . . . . 0.0 111.497 178.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 70.8 mt -71.38 -48.21 54.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 O-C-N 121.639 -0.663 . . . . 0.0 110.252 177.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.6 mt -59.56 -36.15 63.32 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.176 0 C-N-CA 124.111 0.964 . . . . 0.0 109.307 176.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -64.33 -52.46 58.34 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.597 0.759 . . . . 0.0 110.54 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.8 t -66.14 -50.56 63.56 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 118.855 -1.138 . . . . 0.0 111.93 -176.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 52.2 mt -65.07 -37.43 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 110.289 -0.263 . . . . 0.0 110.289 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.41 -48.48 57.47 Favored Glycine 0 C--N 1.338 0.658 0 N-CA-C 111.95 -0.46 . . . . 0.0 111.95 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.8 mtp-105 -67.61 -35.11 78.34 Favored 'General case' 0 C--O 1.23 0.061 0 CA-C-N 117.685 0.742 . . . . 0.0 110.701 179.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.61 -42.77 81.86 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 177.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 -62.43 -46.84 86.71 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 176.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 57.6 tp -58.63 -45.1 89.99 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 123.461 0.476 . . . . 0.0 110.424 -177.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -65.79 -46.56 78.27 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.553 -0.092 . . . . 0.0 110.878 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -69.89 -30.9 68.44 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -174.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.5 t -86.35 -26.58 24.77 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 118.61 0.641 . . . . 0.0 111.37 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 . . . . . 0 CA--C 1.529 0.152 0 O-C-N 122.206 -0.309 . . . . 0.0 110.326 174.142 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.634 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.274 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 26.3 p -50.24 -30.37 11.52 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.98 -41.37 95.49 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.308 -0.87 . . . . 0.0 110.152 176.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 -66.11 -34.72 78.7 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.111 0.481 . . . . 0.0 110.33 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.509 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -63.56 -45.15 91.81 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.964 179.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 98.3 mt -63.54 -42.92 97.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 175.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -61.03 -33.24 72.98 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 122.379 -0.201 . . . . 0.0 110.852 179.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 86.1 m -75.48 -41.33 55.73 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.467 0.307 . . . . 0.0 111.191 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.5 mt -62.01 -30.29 70.85 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 174.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.08 -14.58 25.51 Favored Glycine 0 CA--C 1.53 1.014 0 CA-C-O 119.174 -0.792 . . . . 0.0 113.668 178.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -101.95 -3.73 27.32 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.846 1.323 . . . . 0.0 112.136 -179.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.472 HG21 HD13 ' A' ' 51' ' ' ILE . 26.8 m -125.86 -18.82 3.0 Favored 'Isoleucine or valine' 0 C--N 1.338 0.074 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -178.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.4 tp -50.83 -27.12 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -177.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -64.98 -46.35 81.83 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 118.03 0.377 . . . . 0.0 110.886 178.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -74.23 -40.81 62.16 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -178.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 89.5 mt -60.32 -50.3 74.18 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.422 -177.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.412 ' O ' HG13 ' A' ' 113' ' ' ILE . 78.0 mt -66.51 -59.62 3.48 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 118.383 -0.818 . . . . 0.0 110.245 177.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 62.2 p -49.45 -42.09 42.05 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 118.951 0.796 . . . . 0.0 111.898 -173.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -70.57 -51.69 26.77 Favored 'General case' 0 C--O 1.226 -0.152 0 CA-C-N 118.638 0.654 . . . . 0.0 110.863 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.407 ' O ' ' HE3' ' A' ' 115' ' ' LYS . . . -56.06 -32.43 64.08 Favored 'General case' 0 C--O 1.228 -0.078 0 C-N-CA 123.836 0.854 . . . . 0.0 113.044 -178.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -86.94 -36.43 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.151 0 CA-C-N 119.446 1.021 . . . . 0.0 112.35 175.237 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.92 -28.37 66.6 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.395 0.543 . . . . 0.0 111.0 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.407 ' HE3' ' O ' ' A' ' 112' ' ' ALA . 0.1 OUTLIER -79.0 -18.12 54.18 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.0 0.92 . . . . 0.0 110.843 178.386 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 14.9 m -79.07 166.4 22.33 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -174.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -107.93 -174.15 2.45 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.307 1.443 . . . . 0.0 107.886 173.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -50.89 -55.22 18.15 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.349 0.66 . . . . 0.0 112.097 -177.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -68.79 -32.74 72.69 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 122.004 -0.435 . . . . 0.0 111.617 -176.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 58.8 m-70 -76.67 -42.04 43.31 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 118.796 -0.621 . . . . 0.0 111.419 -177.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.73 -33.19 75.09 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 119.328 0.967 . . . . 0.0 108.787 176.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.07 -46.21 90.12 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.172 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -62.42 -42.33 99.37 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.352 176.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.6 mt -66.19 -35.06 74.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -67.43 -38.31 84.36 Favored 'General case' 0 C--O 1.227 -0.107 0 O-C-N 121.986 -0.446 . . . . 0.0 110.637 178.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 64.6 ttp -66.07 -40.99 91.33 Favored 'General case' 0 N--CA 1.457 -0.116 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 176.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.9 tt -59.24 -45.01 92.31 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 177.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 91.2 mt -71.36 -28.68 64.22 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.1 t70 . . . . . 0 N--CA 1.453 -0.291 0 CA-C-N 118.482 0.583 . . . . 0.0 109.506 176.578 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 160' ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' ' 27' ' ' SER . 58.4 Cg_endo . . . . . 0 N--CA 1.457 -0.62 0 N-CA-C 111.698 -0.155 . . . . 0.0 111.698 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . 0.421 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 65.9 p -170.47 148.48 3.14 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.18 0.992 . . . . 0.0 108.997 175.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -158.62 137.96 11.62 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 120.677 0.275 . . . . 0.0 111.628 172.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 16.3 t -137.69 144.76 45.93 Favored Pre-proline 0 CA--C 1.529 0.138 0 C-N-CA 123.743 0.817 . . . . 0.0 110.152 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -66.23 -1.46 5.46 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 123.305 2.67 . . . . 0.0 111.712 177.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 39.4 p . . . . . 0 CA--C 1.53 0.211 0 CA-C-O 119.125 -0.464 . . . . 0.0 111.414 178.234 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.0 p30 . . . . . 0 CA--C 1.53 0.175 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -54.98 -16.41 2.73 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.199 0.6 . . . . 0.0 110.776 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -54.53 -39.16 67.4 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 118.944 -0.551 . . . . 0.0 110.289 173.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 -64.82 -42.31 95.08 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-N 118.947 0.794 . . . . 0.0 110.216 178.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -64.89 -50.32 67.0 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 118.087 0.403 . . . . 0.0 110.425 -178.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 93.0 t -63.75 -54.15 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.6 -30.69 67.42 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 122.781 0.432 . . . . 0.0 111.589 -178.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 54.0 m -74.64 -41.91 59.5 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.268 0.485 . . . . 0.0 110.594 177.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.4 tp -67.05 -29.75 69.62 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -71.04 -39.92 71.99 Favored 'General case' 0 CA--C 1.523 -0.09 0 C-N-CA 124.032 0.933 . . . . 0.0 109.868 175.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.6 t -63.78 -28.75 70.09 Favored 'General case' 0 N--CA 1.456 -0.134 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 173.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.52 -32.25 60.42 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 110.002 -0.369 . . . . 0.0 110.002 174.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt . . . . . 0 N--CA 1.455 -0.185 0 C-N-CA 122.678 0.391 . . . . 0.0 110.203 176.395 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 20.7 mm . . . . . 0 N--CA 1.457 -0.083 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.42 ' HB2' HH11 ' A' ' 28' ' ' ARG . 73.8 m -59.35 132.41 53.93 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.112 0.565 . . . . 0.0 112.41 -175.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.73 -23.62 72.44 Favored Glycine 0 C--N 1.337 0.627 0 C-N-CA 124.117 0.865 . . . . 0.0 112.581 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.49 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 36.6 t -65.08 -41.12 95.32 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 118.533 1.167 . . . . 0.0 110.46 -175.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.42 HH11 ' HB2' ' A' ' 25' ' ' SER . 81.0 mtt85 -69.57 -38.8 77.54 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 75.9 mt -64.17 -39.42 85.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 176.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp -67.7 -36.86 81.41 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.348 -0.358 . . . . 0.0 111.412 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.453 ' HE3' ' O ' ' A' ' 27' ' ' SER . 0.0 OUTLIER -68.98 -43.93 73.94 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.676 0.671 . . . . 0.0 110.703 175.484 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.4 mt -62.85 -56.47 17.05 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 110.605 -0.146 . . . . 0.0 110.605 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.573 HG21 ' HB2' ' A' ' 71' ' ' SER . 50.8 p -56.3 -49.18 75.04 Favored 'General case' 0 CA--C 1.522 -0.13 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 177.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 t -62.28 -43.86 97.86 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.964 -174.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -68.47 -35.54 77.71 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 118.721 -1.192 . . . . 0.0 111.503 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.86 -58.0 10.57 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.132 0.424 . . . . 0.0 110.226 174.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.83 -16.23 63.23 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -176.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -59.62 -27.25 66.15 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -179.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.3 t-80 -152.3 -23.63 0.17 Allowed 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 -176.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.51 HG22 HG22 ' A' ' 93' ' ' THR . 33.5 mm 46.51 74.96 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 123.431 0.693 . . . . 0.0 111.675 -178.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -147.24 20.57 1.22 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.857 0.863 . . . . 0.0 109.8 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.58 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.3 pt -147.45 35.33 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 C-N-CA 124.291 1.036 . . . . 0.0 109.805 -171.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.487 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -50.61 -58.16 6.5 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.205 1.002 . . . . 0.0 113.601 -177.05 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 52.9 m -73.09 -26.8 61.38 Favored 'General case' 0 CA--C 1.52 -0.192 0 O-C-N 121.864 -0.523 . . . . 0.0 112.4 -174.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.655 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.76 -44.12 15.95 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 119.305 -0.378 . . . . 0.0 109.989 -178.741 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 16.7 mt -56.22 -51.93 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.125 0 CA-C-N 118.303 0.502 . . . . 0.0 109.711 171.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.43 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 13.4 mm -66.8 -49.45 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -176.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 34.2 t -56.66 -36.72 69.88 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 119.987 -0.685 . . . . 0.0 109.646 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.1 tp -69.71 -42.37 74.12 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 118.444 -0.789 . . . . 0.0 112.63 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 32.1 pt -72.99 -37.64 54.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 120.003 1.274 . . . . 0.0 111.773 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.446 HD13 HG21 ' A' ' 104' ' ' VAL . 95.5 mt -63.39 -49.6 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -59.21 -41.72 89.28 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.762 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -55.83 -40.13 72.38 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 176.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -67.9 -52.6 34.47 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -69.0 -23.03 64.05 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -173.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 55.9 mt -81.33 -14.84 56.85 Favored 'General case' 0 C--O 1.231 0.113 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 177.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.546 ' HB3' ' CG ' ' A' ' 61' ' ' HIS . 76.4 m -126.39 157.89 68.91 Favored Pre-proline 0 CA--C 1.539 0.554 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -170.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.452 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 64.0 Cg_endo -74.76 -166.56 0.35 Allowed 'Trans proline' 0 CA--C 1.537 0.665 1 C-N-CA 125.34 4.027 . . . . 0.0 114.648 -176.07 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -38.77 -57.2 1.24 Allowed 'General case' 0 C--O 1.236 0.358 0 C-N-CA 128.167 2.587 . . . . 0.0 115.342 -173.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.3 t -58.92 -31.49 68.7 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.774 0.321 . . . . 0.0 110.46 -175.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.546 ' CG ' ' HB3' ' A' ' 57' ' ' CYS . 16.2 m80 -82.49 -23.9 34.45 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.076 0.551 . . . . 0.0 111.272 -178.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -68.31 -44.67 74.89 Favored 'General case' 0 C--N 1.342 0.25 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 172.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 49.2 tp -66.39 -46.2 77.42 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.271 178.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.63 -44.0 97.22 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.153 -1.179 . . . . 0.0 110.153 177.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.3 t -55.82 -50.51 70.32 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.941 0.371 . . . . 0.0 110.064 177.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 37.5 mt -58.58 -39.94 81.74 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 118.692 -0.671 . . . . 0.0 111.645 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -69.2 -29.36 67.32 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.081 0.855 . . . . 0.0 111.789 179.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 64.1 mt -79.1 -39.24 21.18 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 O-C-N 121.797 -0.564 . . . . 0.0 110.588 178.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 75.9 mt -64.81 -35.8 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 175.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.12 -52.79 53.25 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.102 1.361 . . . . 0.0 110.127 177.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.573 ' HB2' HG21 ' A' ' 33' ' ' THR . 81.3 p -66.38 -52.52 45.96 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 120.049 -0.66 . . . . 0.0 112.015 -175.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 37.6 mt -67.86 -34.43 67.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 CA-C-N 117.641 0.2 . . . . 0.0 110.649 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.98 -50.16 59.27 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 111.692 -0.563 . . . . 0.0 111.692 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.7 mtp-105 -68.02 -36.96 80.82 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-N 117.364 0.582 . . . . 0.0 110.866 178.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.95 -40.95 83.14 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 117.623 0.192 . . . . 0.0 110.551 179.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.8 m-30 -64.79 -45.45 86.24 Favored 'General case' 0 CA--C 1.516 -0.332 0 O-C-N 122.147 -0.346 . . . . 0.0 110.093 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 48.4 tp -59.34 -44.7 92.61 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 123.37 0.419 . . . . 0.0 110.209 -177.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -66.3 -43.74 85.42 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 122.259 -0.276 . . . . 0.0 110.315 177.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.1 tp10 -67.03 -27.71 67.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 119.485 -0.293 . . . . 0.0 111.745 -176.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.9 t -94.04 -23.76 17.88 Favored 'General case' 0 CA--C 1.528 0.115 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 69.9 mtm180 . . . . . 0 C--N 1.342 0.245 0 CA-C-N 119.097 0.862 . . . . 0.0 112.592 176.377 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.51 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.232 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.9 p -48.35 -32.58 7.67 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -176.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.82 -46.73 83.8 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.835 0.743 . . . . 0.0 110.074 176.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 66.9 m80 -67.07 -29.79 69.67 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.005 0.522 . . . . 0.0 110.593 178.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.43 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -65.14 -46.6 80.25 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 122.99 0.516 . . . . 0.0 110.462 177.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.8 -42.77 97.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 176.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -61.48 -33.94 74.63 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 122.257 -0.277 . . . . 0.0 111.165 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.1 m -73.36 -42.16 62.56 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.161 -0.337 . . . . 0.0 110.889 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 47.8 mt -60.09 -31.4 69.99 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 174.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.55 -14.53 14.47 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-O 119.019 -0.878 . . . . 0.0 114.23 178.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -101.63 -6.25 24.03 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.957 1.379 . . . . 0.0 112.059 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.446 HG21 HD13 ' A' ' 51' ' ' ILE . 30.1 m -121.75 -19.36 4.56 Favored 'Isoleucine or valine' 0 C--N 1.337 0.048 0 C-N-CA 123.099 0.56 . . . . 0.0 111.846 -178.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.406 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.9 tp -52.14 -26.99 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 C-N-CA 122.891 0.476 . . . . 0.0 112.055 -178.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -59.44 -57.21 14.0 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 122.896 0.479 . . . . 0.0 111.499 177.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -76.37 -32.81 58.82 Favored 'General case' 0 N--CA 1.457 -0.115 0 O-C-N 122.137 -0.352 . . . . 0.0 111.409 -177.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.4 mt -61.65 -49.48 76.39 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.412 ' O ' HG13 ' A' ' 113' ' ' ILE . 70.7 mt -65.41 -58.18 6.49 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.343 -0.836 . . . . 0.0 109.989 177.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 98.0 p -50.33 -43.93 54.14 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.093 0.861 . . . . 0.0 111.735 -173.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -68.49 -52.53 31.32 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 118.422 0.555 . . . . 0.0 110.776 177.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.461 ' O ' ' HE3' ' A' ' 115' ' ' LYS . . . -56.19 -33.06 64.96 Favored 'General case' 0 N--CA 1.457 -0.107 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -177.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -87.15 -36.16 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 119.853 1.206 . . . . 0.0 112.374 175.295 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.44 -25.49 63.22 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 119.771 -0.772 . . . . 0.0 110.747 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.461 ' HE3' ' O ' ' A' ' 112' ' ' ALA . 0.1 OUTLIER -80.2 -20.09 45.52 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.629 0.772 . . . . 0.0 110.536 177.277 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.7 m -77.08 159.18 30.03 Favored 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -171.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -90.62 175.79 6.91 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.831 1.253 . . . . 0.0 107.859 170.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -55.97 -40.76 73.73 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.832 -0.542 . . . . 0.0 112.069 -177.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -69.7 -36.77 76.22 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.958 -0.464 . . . . 0.0 110.654 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -75.3 -42.92 53.63 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 118.734 -0.651 . . . . 0.0 110.843 -178.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.404 ' HD2' ' C ' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -64.88 -33.66 76.54 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 119.539 1.063 . . . . 0.0 109.78 176.348 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.1 -46.5 87.04 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.023 177.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -63.89 -37.59 87.97 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.688 177.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 92.7 mt -68.58 -35.55 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -65.44 -40.1 92.86 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 176.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 24.2 ttt -62.41 -43.13 99.55 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 176.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.0 tt -58.04 -44.63 87.52 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 178.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.9 mt -71.45 -32.13 67.97 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.3 t70 . . . . . 0 N--CA 1.456 -0.174 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.019 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 160' ' ' PRO . . . . . 0.49 ' HD2' ' N ' ' A' ' 27' ' ' SER . 63.5 Cg_endo . . . . . 0 N--CA 1.456 -0.69 0 N-CA-C 110.864 -0.475 . . . . 0.0 110.864 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . 0.482 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 41.2 t -168.43 145.55 3.96 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 124.186 0.994 . . . . 0.0 108.585 175.109 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -157.75 137.84 12.52 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 117.842 0.292 . . . . 0.0 111.434 174.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 12.2 t -135.37 144.98 51.87 Favored Pre-proline 0 N--CA 1.454 -0.227 0 C-N-CA 123.773 0.829 . . . . 0.0 110.362 -178.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -67.81 -0.09 4.95 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 123.186 2.591 . . . . 0.0 110.707 178.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 37.9 m . . . . . 0 CA--C 1.532 0.262 0 C-N-CA 122.582 0.353 . . . . 0.0 110.568 178.688 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.8 t70 . . . . . 0 CA--C 1.535 0.376 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -55.81 -14.77 2.55 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.768 -0.583 . . . . 0.0 111.189 177.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.5 tp60 -55.3 -40.18 70.79 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.265 0.626 . . . . 0.0 110.836 177.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -64.44 -38.64 91.72 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.754 0.706 . . . . 0.0 111.004 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -64.46 -55.13 22.86 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.501 0.591 . . . . 0.0 109.897 178.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.8 t -60.04 -55.37 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 -178.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.12 -33.28 67.19 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 123.248 0.619 . . . . 0.0 112.026 -178.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 53.5 m -70.22 -45.17 67.11 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.847 0.749 . . . . 0.0 110.415 177.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.8 tp -65.6 -33.06 75.04 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.216 0.531 . . . . 0.0 109.741 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -66.72 -45.92 77.15 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 123.916 0.886 . . . . 0.0 110.325 178.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 73.1 m -63.23 -29.45 70.79 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 174.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.79 -29.62 64.66 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.545 0.338 . . . . 0.0 110.264 176.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt . . . . . 0 CA--C 1.53 0.174 0 C-N-CA 122.894 0.478 . . . . 0.0 111.635 176.116 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.4 mm . . . . . 0 CA--C 1.531 0.222 0 CA-C-O 120.967 0.413 . . . . 0.0 110.389 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.0 t -57.53 136.56 56.74 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 120.974 0.416 . . . . 0.0 110.844 -177.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.59 -24.12 72.4 Favored Glycine 0 CA--C 1.526 0.731 0 CA-C-O 118.999 -0.889 . . . . 0.0 113.911 -172.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.422 ' O ' ' HE3' ' A' ' 31' ' ' LYS . 81.0 p -63.36 -35.89 81.9 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 118.958 1.379 . . . . 0.0 111.217 -175.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -65.52 -44.54 86.65 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 178.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 48.7 mt -61.5 -40.59 86.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -63.68 -38.5 91.36 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 119.241 -0.409 . . . . 0.0 111.415 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.422 ' HE3' ' O ' ' A' ' 27' ' ' SER . 0.0 OUTLIER -64.28 -47.32 79.96 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 118.627 0.649 . . . . 0.0 109.85 175.194 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 92.8 mt -60.28 -56.82 16.89 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 122.395 -0.191 . . . . 0.0 110.973 -178.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.405 HG21 ' OG ' ' A' ' 71' ' ' SER . 75.9 p -58.28 -48.06 81.65 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 t -63.27 -42.48 99.13 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.247 -0.581 . . . . 0.0 111.453 -175.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -75.56 -22.94 56.57 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.99 -55.6 13.77 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 119.043 0.838 . . . . 0.0 109.166 167.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 61.8 mt -69.78 -15.72 63.17 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.21 1.004 . . . . 0.0 113.05 -175.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -57.07 -29.49 63.49 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -178.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.5 t-160 -150.91 -24.65 0.22 Allowed 'General case' 0 N--CA 1.461 0.122 0 N-CA-C 113.994 1.109 . . . . 0.0 113.994 -176.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.405 HG22 HG22 ' A' ' 93' ' ' THR . 40.3 mm 45.73 73.92 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-O 122.06 0.933 . . . . 0.0 111.351 -179.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -138.02 8.63 2.75 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.23 1.012 . . . . 0.0 109.83 178.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.528 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -142.72 109.61 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 125.142 1.377 . . . . 0.0 107.913 -178.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.472 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -104.92 -67.96 0.88 Allowed 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -177.342 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.431 ' H ' ' HG2' ' A' ' 43' ' ' GLU . 81.6 p -68.29 -23.16 64.71 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 122.98 0.512 . . . . 0.0 111.894 -173.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.622 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -73.36 -54.8 7.45 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.799 0.84 . . . . 0.0 109.299 178.377 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.419 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 8.6 mt -57.25 -45.79 84.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 C-N-CA 122.836 0.454 . . . . 0.0 110.143 175.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 14.6 mm -69.5 -47.98 69.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 CA-C-O 119.143 -0.456 . . . . 0.0 111.988 -177.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 95.5 p -63.02 -30.65 71.76 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-N 119.294 0.952 . . . . 0.0 110.227 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 46.4 tp -68.66 -45.72 71.0 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 119.15 -0.452 . . . . 0.0 111.772 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.5 pt -73.08 -36.77 51.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 119.192 0.905 . . . . 0.0 111.677 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.474 HD13 HG21 ' A' ' 104' ' ' VAL . 93.7 mt -62.03 -53.33 49.23 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.124 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.451 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 36.3 t70 -62.67 -31.47 72.37 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.517 179.12 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -61.14 -41.42 96.72 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.1 t -69.36 -35.99 76.4 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.935 175.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.451 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 50.9 tpt85 -66.53 -41.82 88.15 Favored 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -174.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 71.7 mt -96.06 -14.51 22.86 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 113.952 1.093 . . . . 0.0 113.952 -172.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 82.0 m -101.61 162.48 20.31 Favored Pre-proline 0 CA--C 1.536 0.432 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -170.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_exo -55.68 177.49 0.13 Allowed 'Trans proline' 0 N--CA 1.461 -0.431 1 C-N-CA 125.637 4.225 . . . . 0.0 115.188 179.261 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -56.88 -46.2 82.03 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.28 1.032 . . . . 0.0 113.293 -175.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 73.1 m -60.87 -26.88 67.72 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 5.5 m80 -81.77 -23.74 36.43 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 119.243 -0.408 . . . . 0.0 110.803 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -73.82 -44.77 54.77 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.877 0.762 . . . . 0.0 109.23 175.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.99 -50.09 65.51 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 177.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.59 -41.85 93.8 Favored Glycine 0 C--N 1.337 0.619 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.8 t -67.55 -37.76 83.16 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.713 0.756 . . . . 0.0 110.538 179.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 32.1 mt -59.79 -36.12 76.07 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 119.522 1.056 . . . . 0.0 110.756 175.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -73.08 -32.76 65.2 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 119.485 -0.886 . . . . 0.0 111.644 176.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 79.0 mt -67.04 -48.03 80.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 118.819 0.736 . . . . 0.0 109.915 175.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 72.1 mt -61.12 -35.9 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 C-N-CA 124.226 1.01 . . . . 0.0 109.431 178.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -66.91 -45.49 77.77 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 118.88 -0.581 . . . . 0.0 110.418 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.405 ' OG ' HG21 ' A' ' 33' ' ' THR . 7.5 t -63.86 -54.52 33.63 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 118.794 0.724 . . . . 0.0 111.336 -178.213 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 55.5 mt -63.16 -33.77 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.22 -51.95 34.96 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-O 119.545 -0.586 . . . . 0.0 112.437 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.646 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -70.51 -31.83 69.08 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 118.056 0.928 . . . . 0.0 110.625 -178.525 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.71 -46.75 71.33 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -61.29 -46.95 88.21 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 176.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 66.4 tp -56.91 -45.63 82.53 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.587 0.355 . . . . 0.0 110.483 -177.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -66.61 -48.28 70.0 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.761 179.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.9 mm-40 -61.87 -27.77 69.03 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -175.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.2 t -97.79 -24.84 15.27 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 36.9 ptt180 . . . . . 0 N--CA 1.462 0.155 0 CA-C-N 119.346 0.976 . . . . 0.0 111.408 177.358 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.405 HG22 HG22 ' A' ' 40' ' ' ILE . 0.6 OUTLIER . . . . . 0 N--CA 1.462 0.152 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.5 p -50.06 -31.54 13.33 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 -173.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.08 -47.52 82.54 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.872 0.76 . . . . 0.0 109.981 176.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -67.69 -31.29 71.15 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.3 0.572 . . . . 0.0 110.4 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.37 -45.93 82.16 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.366 -178.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.6 mt -64.72 -42.73 95.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 174.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -59.75 -32.81 70.91 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 122.546 -0.096 . . . . 0.0 111.034 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.9 m -76.39 -41.39 48.07 Favored 'General case' 0 C--O 1.227 -0.08 0 C-N-CA 122.421 0.288 . . . . 0.0 111.162 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 58.4 mt -61.79 -29.26 70.02 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-N 118.867 0.758 . . . . 0.0 109.166 174.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.99 -14.38 31.11 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-O 119.199 -0.779 . . . . 0.0 113.562 178.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -101.84 -3.81 27.36 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 118.806 1.303 . . . . 0.0 112.136 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.474 HG21 HD13 ' A' ' 51' ' ' ILE . 27.4 m -125.86 -17.97 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.1 tp -48.96 -30.5 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 C-N-CA 123.171 0.588 . . . . 0.0 112.458 -178.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -64.23 -45.42 88.26 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.24 0.473 . . . . 0.0 110.713 178.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -74.07 -38.95 63.78 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.282 0.633 . . . . 0.0 110.082 -178.233 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.0 mt -62.92 -53.04 60.2 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.24 -178.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.437 ' O ' HG13 ' A' ' 113' ' ' ILE . 81.0 mt -63.82 -59.11 4.96 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.71 -0.662 . . . . 0.0 109.463 177.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 77.7 p -48.82 -45.53 40.63 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 119.008 0.822 . . . . 0.0 112.457 -174.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 89.5 m-20 -69.13 -44.76 71.72 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 118.852 0.751 . . . . 0.0 110.764 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.05 -44.88 94.39 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 118.306 0.503 . . . . 0.0 111.434 -177.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -74.73 -33.44 31.24 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.13 0 CA-C-N 118.661 0.664 . . . . 0.0 112.138 179.864 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.21 -26.94 65.97 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.572 176.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.75 -17.65 57.34 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 125.963 1.705 . . . . 0.0 110.842 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 37.6 m -83.48 155.89 23.15 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -172.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 -103.32 -175.94 2.94 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 169.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 22.2 tm0? -55.54 -41.2 72.87 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 119.398 0.999 . . . . 0.0 110.982 -178.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.81 -45.85 87.77 Favored 'General case' 0 C--O 1.233 0.206 0 O-C-N 121.583 -0.698 . . . . 0.0 110.891 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 46.6 m170 -73.29 -37.6 66.19 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 118.783 -0.627 . . . . 0.0 111.737 -176.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.72 -34.03 76.95 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 119.278 0.945 . . . . 0.0 109.0 176.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -66.04 -41.69 90.54 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -65.39 -42.63 92.42 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 176.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.4 -35.87 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 80.1 ttt-85 -67.77 -34.34 76.61 Favored 'General case' 0 N--CA 1.453 -0.316 0 O-C-N 122.31 -0.244 . . . . 0.0 110.708 177.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.2 ttt -66.1 -44.37 84.53 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 176.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.422 ' C ' HD23 ' A' ' 127' ' ' LEU . 6.4 tt -56.29 -48.9 75.7 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 79.0 mt -73.03 -26.54 61.34 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -178.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 24.6 t70 . . . . . 0 N--CA 1.455 -0.179 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 175.979 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_endo . . . . . 0 N--CA 1.457 -0.675 0 N-CA-C 110.743 -0.522 . . . . 0.0 110.743 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 38.9 t -68.02 152.47 45.47 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 174.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 162' ' ' TYR . . . . . 0.464 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 17.8 t80 -143.81 132.13 22.03 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 29.2 t -127.59 144.36 50.77 Favored Pre-proline 0 N--CA 1.452 -0.365 0 C-N-CA 123.348 0.659 . . . . 0.0 110.619 177.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -65.54 -7.01 14.91 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 122.888 2.392 . . . . 0.0 111.564 175.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 80.6 p . . . . . 0 CA--C 1.531 0.249 0 C-N-CA 123.043 0.537 . . . . 0.0 111.975 179.193 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.406 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 16.4 t70 . . . . . 0 CA--C 1.533 0.299 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.406 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 18.1 t80 -55.54 -16.03 3.47 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.351 0.66 . . . . 0.0 111.636 179.205 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -56.04 -43.43 77.84 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.737 0.415 . . . . 0.0 111.018 177.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -63.4 -36.87 85.17 Favored 'General case' 0 C--O 1.227 -0.118 0 CA-C-N 118.321 0.509 . . . . 0.0 110.542 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -65.85 -54.44 26.77 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 117.812 0.278 . . . . 0.0 110.366 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 63.9 t -60.63 -53.73 44.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.03 -32.81 68.33 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 123.453 0.701 . . . . 0.0 112.162 -177.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 88.1 m -73.71 -40.88 63.27 Favored 'General case' 0 C--N 1.338 0.101 0 CA-C-N 118.557 0.617 . . . . 0.0 110.469 176.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.1 tp -66.7 -30.55 70.81 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.957 0.408 . . . . 0.0 110.061 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -72.65 -40.38 66.4 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.03 0.932 . . . . 0.0 109.691 176.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.0 t -62.12 -30.4 71.0 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 174.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.64 -41.53 68.7 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 122.917 0.487 . . . . 0.0 109.89 175.316 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.412 ' HB2' ' HE3' ' A' ' 18' ' ' LYS . 39.1 ttmt . . . . . 0 CA--C 1.529 0.164 0 C-N-CA 123.821 0.848 . . . . 0.0 111.269 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.8 mm . . . . . 0 CA--C 1.528 0.107 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.2 m -49.9 124.55 10.11 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.025 0.53 . . . . 0.0 111.951 -174.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.86 -19.41 63.19 Favored Glycine 0 CA--C 1.525 0.659 0 CA-C-O 119.584 -0.565 . . . . 0.0 112.301 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.426 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 42.0 t -66.31 -39.2 89.14 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.173 0.987 . . . . 0.0 110.169 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.6 mmp_? -60.09 -45.66 92.19 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 58.3 mt -65.65 -34.51 70.84 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.924 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.7 tmtt? -63.02 -43.75 97.85 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 122.084 -0.385 . . . . 0.0 110.466 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.426 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.4 OUTLIER -65.26 -43.73 90.38 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 118.152 0.433 . . . . 0.0 110.705 176.251 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.5 mt -62.17 -57.93 9.65 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 121.261 -0.176 . . . . 0.0 110.875 -178.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.565 HG21 ' HB2' ' A' ' 71' ' ' SER . 51.5 p -56.29 -48.98 75.55 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 178.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.3 t -63.44 -44.86 93.32 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 120.021 -0.672 . . . . 0.0 111.6 -174.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -76.78 -21.33 55.31 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.07 -56.66 9.09 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 167.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 46.9 mt -68.97 -17.51 63.94 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.524 1.13 . . . . 0.0 113.075 -175.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -59.9 -26.14 65.66 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -178.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -149.04 -28.46 0.28 Allowed 'General case' 0 C--N 1.34 0.154 0 N-CA-C 113.84 1.052 . . . . 0.0 113.84 -175.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.575 HG22 HG22 ' A' ' 93' ' ' THR . 37.9 mm 44.87 74.76 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-O 121.923 0.868 . . . . 0.0 111.605 -179.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -147.98 22.41 1.1 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.354 1.062 . . . . 0.0 109.234 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.558 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -148.63 38.83 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.116 0 C-N-CA 124.765 1.226 . . . . 0.0 109.251 -171.176 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.53 ' CD ' ' H ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -52.95 -57.13 11.35 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -174.508 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.53 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 88.4 p -72.67 -26.35 61.6 Favored 'General case' 0 CA--C 1.521 -0.144 0 O-C-N 121.489 -0.757 . . . . 0.0 112.37 -173.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.682 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.18 -44.35 16.53 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 119.189 -0.434 . . . . 0.0 109.932 -179.074 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 38.0 mt -55.48 -50.85 63.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 171.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 15.9 mm -66.92 -51.81 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -176.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 73.8 m -57.68 -33.59 68.52 Favored 'General case' 0 N--CA 1.458 -0.058 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.324 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.1 tp -69.4 -45.41 69.3 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 118.582 -0.723 . . . . 0.0 112.083 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 38.1 pt -71.35 -34.42 53.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 119.63 1.105 . . . . 0.0 111.699 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.532 HD13 HG21 ' A' ' 104' ' ' VAL . 97.7 mt -63.05 -55.49 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -64.51 -27.12 68.75 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.308 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -62.78 -45.56 92.1 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 175.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.7 t -61.2 -43.37 98.99 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.903 0.382 . . . . 0.0 110.154 175.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 14.7 tpp180 -59.31 -44.86 92.51 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.801 0.84 . . . . 0.0 112.698 -176.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 70.2 mt -89.66 -15.04 33.54 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 -173.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 72.5 m -100.5 165.28 14.67 Favored Pre-proline 0 CA--C 1.537 0.461 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -172.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.68 177.31 0.24 Allowed 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 125.298 3.998 . . . . 0.0 115.036 -178.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -58.78 -41.47 86.74 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.853 0.861 . . . . 0.0 111.875 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.9 m -60.09 -21.3 61.33 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 177.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -93.55 -20.13 20.54 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 118.848 -0.596 . . . . 0.0 111.141 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.8 mptt -64.49 -46.63 82.15 Favored 'General case' 0 C--N 1.342 0.239 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 167.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -65.15 -52.46 55.01 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.47 -42.51 93.91 Favored Glycine 0 C--N 1.338 0.641 0 N-CA-C 111.581 -0.608 . . . . 0.0 111.581 -179.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.9 t -68.83 -34.81 76.11 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 117.735 0.767 . . . . 0.0 110.493 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.4 mt -62.57 -32.45 73.43 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 119.47 1.032 . . . . 0.0 110.818 174.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -73.81 -31.47 63.26 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.845 0.748 . . . . 0.0 111.417 175.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 80.7 mt -72.58 -40.43 62.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 118.622 0.646 . . . . 0.0 110.769 175.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.7 mt -66.63 -35.05 73.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -67.17 -45.47 76.89 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 119.023 -0.513 . . . . 0.0 110.82 176.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.565 ' HB2' HG21 ' A' ' 33' ' ' THR . 79.3 p -66.03 -57.14 8.42 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 118.534 0.606 . . . . 0.0 110.832 -176.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 59.3 mt -64.19 -32.07 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.76 -55.87 17.69 Favored Glycine 0 CA--C 1.527 0.796 0 CA-C-O 119.813 -0.437 . . . . 0.0 112.52 178.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.635 HH11 ' HG3' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -66.6 -30.8 71.17 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-N 117.964 0.882 . . . . 0.0 110.561 -178.929 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.03 -44.93 71.72 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 122.574 -0.078 . . . . 0.0 110.828 176.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -64.05 -48.24 77.02 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 177.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 57.5 tp -58.26 -47.52 83.33 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 122.834 0.454 . . . . 0.0 110.08 -176.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -64.12 -43.15 96.18 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.407 -0.183 . . . . 0.0 110.599 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -65.18 -34.58 78.71 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -175.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.5 t -94.6 -18.63 21.2 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -177.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? . . . . . 0 N--CA 1.464 0.229 0 CA-C-N 119.027 0.83 . . . . 0.0 112.802 178.231 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.575 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.226 -0.166 0 CA-C-O 119.718 -0.182 . . . . 0.0 110.868 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.6 p -47.37 -31.74 4.27 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -176.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.27 -45.61 87.34 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.807 0.73 . . . . 0.0 109.943 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 46.1 t60 -66.87 -29.62 69.57 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 123.482 0.713 . . . . 0.0 109.927 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.17 -43.82 77.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 123.045 0.538 . . . . 0.0 110.548 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.17 -43.58 98.91 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.069 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 174.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -59.53 -33.83 71.87 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.682 -0.236 . . . . 0.0 111.13 178.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.1 m -73.72 -42.05 61.72 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 122.302 -0.249 . . . . 0.0 111.218 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 48.7 mt -60.39 -30.21 69.44 Favored 'General case' 0 C--N 1.339 0.126 0 O-C-N 121.418 -0.802 . . . . 0.0 109.274 173.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.43 -14.91 22.15 Favored Glycine 0 CA--C 1.531 1.076 0 CA-C-O 119.112 -0.827 . . . . 0.0 113.918 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -100.82 -6.92 24.15 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.016 1.408 . . . . 0.0 112.074 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.532 HG21 HD13 ' A' ' 51' ' ' ILE . 27.1 m -123.42 -17.91 4.42 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -177.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.434 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.0 tp -55.22 -26.08 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 CA-C-N 118.246 0.476 . . . . 0.0 111.527 -177.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.402 ' HG2' ' H ' ' A' ' 106' ' ' GLN . 16.9 pt20 -61.54 -53.32 57.86 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.379 0.672 . . . . 0.0 111.65 176.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -75.55 -34.48 60.73 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 122.002 -0.436 . . . . 0.0 110.912 -178.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 88.9 mt -62.38 -46.94 86.37 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.554 ' O ' HD12 ' A' ' 113' ' ' ILE . 55.9 mt -71.31 -53.95 12.49 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 118.532 -0.747 . . . . 0.0 111.19 179.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 69.2 p -55.06 -35.76 64.86 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 119.033 0.833 . . . . 0.0 111.118 -176.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -70.1 -48.62 56.87 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-N 118.798 0.726 . . . . 0.0 110.269 173.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.96 -34.39 65.64 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.984 0.914 . . . . 0.0 113.369 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.554 HD12 ' O ' ' A' ' 109' ' ' LEU . 0.2 OUTLIER -84.5 -38.08 13.27 Favored 'Isoleucine or valine' 0 C--N 1.343 0.288 0 C-N-CA 117.482 -1.687 . . . . 0.0 112.667 170.794 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.27 -22.42 66.94 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.881 0.764 . . . . 0.0 110.85 -178.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.04 -17.11 30.02 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.064 0.946 . . . . 0.0 110.995 178.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.42 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 53.1 p -85.41 167.57 15.4 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -172.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -102.5 177.17 4.94 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 168.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.3 -33.27 63.13 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 118.546 0.612 . . . . 0.0 112.32 -176.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -70.63 -49.93 42.36 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 122.03 -0.419 . . . . 0.0 111.312 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.42 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 6.2 m170 -67.56 -34.07 76.31 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-O 119.052 -0.499 . . . . 0.0 110.41 179.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.5 ttpt -55.67 -51.94 65.55 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 118.736 0.698 . . . . 0.0 109.204 171.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -58.94 -38.96 80.22 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 120.674 -0.411 . . . . 0.0 110.864 -176.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.8 mtpp -63.06 -41.59 99.5 Favored 'General case' 0 N--CA 1.455 -0.187 0 O-C-N 122.338 -0.226 . . . . 0.0 110.955 175.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 97.9 mt -67.65 -36.45 76.13 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 O-C-N 121.863 -0.523 . . . . 0.0 109.595 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -66.26 -32.58 74.08 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 176.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.4 ttt -65.67 -42.68 91.04 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 175.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 89.2 mt -58.99 -43.32 91.46 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.119 175.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.1 mt -65.62 -36.1 82.73 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 117.676 0.216 . . . . 0.0 111.315 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.0 t70 . . . . . 0 N--CA 1.454 -0.24 0 CA-C-N 118.05 0.386 . . . . 0.0 110.51 178.313 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo . . . . . 0 N--CA 1.451 -1.001 0 N-CA-C 110.119 -0.762 . . . . 0.0 110.119 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 36.5 t -69.12 156.83 38.02 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 176.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 162' ' ' TYR . . . . . 0.418 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 13.0 t80 -145.99 131.89 19.14 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.575 0.35 . . . . 0.0 110.988 -179.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 31.2 t -119.65 128.83 25.69 Favored Pre-proline 0 N--CA 1.452 -0.329 0 C-N-CA 122.95 0.5 . . . . 0.0 110.153 175.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.15 -16.25 48.41 Favored 'Trans proline' 0 N--CA 1.449 -1.091 0 C-N-CA 122.64 2.227 . . . . 0.0 109.696 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 2.1 m . . . . . 0 N--CA 1.453 -0.304 0 C-N-CA 123.972 0.909 . . . . 0.0 112.47 -175.367 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 15.2 t70 . . . . . 0 CA--C 1.536 0.429 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -55.18 -14.38 1.67 Allowed 'General case' 0 C--N 1.339 0.111 0 C-N-CA 123.483 0.713 . . . . 0.0 111.507 178.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -54.56 -42.88 71.5 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.264 0.626 . . . . 0.0 110.481 177.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 56.1 m-20 -55.91 -46.35 78.42 Favored 'General case' 0 C--O 1.227 -0.104 0 CA-C-N 118.285 0.493 . . . . 0.0 110.51 177.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -65.98 -50.03 65.74 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 117.777 0.262 . . . . 0.0 110.591 -176.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.8 t -63.72 -54.6 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 -178.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.89 -32.72 67.99 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.069 0.548 . . . . 0.0 111.897 -178.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 80.0 m -73.02 -41.46 64.21 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 118.312 0.505 . . . . 0.0 110.525 177.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.2 tp -66.12 -32.7 74.31 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.086 0.47 . . . . 0.0 110.097 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -68.58 -43.49 76.41 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.967 0.907 . . . . 0.0 109.616 175.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 65.4 m -64.39 -26.36 68.43 Favored 'General case' 0 C--O 1.227 -0.105 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 175.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.423 ' CE2' HD11 ' A' ' 68' ' ' ILE . 0.1 OUTLIER -71.81 -40.55 69.06 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 175.574 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 87.4 tttt . . . . . 0 N--CA 1.456 -0.157 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 176.123 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 19.7 mm . . . . . 0 CA--C 1.528 0.109 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.0 m -50.56 127.99 19.18 Favored 'General case' 0 CA--C 1.522 -0.099 0 C-N-CA 122.954 0.502 . . . . 0.0 111.641 -174.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.55 -20.11 67.59 Favored Glycine 0 CA--C 1.526 0.758 0 CA-C-O 119.098 -0.834 . . . . 0.0 112.546 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.428 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 40.3 t -66.05 -37.19 85.23 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 118.801 1.3 . . . . 0.0 110.059 -178.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.5 mmp_? -61.99 -49.0 77.83 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 176.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.6 mt -61.5 -38.53 80.33 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.883 -179.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -65.76 -38.96 90.51 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 118.954 -0.546 . . . . 0.0 111.291 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.1 OUTLIER -66.61 -41.38 88.51 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 119.279 0.945 . . . . 0.0 110.238 175.52 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.2 mt -62.0 -57.47 11.55 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 119.55 -0.262 . . . . 0.0 111.042 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.527 HG21 ' HB2' ' A' ' 71' ' ' SER . 66.6 p -56.85 -42.46 79.74 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 118.228 0.467 . . . . 0.0 111.707 177.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.7 m -55.44 -56.27 22.1 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 119.234 -0.413 . . . . 0.0 110.873 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -69.35 -32.72 71.97 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 118.524 -1.27 . . . . 0.0 111.815 -175.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.29 -58.4 8.78 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 174.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.7 mt -71.36 -15.81 62.4 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.711 0.804 . . . . 0.0 112.697 -174.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -61.09 -28.42 69.07 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 25.0 t60 -150.76 -24.37 0.22 Allowed 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -175.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.5 HG22 HG22 ' A' ' 93' ' ' THR . 30.3 mm 46.65 74.67 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-O 121.645 0.736 . . . . 0.0 111.522 -178.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -147.62 21.16 1.17 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.898 0.879 . . . . 0.0 109.918 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.555 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.01 37.76 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.087 0 C-N-CA 124.331 1.052 . . . . 0.0 109.365 -171.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.467 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -53.2 -54.19 39.67 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -174.676 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 81.0 p -75.22 -28.42 59.92 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -173.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.703 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -79.44 -45.41 19.5 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -179.247 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 24.4 mt -56.11 -51.76 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 172.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.431 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 11.7 mm -66.17 -50.83 65.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-O 119.02 -0.514 . . . . 0.0 112.124 -176.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 63.6 m -58.03 -33.55 69.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 119.198 0.908 . . . . 0.0 110.558 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 54.1 tp -70.06 -43.36 71.37 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 36.5 pt -73.24 -35.48 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-N 119.588 1.086 . . . . 0.0 111.927 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.475 HD13 HG21 ' A' ' 104' ' ' VAL . 96.8 mt -64.02 -52.37 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 178.079 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.411 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 37.3 t70 -62.39 -30.53 71.27 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.286 178.252 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -61.37 -42.51 98.82 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 175.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.1 t -68.39 -35.73 78.1 Favored 'General case' 0 C--N 1.338 0.098 0 O-C-N 122.097 -0.377 . . . . 0.0 110.701 175.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.411 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 8.3 tpt180 -64.82 -42.24 95.12 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.925 0.89 . . . . 0.0 113.056 -174.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 79.6 mt -91.24 -14.31 31.19 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -174.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 71.1 m -106.1 155.53 38.32 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -170.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.69 -174.95 0.79 Allowed 'Trans proline' 0 N--CA 1.459 -0.52 1 C-N-CA 125.788 4.325 . . . . 0.0 113.823 -179.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -53.77 -45.1 70.54 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 125.732 1.613 . . . . 0.0 114.738 -170.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 73.3 m -61.21 -27.33 68.36 Favored 'General case' 0 CA--C 1.523 -0.06 0 CA-C-N 118.484 0.584 . . . . 0.0 110.152 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 24.0 m170 -91.58 -16.99 26.29 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.263 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -66.09 -47.57 73.79 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 169.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 58.4 tp -66.86 -48.64 68.17 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.449 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.11 -46.45 92.67 Favored Glycine 0 C--N 1.338 0.643 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.8 t -62.65 -45.22 93.85 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 117.495 0.647 . . . . 0.0 110.069 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 25.2 mt -54.22 -41.18 68.37 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 119.162 0.892 . . . . 0.0 110.774 176.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -68.31 -27.0 65.91 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.028 0.831 . . . . 0.0 111.263 178.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.423 HD11 ' CE2' ' A' ' 17' ' ' PHE . 72.0 mt -75.12 -44.4 43.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 CA-C-N 118.247 0.476 . . . . 0.0 111.23 174.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 1.6 mp -60.33 -34.69 58.49 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 175.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.425 ' CG ' HH22 ' A' ' 74' ' ' ARG . 38.3 t70 -71.53 -45.4 62.47 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.744 1.218 . . . . 0.0 111.584 -178.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.527 ' HB2' HG21 ' A' ' 33' ' ' THR . 65.8 p -67.29 -56.04 11.42 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 119.009 0.822 . . . . 0.0 110.478 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 49.2 mt -63.37 -32.27 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.6 -55.68 21.44 Favored Glycine 0 CA--C 1.525 0.677 0 CA-C-O 119.65 -0.528 . . . . 0.0 112.02 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.425 HH22 ' CG ' ' A' ' 70' ' ' ASP . 5.1 ptp85 -67.14 -32.85 74.24 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 118.086 0.943 . . . . 0.0 110.658 -178.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.87 -44.7 69.26 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 121.514 -0.074 . . . . 0.0 110.803 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.2 m-30 -62.45 -47.93 81.86 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 176.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -59.17 -47.76 84.12 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 123.344 0.402 . . . . 0.0 110.144 -176.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -62.27 -47.74 83.01 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 120.515 0.198 . . . . 0.0 110.651 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -66.11 -38.04 87.23 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 121.039 -0.264 . . . . 0.0 111.591 -175.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 6.2 t -82.61 -19.42 38.41 Favored 'General case' 0 C--O 1.226 -0.138 0 CA-C-N 118.108 0.413 . . . . 0.0 111.592 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 79.8 ttt-85 . . . . . 0 C--N 1.339 0.133 0 CA-C-N 117.978 0.354 . . . . 0.0 111.351 174.763 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.5 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.307 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.6 p -52.52 -28.88 22.44 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.162 0.985 . . . . 0.0 113.546 -176.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.11 -46.17 88.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.819 0.736 . . . . 0.0 109.758 176.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 9.4 m170 -73.38 -24.28 60.29 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.506 178.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.431 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -63.67 -46.45 85.5 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 175.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.1 mt -64.46 -44.24 96.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.171 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 176.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -58.17 -36.39 72.98 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 122.516 -0.115 . . . . 0.0 111.042 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.3 m -74.04 -41.03 62.41 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-O 119.626 -0.226 . . . . 0.0 111.482 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.4 mt -60.36 -30.21 69.41 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.824 0.738 . . . . 0.0 109.348 174.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.0 -15.44 21.13 Favored Glycine 0 CA--C 1.528 0.861 0 CA-C-O 119.222 -0.765 . . . . 0.0 113.967 179.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -101.3 -6.02 24.68 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.01 1.405 . . . . 0.0 112.28 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.475 HG21 HD13 ' A' ' 51' ' ' ILE . 35.0 m -123.02 -16.72 5.14 Favored 'Isoleucine or valine' 0 C--N 1.339 0.135 0 C-N-CA 122.941 0.496 . . . . 0.0 112.005 -178.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.44 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.6 tp -52.2 -26.34 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 122.884 0.474 . . . . 0.0 111.58 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.2 pt20 -63.89 -48.03 78.25 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.037 0.535 . . . . 0.0 111.57 178.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -79.39 -31.39 42.78 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 118.107 0.412 . . . . 0.0 110.721 -178.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.0 mp -61.67 -53.3 57.93 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.4 ' O ' HG13 ' A' ' 113' ' ' ILE . 85.5 mt -66.07 -56.72 10.13 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 118.621 -0.704 . . . . 0.0 110.389 178.18 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 80.9 p -54.02 -40.57 67.15 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 119.238 0.926 . . . . 0.0 112.229 -174.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -71.04 -47.04 60.82 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 119.465 1.029 . . . . 0.0 110.357 176.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.22 -37.92 72.95 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 118.949 -0.548 . . . . 0.0 111.904 -177.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -82.92 -33.93 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 119.058 0.845 . . . . 0.0 111.925 177.041 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.84 -28.22 67.37 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 119.789 -0.764 . . . . 0.0 111.028 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.21 -14.76 45.82 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.466 0.707 . . . . 0.0 111.053 177.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.41 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 32.4 p -74.39 159.57 32.16 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 -171.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.1 t-20 -96.25 174.39 6.91 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 169.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -55.42 -43.58 75.45 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.231 0.923 . . . . 0.0 111.507 -176.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -66.01 -40.78 91.38 Favored 'General case' 0 CA--C 1.527 0.093 0 O-C-N 121.856 -0.528 . . . . 0.0 110.529 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.41 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 40.2 m80 -69.94 -38.77 76.28 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.376 -0.345 . . . . 0.0 110.996 -178.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -39.3 90.14 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 174.295 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -66.06 -38.35 88.1 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.563 -178.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -64.33 -42.79 96.11 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 121.071 -0.251 . . . . 0.0 111.013 175.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.7 mt -67.17 -34.81 71.8 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -66.54 -36.06 81.76 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 122.75 0.42 . . . . 0.0 110.454 176.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.3 ttt -65.56 -42.13 92.16 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 109.668 -0.494 . . . . 0.0 109.668 176.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.41 HD23 ' C ' ' A' ' 127' ' ' LEU . 7.2 tt -58.05 -49.9 75.28 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 176.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.79 -30.29 69.69 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 122.264 -0.273 . . . . 0.0 111.715 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 36.7 t70 . . . . . 0 N--CA 1.454 -0.245 0 CA-C-N 118.144 0.429 . . . . 0.0 110.058 177.63 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 160' ' ' PRO . . . . . 0.409 ' HD2' ' N ' ' A' ' 27' ' ' SER . 85.3 Cg_endo . . . . . 0 N--CA 1.456 -0.68 0 N-CA-C 109.509 -0.997 . . . . 0.0 109.509 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 67.9 p -72.83 157.29 37.77 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.675 0.274 . . . . 0.0 111.12 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 162' ' ' TYR . . . . . 0.411 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 4.2 t80 -144.25 129.62 18.87 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 123.338 0.655 . . . . 0.0 109.771 178.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 28.8 t -125.65 138.16 31.37 Favored Pre-proline 0 N--CA 1.454 -0.246 0 C-N-CA 123.144 0.577 . . . . 0.0 111.512 -177.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -67.83 -1.59 7.11 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 123.556 2.837 . . . . 0.0 111.44 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 57.2 p . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 118.673 -0.68 . . . . 0.0 112.145 -179.642 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.424 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 27.2 t70 . . . . . 0 CA--C 1.533 0.323 0 N-CA-C 109.182 -0.674 . . . . 0.0 109.182 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.424 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 19.9 t80 -55.79 -14.44 2.34 Favored 'General case' 0 CA--C 1.532 0.28 0 O-C-N 121.721 -0.612 . . . . 0.0 111.484 178.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.8 tp60 -54.25 -40.23 67.57 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.678 0.791 . . . . 0.0 110.877 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -63.42 -39.48 94.6 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 118.779 0.718 . . . . 0.0 110.703 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.1 t80 -64.6 -54.3 34.18 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 118.464 0.575 . . . . 0.0 109.795 179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.6 t -59.57 -55.67 22.32 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.145 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 -178.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.1 -33.17 67.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.507 0.723 . . . . 0.0 112.197 -178.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 60.2 m -70.73 -44.97 65.74 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.705 0.684 . . . . 0.0 110.33 176.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.7 tp -65.36 -33.72 76.63 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.235 0.54 . . . . 0.0 110.071 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -66.34 -46.87 75.31 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.49 0.716 . . . . 0.0 109.757 177.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 61.6 m -63.86 -26.52 68.65 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -69.54 -45.7 68.17 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 177.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 15.7 pttm . . . . . 0 CA--C 1.529 0.167 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -177.594 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.5 mm . . . . . 0 CA--C 1.533 0.317 0 CA-C-O 120.842 0.353 . . . . 0.0 110.408 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.4 t -57.12 136.21 56.38 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.963 0.411 . . . . 0.0 111.146 -177.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -71.95 -22.18 78.84 Favored Glycine 0 CA--C 1.524 0.643 0 CA-C-O 119.072 -0.849 . . . . 0.0 114.601 -170.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 79.7 p -64.39 -38.7 91.96 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 119.384 1.592 . . . . 0.0 111.635 -174.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.6 mpt_? -65.69 -40.74 92.66 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 42.4 mt -64.89 -36.07 76.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 178.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.3 mmtt -65.35 -39.87 92.89 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.606 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.36 -48.57 77.39 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 118.746 0.703 . . . . 0.0 110.382 174.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.1 mt -59.66 -59.16 5.88 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 122.293 -0.255 . . . . 0.0 110.872 -178.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 59.4 p -55.67 -47.62 76.4 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.8 t -63.9 -43.04 97.2 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.528 -176.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -74.56 -22.78 58.81 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.695 0.68 . . . . 0.0 112.811 -178.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.5 -56.46 9.45 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.895 0.77 . . . . 0.0 109.545 167.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 65.6 mt -69.88 -14.89 62.95 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.931 0.892 . . . . 0.0 113.076 -175.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -55.81 -30.59 61.61 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -178.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.9 t-80 -151.9 -23.61 0.19 Allowed 'General case' 0 C--N 1.34 0.174 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -176.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 41.1 mm 46.18 73.51 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 121.941 0.877 . . . . 0.0 111.446 -178.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -136.63 9.33 3.11 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.272 1.029 . . . . 0.0 109.207 177.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.536 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -142.97 111.77 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 C-N-CA 125.125 1.37 . . . . 0.0 107.692 -177.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.471 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -108.13 -64.05 1.26 Allowed 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.686 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 74.0 p -68.75 -24.15 64.41 Favored 'General case' 0 CA--C 1.521 -0.15 0 C-N-CA 123.096 0.558 . . . . 0.0 111.909 -173.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.617 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -74.82 -53.72 8.61 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.995 0.918 . . . . 0.0 109.143 179.715 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.419 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 10.1 mt -57.22 -47.08 84.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 C-N-CA 123.129 0.572 . . . . 0.0 110.165 175.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.424 HD13 ' HA ' ' A' ' 47' ' ' ILE . 12.7 mm -69.47 -46.95 74.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-O 119.067 -0.492 . . . . 0.0 111.652 -176.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.0 m -61.31 -33.4 73.52 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 119.318 -0.953 . . . . 0.0 109.891 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.6 tp -68.07 -44.97 75.1 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 119.183 -0.437 . . . . 0.0 112.037 -178.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.5 pt -73.51 -35.69 45.86 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-N 119.207 0.912 . . . . 0.0 111.871 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.475 HD13 HG21 ' A' ' 104' ' ' VAL . 96.0 mt -64.29 -49.34 81.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 178.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -58.32 -40.8 83.01 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.777 177.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -57.68 -42.46 83.65 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 175.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.0 t -65.41 -47.05 77.61 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -75.48 -24.74 56.96 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -174.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 53.6 mt -81.53 -15.44 54.85 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 178.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.403 ' HB3' ' CG ' ' A' ' 61' ' ' HIS . 74.4 m -120.78 153.77 57.12 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -171.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -74.23 -169.54 0.6 Allowed 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 125.178 3.919 . . . . 0.0 114.26 -175.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -35.02 -59.99 0.48 Allowed 'General case' 0 C--O 1.236 0.345 0 C-N-CA 128.258 2.623 . . . . 0.0 115.787 -172.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.8 p -59.79 -26.29 65.61 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 122.309 -0.245 . . . . 0.0 110.987 -175.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.403 ' CG ' ' HB3' ' A' ' 57' ' ' CYS . 52.5 m-70 -89.6 -18.87 25.73 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 119.625 -0.226 . . . . 0.0 110.946 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -66.04 -49.1 68.9 Favored 'General case' 0 C--N 1.343 0.322 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 171.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.5 mt -67.27 -44.6 78.91 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.502 178.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.71 -50.88 61.67 Favored Glycine 0 C--N 1.335 0.504 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 9.9 t -65.75 -36.88 84.83 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 118.749 -0.644 . . . . 0.0 110.963 -178.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 66' ' ' LEU . 36.2 mt -60.99 -39.11 88.38 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 119.655 1.116 . . . . 0.0 111.635 176.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -72.21 -31.67 66.07 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.349 0.977 . . . . 0.0 111.094 177.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 64.3 mt -71.91 -47.63 54.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 O-C-N 121.895 -0.503 . . . . 0.0 110.529 177.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.4 mt -59.84 -37.19 70.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.179 0 C-N-CA 124.258 1.023 . . . . 0.0 109.213 176.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -66.19 -47.48 73.79 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 118.987 -0.53 . . . . 0.0 110.868 178.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.8 t -64.52 -53.73 43.4 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 118.615 0.643 . . . . 0.0 111.129 -176.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 57.2 mt -63.27 -34.2 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 179.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.06 -51.35 39.78 Favored Glycine 0 CA--C 1.526 0.734 0 CA-C-O 119.823 -0.432 . . . . 0.0 112.492 -178.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.635 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -71.17 -31.46 67.68 Favored 'General case' 0 C--N 1.338 0.085 0 CA-C-N 117.996 0.898 . . . . 0.0 111.008 -178.894 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.87 -43.84 74.51 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 176.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.0 m-30 -62.38 -45.89 91.12 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 175.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.11 -46.57 87.99 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 123.358 0.411 . . . . 0.0 110.287 -176.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -64.18 -45.17 89.56 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.598 0.237 . . . . 0.0 110.565 178.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -62.75 -39.51 94.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -175.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.6 t -84.33 -28.08 27.31 Favored 'General case' 0 C--O 1.232 0.148 0 O-C-N 122.093 -0.38 . . . . 0.0 111.8 -177.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 . . . . . 0 C--N 1.341 0.238 0 CA-C-N 118.412 0.551 . . . . 0.0 111.523 175.64 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.408 ' HA ' ' HB3' ' A' ' 43' ' ' GLU . 0.6 OUTLIER . . . . . 0 CA--C 1.533 0.289 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.0 p -50.22 -32.85 17.63 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.475 1.51 . . . . 0.0 114.813 -172.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.54 -47.0 87.54 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.225 0.921 . . . . 0.0 109.799 177.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 55.3 m-70 -78.15 -17.37 56.93 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.235 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.75 -44.67 80.87 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 173.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.6 mt -63.61 -44.35 98.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -57.78 -35.28 70.58 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.981 -0.099 . . . . 0.0 111.154 178.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.9 m -74.39 -41.77 60.39 Favored 'General case' 0 C--N 1.339 0.15 0 O-C-N 122.291 -0.256 . . . . 0.0 111.309 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 52.1 mt -60.28 -30.15 69.28 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 174.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.44 -14.63 28.31 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-O 119.08 -0.844 . . . . 0.0 113.641 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -100.81 -4.76 27.32 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.95 1.375 . . . . 0.0 112.075 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.475 HG21 HD13 ' A' ' 51' ' ' ILE . 34.5 m -124.48 -21.8 2.68 Favored 'Isoleucine or valine' 0 C--N 1.338 0.086 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -178.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.414 ' HA ' HD12 ' A' ' 105' ' ' ILE . 11.0 tp -52.83 -26.67 11.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 123.277 0.631 . . . . 0.0 112.294 -175.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.2 pt20 -62.85 -45.2 93.7 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 122.942 0.497 . . . . 0.0 111.255 177.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -74.01 -39.2 63.77 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.091 0.472 . . . . 0.0 110.132 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 68.8 mt -62.05 -50.49 71.77 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.459 -177.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.405 ' O ' HG13 ' A' ' 113' ' ' ILE . 66.2 mt -65.63 -56.79 10.32 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.286 176.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 87.5 p -50.66 -41.65 55.65 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 119.181 0.9 . . . . 0.0 111.893 -174.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -70.74 -50.79 32.36 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 118.791 0.723 . . . . 0.0 111.148 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.483 ' O ' ' HE3' ' A' ' 115' ' ' LYS . . . -56.24 -32.4 64.42 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.599 0.76 . . . . 0.0 112.855 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -84.85 -38.35 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 CA-C-N 119.673 1.124 . . . . 0.0 111.788 174.772 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.25 -26.44 65.68 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 121.956 -0.465 . . . . 0.0 111.186 -179.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.483 ' HE3' ' O ' ' A' ' 112' ' ' ALA . 0.2 OUTLIER -80.73 -21.01 41.54 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.13 0.572 . . . . 0.0 110.075 177.414 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.3 m -80.93 169.86 17.0 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 122.063 0.935 . . . . 0.0 113.494 -173.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -105.78 -176.89 3.21 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 114.124 -1.398 . . . . 0.0 107.262 169.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . 0.42 ' O ' ' HE2' ' A' ' 121' ' ' LYS . 50.4 mm-40 -55.97 -35.91 67.25 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.789 -0.569 . . . . 0.0 112.031 -177.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -71.36 -49.6 40.61 Favored 'General case' 0 N--CA 1.456 -0.173 0 O-C-N 121.932 -0.48 . . . . 0.0 111.475 -177.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 49.4 m-70 -69.39 -34.6 74.75 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 122.191 -0.318 . . . . 0.0 110.679 -179.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.42 ' HE2' ' O ' ' A' ' 118' ' ' GLN . 4.7 ttpt -56.67 -48.35 77.8 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 108.301 -0.999 . . . . 0.0 108.301 171.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -59.56 -39.73 85.0 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.919 -176.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -60.72 -44.37 96.69 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.28 175.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.8 mt -68.35 -34.26 64.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-O 120.757 0.313 . . . . 0.0 110.164 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 69.6 ttt-85 -69.66 -35.33 75.08 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.077 0.551 . . . . 0.0 109.908 178.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 62.8 ttp -68.37 -38.8 81.73 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 176.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.6 tt -58.95 -45.75 89.7 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 81.6 mt -66.31 -34.27 77.61 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 177.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.9 t70 . . . . . 0 CA--C 1.536 0.411 0 CA-C-N 118.205 0.457 . . . . 0.0 110.446 178.4 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo . . . . . 0 N--CA 1.458 -0.579 0 N-CA-C 110.494 -0.618 . . . . 0.0 110.494 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 50.1 m -63.74 147.32 51.99 Favored 'General case' 0 C--O 1.231 0.096 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 175.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 162' ' ' TYR . . . . . 0.464 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 17.2 t80 -145.93 131.12 18.42 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 178.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 163' ' ' SER . . . . . 0.404 ' HA ' ' HD3' ' B' ' 164' ' ' PRO . 29.4 t -135.44 135.45 22.37 Favored Pre-proline 0 C--O 1.234 0.265 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.878 176.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 164' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' B' ' 163' ' ' SER . 52.9 Cg_exo -56.58 -17.34 21.89 Favored 'Trans proline' 0 N--CA 1.451 -1.009 0 C-N-CA 123.23 2.62 . . . . 0.0 112.443 175.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 73.3 p . . . . . 0 C--N 1.341 0.227 0 N-CA-C 113.196 0.814 . . . . 0.0 113.196 -174.043 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.437 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 17.3 t70 . . . . . 0 CA--C 1.535 0.367 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.437 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 13.3 t80 -55.62 -14.82 2.36 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.335 0.654 . . . . 0.0 111.036 178.288 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -55.33 -34.56 64.31 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.505 1.122 . . . . 0.0 111.304 176.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 40.8 m-20 -66.38 -44.2 83.79 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 119.2 0.909 . . . . 0.0 109.927 178.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -64.44 -50.23 68.38 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 -178.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 88.1 t -62.53 -57.71 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 -179.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.42 -32.32 64.75 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -177.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 78.9 m -72.43 -44.03 62.99 Favored 'General case' 0 C--N 1.338 0.079 0 O-C-N 121.798 -0.564 . . . . 0.0 110.78 176.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.0 tp -65.62 -31.59 72.71 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -69.73 -43.1 73.01 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 124.001 0.921 . . . . 0.0 109.546 176.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.8 t -60.07 -31.47 70.04 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -36.91 68.63 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.231 0.212 . . . . 0.0 110.592 175.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt . . . . . 0 C--N 1.339 0.134 0 C-N-CA 123.808 0.843 . . . . 0.0 111.18 179.186 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 17.4 mm . . . . . 0 CA--C 1.528 0.12 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.4 m -54.21 123.38 12.62 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-O 121.063 0.459 . . . . 0.0 111.481 -175.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -69.77 -14.98 70.82 Favored Glycine 0 CA--C 1.525 0.675 0 CA-C-O 119.13 -0.817 . . . . 0.0 113.288 -177.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.4 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 43.1 t -64.02 -43.63 95.04 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 118.914 1.357 . . . . 0.0 109.816 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 83.6 mtt85 -65.32 -41.42 94.01 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 53.1 mt -59.01 -41.46 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.103 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 176.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.3 tmtt? -60.79 -44.72 96.45 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.772 0.429 . . . . 0.0 111.256 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.4 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.3 OUTLIER -63.66 -40.99 98.23 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 118.72 0.691 . . . . 0.0 110.925 177.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 92.2 mt -63.66 -53.4 51.93 Favored 'General case' 0 C--O 1.233 0.202 0 O-C-N 122.534 -0.104 . . . . 0.0 110.782 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 48.4 p -60.94 -39.65 90.27 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.1 m -55.5 -57.7 10.8 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 122.876 0.47 . . . . 0.0 110.572 178.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -67.95 -35.09 77.81 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 118.908 -1.117 . . . . 0.0 111.942 -175.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.95 -58.3 9.27 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.422 0.556 . . . . 0.0 110.336 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 53.0 mt -72.21 -15.74 61.94 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.847 0.859 . . . . 0.0 112.913 -174.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -61.94 -24.69 67.14 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -150.85 -26.69 0.22 Allowed 'General case' 0 C--N 1.338 0.102 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -175.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 34.9 mm 44.97 73.59 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-O 121.768 0.794 . . . . 0.0 111.283 -178.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -137.53 9.26 2.89 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.114 0.966 . . . . 0.0 110.137 178.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.537 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.5 pt -143.64 119.62 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 C-N-CA 125.205 1.402 . . . . 0.0 107.837 -178.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.409 ' HG2' ' N ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -114.92 -66.89 1.04 Allowed 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -179.192 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.409 ' N ' ' HG2' ' A' ' 43' ' ' GLU . 79.4 p -67.84 -23.19 65.13 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 122.851 0.46 . . . . 0.0 111.774 -173.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.621 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -75.46 -52.63 10.25 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.263 1.025 . . . . 0.0 109.399 179.475 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.433 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 7.4 mt -59.72 -44.33 93.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 C-N-CA 123.02 0.528 . . . . 0.0 110.352 176.207 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.426 HD12 HD11 ' A' ' 101' ' ' LEU . 12.3 mm -71.33 -47.63 58.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 O-C-N 122.258 -0.276 . . . . 0.0 111.681 -177.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.3 t -57.68 -35.02 70.03 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 176.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.4 tp -68.26 -45.67 72.51 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 118.442 -0.789 . . . . 0.0 112.184 -179.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 26.3 pt -73.01 -35.77 49.39 Favored 'Isoleucine or valine' 0 C--N 1.342 0.258 0 CA-C-N 120.03 1.286 . . . . 0.0 112.149 -179.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 95.8 mt -66.15 -50.73 66.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-O 121.431 0.634 . . . . 0.0 109.336 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -60.77 -40.38 92.3 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.317 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -55.67 -43.08 76.0 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 175.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.4 ' HB2' ' HB2' ' A' ' 65' ' ' SER . 11.1 p -62.49 -51.5 67.2 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 119.442 -0.314 . . . . 0.0 110.96 -177.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.42 -20.45 66.37 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 118.585 0.63 . . . . 0.0 112.314 -177.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 69.8 mt -79.27 -14.74 58.84 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 173.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 59.6 m -95.17 163.49 21.67 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -173.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -74.04 -137.81 0.02 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.62 1 C-N-CA 125.606 4.204 . . . . 0.0 109.25 170.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -55.54 -26.89 45.75 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 119.361 0.982 . . . . 0.0 111.966 178.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 25.5 m -58.51 -21.27 51.48 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.962 0.505 . . . . 0.0 110.564 175.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -55.21 -72.36 0.07 Allowed 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 174.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -59.11 -60.37 3.97 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -175.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 35.1 tp -73.58 -47.47 40.26 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 119.619 -0.832 . . . . 0.0 112.203 -170.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.55 -41.78 93.91 Favored Glycine 0 C--N 1.335 0.479 0 N-CA-C 110.586 -1.005 . . . . 0.0 110.586 -175.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.4 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 11.4 t -68.2 -44.03 76.75 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 117.76 0.78 . . . . 0.0 110.4 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 66' ' ' LEU . 49.6 mt -55.48 -42.04 73.83 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 119.704 -0.799 . . . . 0.0 111.178 178.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -71.12 -40.93 71.13 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.327 0.967 . . . . 0.0 112.372 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 89.1 mt -65.56 -45.9 91.19 Favored 'Isoleucine or valine' 0 C--N 1.341 0.228 0 CA-C-N 118.868 0.758 . . . . 0.0 109.847 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.0 mt -59.64 -36.63 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 C-N-CA 123.368 0.667 . . . . 0.0 109.432 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -66.44 -46.52 76.2 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 119.144 -0.455 . . . . 0.0 111.019 -179.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.6 m -67.63 -51.23 52.61 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 118.955 0.798 . . . . 0.0 111.443 -178.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 39.4 mt -66.94 -39.1 82.73 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 C-N-CA 120.56 -0.456 . . . . 0.0 109.999 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.48 -39.73 86.92 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 111.926 -0.47 . . . . 0.0 111.926 -179.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 42.9 ttm-85 -67.75 -42.25 82.1 Favored 'General case' 0 CA--C 1.523 -0.08 0 CA-C-N 117.52 0.66 . . . . 0.0 110.016 178.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.86 -41.47 82.84 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.324 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -63.7 -45.54 89.55 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 175.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 55.8 tp -59.38 -43.64 92.87 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 123.205 0.316 . . . . 0.0 110.184 -177.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -64.26 -46.63 82.89 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 120.776 0.322 . . . . 0.0 110.25 176.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -58.4 -41.84 85.83 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.543 -176.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 15.0 t -87.34 -20.48 26.7 Favored 'General case' 0 CA--C 1.528 0.101 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 51.2 tpt85 . . . . . 0 C--O 1.232 0.155 0 CA-C-N 118.503 0.592 . . . . 0.0 110.131 175.634 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.531 0.22 0 N-CA-C 114.36 1.244 . . . . 0.0 114.36 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.5 p -50.65 -31.73 17.03 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.585 1.154 . . . . 0.0 114.114 -173.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.52 -45.36 90.97 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 118.752 0.706 . . . . 0.0 110.006 177.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -68.18 -32.32 72.48 Favored 'General case' 0 CA--C 1.52 -0.204 0 C-N-CA 122.904 0.482 . . . . 0.0 110.215 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.79 -43.99 91.42 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.395 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.71 -42.08 91.81 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 175.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -59.15 -35.0 72.74 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 122.493 -0.129 . . . . 0.0 110.961 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 62.2 m -76.81 -43.05 38.11 Favored 'General case' 0 CA--C 1.524 -0.049 0 CA-C-O 119.689 -0.196 . . . . 0.0 111.413 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.426 HD11 HD12 ' A' ' 47' ' ' ILE . 51.1 mt -60.96 -27.78 68.51 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.553 -0.717 . . . . 0.0 109.137 174.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.1 -15.35 36.2 Favored Glycine 0 CA--C 1.528 0.889 0 CA-C-O 119.228 -0.762 . . . . 0.0 113.458 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -97.82 -5.33 34.97 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.664 1.232 . . . . 0.0 111.652 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.9 m -123.45 -26.81 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.338 0.102 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.429 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.5 tp -55.78 -27.46 22.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 CA-C-N 118.123 0.42 . . . . 0.0 111.588 -178.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -60.84 -47.5 86.05 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.262 0.625 . . . . 0.0 110.606 178.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -75.19 -38.71 60.7 Favored 'General case' 0 CA--C 1.522 -0.116 0 C-N-CA 123.022 0.529 . . . . 0.0 110.502 -179.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 89.0 mt -59.41 -49.67 76.9 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.409 -178.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.423 ' O ' HG13 ' A' ' 113' ' ' ILE . 58.6 mt -67.73 -51.87 44.17 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-O 118.458 -0.782 . . . . 0.0 110.462 177.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 91.2 p -53.52 -49.05 68.4 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 119.227 -0.989 . . . . 0.0 111.313 -176.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -69.65 -35.11 74.88 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 121.882 -0.511 . . . . 0.0 111.467 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.87 -48.26 81.3 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 118.225 0.466 . . . . 0.0 111.17 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -74.88 -33.21 29.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.743 -177.994 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.03 -27.56 65.77 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 119.522 -0.871 . . . . 0.0 110.646 178.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 4.5 ttpt -80.69 -23.81 39.3 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.205 1.002 . . . . 0.0 110.583 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.9 m -78.04 158.72 29.11 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -170.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -100.12 -179.87 4.27 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 170.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -36.59 68.08 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.547 1.067 . . . . 0.0 112.858 -175.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -69.66 -42.78 73.74 Favored 'General case' 0 N--CA 1.456 -0.166 0 O-C-N 121.618 -0.676 . . . . 0.0 110.698 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 60.6 m80 -73.57 -37.67 65.45 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 119.573 -0.251 . . . . 0.0 111.136 -177.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.421 ' HD2' ' C ' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -64.92 -37.2 86.84 Favored 'General case' 0 C--N 1.34 0.184 0 N-CA-C 108.469 -0.938 . . . . 0.0 108.469 176.321 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -62.3 -43.62 98.4 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 178.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -62.35 -38.92 91.38 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 122.119 -0.363 . . . . 0.0 111.424 176.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.6 -43.32 80.46 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 118.526 0.603 . . . . 0.0 111.13 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -70.68 -26.18 63.32 Favored 'General case' 0 C--O 1.225 -0.236 0 O-C-N 121.329 -0.857 . . . . 0.0 110.645 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.1 ttt -68.58 -41.04 80.23 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 174.108 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 33.2 tp -57.19 -49.3 76.42 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.121 0.568 . . . . 0.0 109.609 176.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 85.7 mt -72.92 -31.89 64.94 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -178.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 32.2 t70 . . . . . 0 N--CA 1.452 -0.327 0 CA-C-N 118.274 0.488 . . . . 0.0 109.813 177.743 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo . . . . . 0 N--CA 1.456 -0.734 0 N-CA-C 110.646 -0.559 . . . . 0.0 110.646 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 32.5 t -81.89 164.0 21.86 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 122.521 0.328 . . . . 0.0 110.519 176.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -131.5 127.18 36.76 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.841 0.456 . . . . 0.0 110.713 177.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 163' ' ' SER . . . . . 0.409 ' HA ' ' HD3' ' B' ' 164' ' ' PRO . 21.8 t -104.07 131.14 22.22 Favored Pre-proline 0 N--CA 1.453 -0.295 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 174.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 164' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' B' ' 163' ' ' SER . 50.9 Cg_exo -57.48 -10.45 6.8 Favored 'Trans proline' 0 N--CA 1.448 -1.183 0 C-N-CA 122.854 2.369 . . . . 0.0 112.943 176.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 52.4 p . . . . . 0 C--N 1.34 0.154 0 CA-C-N 118.865 0.757 . . . . 0.0 112.21 -177.302 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 . . . . . 0 CA--C 1.532 0.28 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -54.79 -14.35 1.37 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.525 0.73 . . . . 0.0 111.053 177.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -53.63 -34.6 59.12 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.367 0.667 . . . . 0.0 110.506 175.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 34.4 m-20 -64.47 -48.5 75.01 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 118.962 0.801 . . . . 0.0 110.16 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -63.1 -49.06 75.93 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 110.466 -0.198 . . . . 0.0 110.466 -177.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 86.2 t -63.45 -57.75 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.22 -29.54 67.58 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 119.395 -0.336 . . . . 0.0 111.802 -177.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 61.9 m -71.53 -46.04 60.69 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.35 0.523 . . . . 0.0 110.48 176.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.438 HD11 ' CD2' ' A' ' 53' ' ' TYR . 19.5 tp -65.89 -33.84 76.76 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.077 0.465 . . . . 0.0 110.167 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -68.42 -43.27 77.53 Favored 'General case' 0 CA--C 1.522 -0.108 0 C-N-CA 123.93 0.892 . . . . 0.0 109.648 178.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.6 t -62.88 -31.75 72.86 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 174.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.83 -32.86 70.04 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 177.214 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt . . . . . 0 C--O 1.23 0.06 0 C-N-CA 123.019 0.528 . . . . 0.0 111.655 176.675 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 21.3 mm . . . . . 0 CA--C 1.53 0.206 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.7 t -64.24 124.52 21.92 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 120.882 0.372 . . . . 0.0 110.139 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.408 ' C ' ' HD2' ' B' ' 160' ' ' PRO . . . -68.79 -25.79 74.96 Favored Glycine 0 CA--C 1.524 0.604 0 CA-C-O 119.603 -0.554 . . . . 0.0 112.534 -176.132 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 83.1 p -64.22 -33.96 77.0 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 118.549 1.174 . . . . 0.0 111.079 -175.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -69.98 -39.19 76.09 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 54.7 mt -63.98 -38.08 81.47 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.07 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 176.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -60.8 -45.24 95.17 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 118.92 -0.562 . . . . 0.0 110.654 176.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.95 -40.34 97.38 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 119.256 0.934 . . . . 0.0 111.396 178.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 99.4 mt -64.52 -58.56 6.05 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 119.709 -0.186 . . . . 0.0 111.044 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.556 HG21 ' HB2' ' A' ' 71' ' ' SER . 44.2 p -54.18 -41.36 68.47 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-N 118.0 0.363 . . . . 0.0 111.693 175.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.0 m -55.53 -60.18 3.79 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 119.227 -0.416 . . . . 0.0 111.104 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -67.15 -32.69 73.98 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 119.134 -1.026 . . . . 0.0 111.711 -174.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.38 -58.14 9.91 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 122.029 -0.42 . . . . 0.0 110.109 174.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.0 mt -70.45 -17.02 62.99 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.637 0.775 . . . . 0.0 112.47 -175.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -66.9 -21.76 65.98 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -178.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.4 t60 -148.17 -30.03 0.3 Allowed 'General case' 0 C--N 1.34 0.169 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -175.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.514 HG22 HG22 ' A' ' 93' ' ' THR . 33.4 mm 43.86 73.95 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 121.583 0.706 . . . . 0.0 111.436 -178.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -149.49 21.12 0.93 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.705 0.802 . . . . 0.0 109.754 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.595 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.24 36.85 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 C-N-CA 124.539 1.135 . . . . 0.0 109.183 -172.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.49 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -50.95 -56.12 13.92 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -175.899 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 79.2 p -75.29 -25.78 58.22 Favored 'General case' 0 CA--C 1.522 -0.129 0 N-CA-C 112.33 0.492 . . . . 0.0 112.33 -173.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.676 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -83.07 -42.3 17.6 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -179.3 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 21.0 mt -57.61 -52.77 53.21 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.123 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 171.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 13.3 mm -65.81 -47.05 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 CA-C-O 119.494 -0.288 . . . . 0.0 111.514 -176.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.6 t -56.21 -40.1 73.52 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 120.034 -0.667 . . . . 0.0 109.859 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.7 tp -68.3 -41.72 80.53 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 118.834 -0.603 . . . . 0.0 112.543 -176.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.7 pt -74.67 -36.4 40.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 CA-C-N 119.688 1.131 . . . . 0.0 111.946 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.454 HD13 HG21 ' A' ' 104' ' ' VAL . 96.0 mt -63.97 -48.59 85.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 177.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -59.47 -43.72 93.17 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.778 177.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.438 ' CD2' HD11 ' A' ' 14' ' ' LEU . 31.6 t80 -55.73 -40.1 72.02 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 177.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.7 t -65.34 -55.41 18.36 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -69.15 -21.17 64.02 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -173.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 50.2 mt -81.55 -14.8 56.41 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 179.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 78.8 m -125.04 163.73 35.9 Favored Pre-proline 0 CA--C 1.539 0.546 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 -169.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -59.11 174.26 1.0 Allowed 'Trans proline' 0 C--N 1.348 0.549 1 C-N-CA 126.041 4.494 . . . . 0.0 114.645 -179.231 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.567 ' HB3' ' HE2' ' A' ' 115' ' ' LYS . 4.6 p-10 -59.42 -30.18 68.29 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -174.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 25.3 t -63.53 -36.88 85.25 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -78.49 -28.13 46.3 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.034 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -63.05 -45.31 92.83 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-N 119.013 0.824 . . . . 0.0 109.104 173.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.7 tp -63.32 -48.27 78.73 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.76 -41.86 96.14 Favored Glycine 0 C--N 1.336 0.579 0 N-CA-C 111.111 -0.796 . . . . 0.0 111.111 178.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.2 m -63.63 -43.97 95.26 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 117.043 0.422 . . . . 0.0 110.443 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 81.6 mt -62.34 -37.02 84.04 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 118.086 0.403 . . . . 0.0 110.749 179.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -70.81 -33.28 70.54 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.64 0.654 . . . . 0.0 111.344 177.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 69.9 mt -71.3 -41.38 74.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 176.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 66.8 mt -65.25 -33.72 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 123.516 0.726 . . . . 0.0 109.412 177.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -75.18 -42.48 55.74 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 119.606 -0.235 . . . . 0.0 111.361 -178.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.556 ' HB2' HG21 ' A' ' 33' ' ' THR . 10.9 p -68.42 -49.77 57.53 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-N 118.592 0.633 . . . . 0.0 110.731 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 54.8 mt -67.4 -42.67 87.6 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.096 0 CA-C-N 117.725 0.239 . . . . 0.0 110.466 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.22 -39.66 94.54 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 -178.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.0 ttm-85 -70.1 -40.02 75.19 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.181 0.592 . . . . 0.0 110.314 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.92 -40.38 83.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 178.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -62.36 -49.43 75.59 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 175.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.6 tp -57.61 -48.39 79.54 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.017 0.527 . . . . 0.0 110.25 -176.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -64.51 -43.86 92.74 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.808 -0.178 . . . . 0.0 110.811 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -67.9 -39.25 83.65 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 121.127 -0.229 . . . . 0.0 111.506 -175.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.1 t -80.17 -24.28 40.45 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.872 -178.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 . . . . . 0 C--N 1.341 0.212 0 CA-C-N 118.438 0.563 . . . . 0.0 111.621 172.456 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.514 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.316 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.2 p -53.0 -30.17 33.65 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.034 0.934 . . . . 0.0 113.434 -175.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.74 -46.32 90.13 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 118.97 0.804 . . . . 0.0 109.859 175.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -73.78 -23.04 59.65 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.897 178.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.75 -45.89 84.5 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 175.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.6 mt -64.45 -43.0 96.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 176.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -60.18 -34.12 73.15 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 121.309 -0.156 . . . . 0.0 111.33 178.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.6 m -74.92 -41.29 59.96 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-O 119.517 -0.278 . . . . 0.0 111.342 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.2 mt -61.39 -30.5 70.59 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 174.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.68 -14.92 31.38 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 119.277 -0.735 . . . . 0.0 113.637 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.78 -6.92 24.23 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.701 1.25 . . . . 0.0 111.959 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.454 HG21 HD13 ' A' ' 51' ' ' ILE . 27.3 m -121.18 -20.29 4.36 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -178.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.416 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.5 tp -51.42 -27.66 7.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 C-N-CA 123.027 0.531 . . . . 0.0 112.099 -177.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -64.1 -56.22 16.42 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 122.765 0.426 . . . . 0.0 110.81 177.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -66.31 -40.32 89.9 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 73.5 mt -58.59 -55.68 31.94 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 119.05 -0.5 . . . . 0.0 110.946 -177.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.3 mt -69.45 -51.8 32.78 Favored 'General case' 0 N--CA 1.457 -0.08 0 CA-C-N 118.581 0.628 . . . . 0.0 111.565 -177.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 80.4 p -55.06 -49.82 70.66 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 120.116 -0.634 . . . . 0.0 111.706 -178.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -69.69 -45.76 67.58 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 118.897 0.772 . . . . 0.0 111.513 -178.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -51.91 -55.88 17.51 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 118.11 0.414 . . . . 0.0 110.955 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 25.7 mt -69.19 -37.28 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 O-C-N 122.955 0.159 . . . . 0.0 110.821 -178.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.61 -21.46 61.84 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.143 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.567 ' HE2' ' HB3' ' A' ' 59' ' ' ASP . 0.1 OUTLIER -98.39 -15.17 19.79 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.649 0.38 . . . . 0.0 111.929 -175.736 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 87.8 p -84.34 167.99 16.03 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -174.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . 0.522 HD21 ' CD2' ' A' ' 120' ' ' HIS . 11.6 p30 -86.72 174.42 8.85 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 49.9 mm-40 -55.89 -40.31 72.81 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.558 0.617 . . . . 0.0 112.04 -175.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -71.42 -42.6 68.08 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.514 0.597 . . . . 0.0 111.001 -179.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.522 ' CD2' HD21 ' A' ' 117' ' ' ASN . 11.4 m-70 -71.17 -42.42 69.1 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.149 -0.345 . . . . 0.0 110.543 -178.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.4 ttpt -51.36 -49.88 60.6 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 169.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -61.12 -37.82 84.14 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 120.93 -0.308 . . . . 0.0 111.33 -175.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -63.03 -43.33 98.99 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 122.365 -0.209 . . . . 0.0 111.483 175.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 69.4 mt -69.59 -34.24 60.58 Favored 'Isoleucine or valine' 0 C--N 1.338 0.096 0 C-N-CA 119.869 -0.733 . . . . 0.0 109.05 178.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -35.75 81.95 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 177.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 19.9 ttt -66.27 -43.72 85.6 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 123.132 0.573 . . . . 0.0 110.316 175.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.41 -41.29 84.62 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 176.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 75.9 mt -70.43 -31.23 68.33 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 178.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.2 t70 . . . . . 0 N--CA 1.455 -0.178 0 CA-C-N 117.941 0.337 . . . . 0.0 110.135 178.394 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 160' ' ' PRO . . . . . 0.408 ' HD2' ' C ' ' A' ' 26' ' ' GLY . 44.5 Cg_endo . . . . . 0 N--CA 1.455 -0.764 0 N-CA-C 110.854 -0.479 . . . . 0.0 110.854 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 18.8 t 62.82 171.56 0.14 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.901 1.28 . . . . 0.0 112.108 -171.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -144.52 148.53 34.58 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.753 0.821 . . . . 0.0 110.306 -178.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 16.1 t -124.44 130.51 24.29 Favored Pre-proline 0 N--CA 1.45 -0.43 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.72 -10.8 4.19 Favored 'Trans proline' 0 N--CA 1.452 -0.952 0 C-N-CA 123.292 2.661 . . . . 0.0 113.054 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 67.2 p . . . . . 0 CA--C 1.53 0.201 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -177.333 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 . . . . . 0 CA--C 1.534 0.34 0 CA-C-O 120.77 0.319 . . . . 0.0 110.282 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -54.28 -15.06 1.37 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.928 0.891 . . . . 0.0 111.957 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.4 tp60 -55.64 -41.8 74.1 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.191 0.596 . . . . 0.0 111.13 177.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -65.47 -38.75 90.72 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 118.637 0.653 . . . . 0.0 110.521 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -64.44 -55.13 22.96 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 120.726 0.298 . . . . 0.0 110.235 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 96.6 t -59.16 -54.65 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.52 -32.1 68.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.938 0.495 . . . . 0.0 112.08 -177.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 58.9 m -72.56 -44.44 62.08 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 118.45 0.568 . . . . 0.0 110.707 177.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.9 tp -67.72 -33.38 74.76 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.424 0.631 . . . . 0.0 109.854 -179.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -65.15 -45.45 84.9 Favored 'General case' 0 CA--C 1.521 -0.159 0 C-N-CA 123.842 0.857 . . . . 0.0 109.216 176.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.3 t -61.6 -32.13 72.23 Favored 'General case' 0 N--CA 1.457 -0.079 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 175.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -61.58 -49.92 74.7 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 176.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt . . . . . 0 C--N 1.339 0.129 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 179.731 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.5 mm . . . . . 0 CA--C 1.532 0.278 0 CA-C-O 120.688 0.28 . . . . 0.0 110.71 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.6 m -54.95 128.51 33.78 Favored 'General case' 0 C--N 1.339 0.134 0 O-C-N 121.959 -0.463 . . . . 0.0 110.241 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.81 -15.27 62.03 Favored Glycine 0 C--N 1.337 0.584 0 CA-C-O 119.166 -0.796 . . . . 0.0 113.761 -174.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.1 p -62.38 -40.08 95.27 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 119.155 1.478 . . . . 0.0 110.823 -177.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -68.16 -42.72 79.64 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 56.1 mt -63.77 -36.04 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.3 mmtt -66.5 -42.21 87.73 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 118.743 -0.646 . . . . 0.0 110.864 179.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.13 -41.77 94.51 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.213 0.915 . . . . 0.0 111.039 175.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.2 mt -61.81 -57.28 12.47 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 122.563 -0.086 . . . . 0.0 110.929 -179.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.563 HG21 ' HB2' ' A' ' 71' ' ' SER . 41.3 p -55.67 -43.97 76.85 Favored 'General case' 0 CA--C 1.523 -0.071 0 O-C-N 122.152 -0.343 . . . . 0.0 111.641 177.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 m -55.38 -58.8 6.23 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 122.396 0.278 . . . . 0.0 110.799 -178.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -78.59 -14.62 59.24 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -172.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.42 -58.51 3.65 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 166.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.4 mt -65.62 -20.69 66.41 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.901 0.88 . . . . 0.0 112.284 -176.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -72.59 -14.89 61.72 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -133.71 -46.11 0.81 Allowed 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 119.011 0.823 . . . . 0.0 112.964 -176.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.512 HG22 HG22 ' A' ' 93' ' ' THR . 39.8 mm 40.27 66.32 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 122.304 1.05 . . . . 0.0 111.529 -174.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -150.34 21.62 0.84 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.663 1.185 . . . . 0.0 108.655 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.577 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -148.8 35.52 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 C-N-CA 125.069 1.347 . . . . 0.0 109.063 -170.562 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.442 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -51.45 -52.81 43.17 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -175.044 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 83.5 p -76.57 -24.06 53.54 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -173.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.645 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -86.2 -41.76 14.39 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -179.584 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 48.8 mt -56.27 -52.77 47.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 118.259 0.481 . . . . 0.0 109.817 170.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 14.8 mm -67.09 -48.12 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.139 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.582 -177.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 48.4 t -55.76 -37.64 68.8 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 120.001 -0.68 . . . . 0.0 109.722 178.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.4 tp -69.31 -43.12 74.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.551 -0.738 . . . . 0.0 112.613 -177.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 31.3 pt -72.41 -35.53 52.05 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 120.047 1.294 . . . . 0.0 111.781 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.505 HD13 HG21 ' A' ' 104' ' ' VAL . 94.9 mt -64.24 -49.66 80.13 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-O 121.593 0.711 . . . . 0.0 109.257 178.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -57.92 -41.97 83.83 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.474 177.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -56.45 -41.07 75.88 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 176.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.4 t -66.22 -48.42 70.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 112.135 0.421 . . . . 0.0 112.135 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -73.21 -23.97 60.45 Favored 'General case' 0 C--O 1.231 0.081 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -175.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 51.4 mt -80.49 -15.1 57.55 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 178.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.408 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 73.4 m -119.87 157.36 52.74 Favored Pre-proline 0 CA--C 1.536 0.434 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -171.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 90.5 Cg_endo -72.62 -170.79 0.64 Allowed 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 125.045 3.83 . . . . 0.0 113.642 -176.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -50.67 -44.98 57.83 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.42 1.888 . . . . 0.0 114.462 -170.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.0 p -60.12 -31.4 70.03 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.403 ' CG ' ' HB3' ' A' ' 57' ' ' CYS . 65.1 m-70 -86.32 -14.7 42.84 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 118.921 -0.561 . . . . 0.0 111.136 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.411 ' HB2' ' HE2' ' A' ' 115' ' ' LYS . 75.1 mmtt -69.85 -43.47 71.87 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 171.187 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 57.2 tp -66.44 -49.12 67.76 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.3 -38.32 93.15 Favored Glycine 0 C--N 1.336 0.552 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 178.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.1 t -60.94 -51.07 70.82 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 177.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 49.5 mt -58.59 -34.58 71.27 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.736 -0.65 . . . . 0.0 111.605 179.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -72.41 -33.53 67.21 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.389 0.995 . . . . 0.0 111.783 177.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 75.9 mt -75.69 -40.42 40.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 118.607 0.639 . . . . 0.0 110.378 178.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 84.6 mt -63.63 -36.68 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 174.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -67.8 -43.68 79.1 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.998 -0.525 . . . . 0.0 111.057 178.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.563 ' HB2' HG21 ' A' ' 33' ' ' THR . 89.3 p -67.17 -57.13 7.33 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 118.627 0.649 . . . . 0.0 111.289 -177.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 54.1 mt -64.88 -30.5 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 178.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.09 -54.67 19.81 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-O 119.851 -0.416 . . . . 0.0 112.541 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.64 HH11 ' HG3' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -66.49 -34.13 77.24 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 118.162 0.981 . . . . 0.0 110.754 -179.678 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.79 -45.96 76.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 110.318 -0.253 . . . . 0.0 110.318 177.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -63.71 -46.76 83.96 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 177.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 60.5 tp -55.93 -45.38 78.78 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 122.802 0.441 . . . . 0.0 110.507 -177.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -67.41 -46.94 71.7 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 120.775 -0.37 . . . . 0.0 110.811 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -64.68 -24.95 67.74 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -175.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.3 t -99.09 -27.77 13.68 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 118.798 0.726 . . . . 0.0 112.237 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 . . . . . 0 CA--C 1.531 0.231 0 O-C-N 121.948 -0.47 . . . . 0.0 111.882 -179.587 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.512 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.312 0 N-CA-C 114.093 1.145 . . . . 0.0 114.093 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.6 p -53.58 -28.46 32.14 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.153 0.981 . . . . 0.0 113.549 -174.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.74 -46.16 86.61 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 118.921 0.782 . . . . 0.0 109.952 176.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 3.2 m80 -73.96 -22.32 59.68 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.462 178.212 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.79 -46.57 78.18 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 175.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 94.9 mt -63.05 -41.69 93.8 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 175.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -63.51 -33.87 76.53 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 179.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.6 m -73.12 -39.7 65.55 Favored 'General case' 0 C--O 1.227 -0.126 0 O-C-N 122.342 -0.224 . . . . 0.0 110.654 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.1 mt -62.34 -31.58 72.24 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 173.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.46 -15.4 24.36 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-O 119.0 -0.889 . . . . 0.0 113.463 179.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -100.29 -4.74 28.68 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 119.263 1.531 . . . . 0.0 111.856 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.505 HG21 HD13 ' A' ' 51' ' ' ILE . 28.7 m -124.52 -20.55 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 122.823 0.449 . . . . 0.0 112.024 -179.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.416 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.8 tp -54.4 -23.4 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 C-N-CA 123.358 0.663 . . . . 0.0 112.222 -176.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -59.4 -54.01 51.56 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.623 0.369 . . . . 0.0 111.602 178.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -78.34 -29.16 47.42 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 121.124 -0.23 . . . . 0.0 110.795 -177.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.2 mt -63.16 -52.16 63.54 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 64.3 mt -64.79 -59.81 3.8 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 118.478 -0.773 . . . . 0.0 110.369 176.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 90.7 p -52.77 -42.32 64.89 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 118.97 -1.092 . . . . 0.0 111.857 -172.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -69.44 -47.49 63.88 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 119.16 0.891 . . . . 0.0 111.175 178.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.84 -34.58 65.53 Favored 'General case' 0 N--CA 1.458 -0.068 0 C-N-CA 123.503 0.721 . . . . 0.0 112.323 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -81.92 -39.75 16.92 Favored 'Isoleucine or valine' 0 C--N 1.337 0.041 0 CA-C-N 119.471 1.032 . . . . 0.0 112.048 175.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.64 -25.95 64.17 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.344 -178.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.411 ' HE2' ' HB2' ' A' ' 62' ' ' LYS . 0.1 OUTLIER -81.94 -17.39 47.22 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.256 0.623 . . . . 0.0 110.731 178.406 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 13.3 m -80.88 160.85 24.62 Favored 'General case' 0 N--CA 1.457 -0.079 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -174.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -96.27 -179.2 4.57 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 170.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -55.47 -43.5 75.56 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.931 0.787 . . . . 0.0 111.828 -177.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -68.6 -41.39 79.66 Favored 'General case' 0 N--CA 1.453 -0.285 0 O-C-N 121.555 -0.715 . . . . 0.0 111.05 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -72.15 -38.27 69.24 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 122.158 -0.339 . . . . 0.0 111.176 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.73 -34.94 78.95 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -63.14 -42.51 99.48 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 178.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -61.59 -42.71 99.26 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 110.556 -0.165 . . . . 0.0 110.556 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.0 mt -65.89 -37.74 80.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 39.4 ttt180 -63.35 -33.26 75.13 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 176.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 62.4 ttp -67.79 -41.45 83.19 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 176.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 88.3 mt -58.76 -45.7 89.14 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.197 176.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.3 mt -67.33 -35.25 79.03 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 111.571 0.212 . . . . 0.0 111.571 -179.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.5 t70 . . . . . 0 CA--C 1.529 0.156 0 CA-C-N 117.999 0.363 . . . . 0.0 110.176 178.321 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo . . . . . 0 N--CA 1.456 -0.72 0 N-CA-C 110.37 -0.666 . . . . 0.0 110.37 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 36.6 m -76.6 163.71 26.61 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 120.819 0.343 . . . . 0.0 110.898 176.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 162' ' ' TYR . . . . . 0.464 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 7.9 t80 -143.22 138.22 29.51 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.116 0.566 . . . . 0.0 110.307 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 35.9 t -124.88 142.31 40.63 Favored Pre-proline 0 N--CA 1.454 -0.267 0 C-N-CA 122.976 0.51 . . . . 0.0 111.46 177.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -66.87 -5.93 14.54 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 123.388 2.725 . . . . 0.0 111.523 175.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 66.9 p . . . . . 0 N--CA 1.456 -0.172 0 C-N-CA 122.826 0.45 . . . . 0.0 111.642 179.583 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.421 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 12.9 t70 . . . . . 0 CA--C 1.536 0.436 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.421 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 13.5 t80 -55.58 -14.29 2.03 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.498 0.719 . . . . 0.0 111.142 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -51.4 -43.94 62.08 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.173 0.989 . . . . 0.0 110.609 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 44.7 m-20 -62.05 -44.2 97.2 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 118.042 0.383 . . . . 0.0 110.806 -179.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -64.88 -51.27 62.87 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 117.795 0.271 . . . . 0.0 110.566 -177.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.7 t -62.54 -55.09 26.08 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.05 -31.5 65.25 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.15 0.58 . . . . 0.0 111.802 -178.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 54.4 m -73.49 -43.0 61.14 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 118.387 0.54 . . . . 0.0 110.68 177.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.442 HD11 ' CD2' ' A' ' 53' ' ' TYR . 15.6 tp -66.72 -30.46 70.7 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -70.63 -43.83 68.44 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.167 0.987 . . . . 0.0 109.652 175.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -62.93 -26.77 68.97 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 175.302 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.49 -41.75 62.71 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 174.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.6 tttt . . . . . 0 CA--C 1.529 0.162 0 C-N-CA 123.087 0.555 . . . . 0.0 111.222 178.613 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.1 mm . . . . . 0 CA--C 1.531 0.224 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.3 m -49.89 127.25 15.9 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.401 0.68 . . . . 0.0 112.103 -174.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.56 -15.08 63.47 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-O 119.012 -0.882 . . . . 0.0 113.705 -176.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.41 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 46.5 t -62.46 -42.86 99.77 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 118.966 1.383 . . . . 0.0 110.301 -178.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -66.99 -40.87 87.48 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 46.0 mt -60.98 -37.58 77.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 176.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -60.74 -49.23 78.34 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.042 0.537 . . . . 0.0 110.783 177.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.41 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.5 OUTLIER -61.25 -43.51 98.76 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 118.366 0.53 . . . . 0.0 110.971 179.036 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.67 -61.92 2.09 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 122.356 -0.215 . . . . 0.0 110.635 -179.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 64.1 p -55.94 -46.02 78.65 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.3 t -63.32 -44.06 96.01 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.742 -176.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -68.19 -36.22 79.24 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 118.816 -1.153 . . . . 0.0 111.209 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.42 -56.29 24.08 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 174.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.9 mt -70.32 -17.89 63.08 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.477 0.711 . . . . 0.0 112.586 -175.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -63.76 -24.46 67.77 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -150.24 -26.15 0.24 Allowed 'General case' 0 C--N 1.342 0.253 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -176.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.525 HG22 HG22 ' A' ' 93' ' ' THR . 32.6 mm 45.42 74.68 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 123.307 0.643 . . . . 0.0 111.484 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -148.49 21.63 1.04 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.661 0.784 . . . . 0.0 109.964 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.574 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.13 36.69 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.134 0 C-N-CA 124.439 1.095 . . . . 0.0 109.566 -171.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.457 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -51.11 -55.27 18.58 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 -175.701 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 80.7 p -75.76 -25.76 56.79 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -173.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.664 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -83.03 -44.23 15.44 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.342 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 22.2 mt -56.23 -53.82 35.08 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 CA-C-N 118.178 0.445 . . . . 0.0 109.973 172.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.9 mm -65.33 -48.32 83.72 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.161 0 CA-C-O 119.209 -0.424 . . . . 0.0 111.523 -175.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 44.4 t -56.22 -40.43 74.05 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.167 178.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.2 tp -68.45 -41.46 80.21 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.4 pt -74.52 -35.0 37.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 CA-C-N 119.325 0.966 . . . . 0.0 111.906 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.435 HD13 HG21 ' A' ' 104' ' ' VAL . 97.4 mt -63.77 -50.68 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 177.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -58.14 -43.52 87.35 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.761 178.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.442 ' CD2' HD11 ' A' ' 14' ' ' LEU . 24.0 t80 -56.23 -41.65 76.05 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 176.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.7 t -64.69 -53.84 41.07 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -70.9 -23.7 62.34 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -173.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 51.2 mt -82.92 -15.95 49.34 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 76.3 m -118.55 159.15 45.07 Favored Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 -169.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 57' ' ' CYS . 49.9 Cg_exo -59.16 -171.5 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 1 C-N-CA 126.544 4.83 . . . . 0.0 116.582 -179.375 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -47.37 -58.79 3.75 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 126.719 2.008 . . . . 0.0 114.725 -175.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.2 p -58.81 -22.78 59.33 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.391 0.139 . . . . 0.0 110.668 -177.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 42.0 m-70 -88.84 -27.58 20.97 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 118.72 -0.657 . . . . 0.0 110.985 -178.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -66.52 -46.53 75.86 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 119.568 1.077 . . . . 0.0 108.215 172.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.0 tp -65.67 -48.89 70.55 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.853 0.359 . . . . 0.0 110.126 178.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.01 -40.19 95.2 Favored Glycine 0 C--N 1.336 0.553 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.4 m -65.68 -43.38 89.45 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 117.676 0.738 . . . . 0.0 110.564 178.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 72.1 mt -59.62 -35.46 74.4 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.866 0.757 . . . . 0.0 110.877 177.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -73.73 -35.34 65.06 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.516 0.598 . . . . 0.0 111.345 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 73.7 mt -70.09 -48.01 64.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 O-C-N 121.528 -0.732 . . . . 0.0 109.831 177.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 77.8 mt -59.1 -38.39 73.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 C-N-CA 124.283 1.033 . . . . 0.0 109.18 178.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -66.52 -46.81 74.94 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 118.676 -0.678 . . . . 0.0 111.084 177.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.0 t -62.37 -52.72 62.5 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 118.988 0.813 . . . . 0.0 110.887 -175.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 43.4 mt -63.8 -34.76 70.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.09 -51.24 46.38 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-O 119.739 -0.478 . . . . 0.0 112.665 -178.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.671 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -71.4 -32.34 68.31 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 117.994 0.897 . . . . 0.0 110.228 -178.055 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.66 -45.08 72.71 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 176.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.3 m-30 -61.57 -49.9 74.79 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 176.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.1 tp -60.75 -43.79 97.51 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.783 0.433 . . . . 0.0 110.931 -174.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -67.27 -45.24 77.22 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.471 178.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -64.32 -39.59 94.2 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 111.509 0.189 . . . . 0.0 111.509 -175.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.0 t -80.93 -33.79 33.83 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 118.037 0.38 . . . . 0.0 111.313 -179.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.7 ttt85 . . . . . 0 C--N 1.339 0.122 0 CA-C-N 118.406 0.548 . . . . 0.0 110.405 177.013 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.525 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.34 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 23.3 p -50.88 -30.34 14.33 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -175.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.82 -44.75 88.84 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.597 -0.689 . . . . 0.0 110.046 176.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -68.02 -30.29 69.5 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.931 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.49 -45.8 85.74 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 123.287 0.635 . . . . 0.0 110.143 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.6 mt -64.46 -42.23 94.65 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 175.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 44.6 t-20 -60.99 -33.62 73.52 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 121.255 -0.178 . . . . 0.0 110.725 178.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.8 m -73.54 -40.58 63.87 Favored 'General case' 0 N--CA 1.457 -0.097 0 CA-C-O 119.492 -0.29 . . . . 0.0 110.884 179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.1 mt -62.29 -29.65 70.58 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 173.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.69 -14.92 31.46 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 118.994 -0.892 . . . . 0.0 113.919 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -100.12 -6.24 26.58 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.016 1.408 . . . . 0.0 111.966 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.435 HG21 HD13 ' A' ' 51' ' ' ILE . 27.6 m -122.16 -18.57 4.74 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.163 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -178.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.7 tp -50.89 -28.46 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 CA-C-N 118.426 0.557 . . . . 0.0 111.602 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -59.35 -53.49 57.66 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.67 0.388 . . . . 0.0 110.849 177.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -80.72 -27.91 36.78 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 119.605 -0.236 . . . . 0.0 111.476 -177.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 82.0 mt -65.28 -50.84 64.18 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 178.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.465 ' O ' HG13 ' A' ' 113' ' ' ILE . 83.7 mt -64.37 -64.8 0.79 Allowed 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 175.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.2 t -34.4 -55.44 0.53 Allowed 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 179.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -73.12 -39.29 65.86 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-N 119.359 0.981 . . . . 0.0 112.054 -177.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.418 ' O ' ' HE2' ' A' ' 115' ' ' LYS . . . -57.56 -49.46 76.3 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.847 0.749 . . . . 0.0 110.216 179.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.2 OUTLIER -76.04 -32.57 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -179.119 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.35 -28.76 67.42 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.542 0.61 . . . . 0.0 109.841 179.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.418 ' HE2' ' O ' ' A' ' 112' ' ' ALA . 0.4 OUTLIER -79.21 -23.04 44.06 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.833 0.853 . . . . 0.0 110.374 175.12 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.408 ' HB3' ' HB2' ' A' ' 120' ' ' HIS . 35.5 m -76.87 154.95 33.28 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 113.75 1.018 . . . . 0.0 113.75 -172.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -92.1 -178.35 4.95 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 170.177 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -55.61 -43.82 76.44 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.094 0.407 . . . . 0.0 111.396 -178.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -66.71 -43.02 85.4 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 121.716 -0.615 . . . . 0.0 110.85 -178.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.408 ' HB2' ' HB3' ' A' ' 116' ' ' SER . 55.7 m80 -70.25 -36.08 74.22 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 119.628 -0.225 . . . . 0.0 110.777 -178.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.08 -39.48 92.56 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 174.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -67.41 -38.65 84.95 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.689 -177.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -63.04 -44.47 95.8 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 121.209 -0.196 . . . . 0.0 111.169 175.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 97.5 mt -66.94 -35.92 75.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 80.0 ttt-85 -66.4 -32.19 73.42 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 122.079 -0.388 . . . . 0.0 110.181 176.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 58.3 ttp -67.19 -42.47 84.15 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 175.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 64.7 tp -57.34 -47.81 80.63 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.95 0.405 . . . . 0.0 110.221 176.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 84.1 mt -70.79 -27.79 64.16 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.443 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.6 t70 . . . . . 0 N--CA 1.454 -0.258 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 175.947 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo . . . . . 0 N--CA 1.455 -0.759 0 N-CA-C 110.103 -0.768 . . . . 0.0 110.103 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 38.1 m -68.4 154.9 40.91 Favored 'General case' 0 N--CA 1.457 -0.109 0 CA-C-O 120.679 0.276 . . . . 0.0 110.616 176.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 162' ' ' TYR . . . . . 0.423 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 3.2 t80 -150.58 138.53 20.04 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.911 0.484 . . . . 0.0 110.671 -179.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.4 t -133.46 134.67 24.07 Favored Pre-proline 0 N--CA 1.455 -0.195 0 C-N-CA 123.26 0.624 . . . . 0.0 111.4 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -58.42 -12.58 14.07 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.531 2.821 . . . . 0.0 112.593 174.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 2.8 m . . . . . 0 CA--C 1.531 0.247 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 -173.414 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.43 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 18.3 t70 . . . . . 0 CA--C 1.534 0.331 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.43 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 7.1 t80 -55.92 -13.65 1.99 Allowed 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.724 -0.61 . . . . 0.0 110.772 177.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -53.06 -37.98 62.09 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 124.367 1.067 . . . . 0.0 111.127 175.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -62.91 -45.02 94.46 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 119.217 0.917 . . . . 0.0 110.164 179.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -64.04 -51.34 64.6 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 117.693 0.224 . . . . 0.0 110.613 -178.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.2 t -64.72 -50.82 73.71 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.129 0 C-N-CA 121.002 -0.279 . . . . 0.0 110.773 -177.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.31 -29.47 69.89 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 119.537 -0.268 . . . . 0.0 111.683 -179.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 57.5 m -73.84 -43.55 58.34 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 118.456 0.571 . . . . 0.0 110.389 176.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.501 ' HG ' ' CD2' ' A' ' 53' ' ' TYR . 21.3 tp -66.32 -28.47 68.71 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.163 0.506 . . . . 0.0 109.741 179.228 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -70.64 -46.71 62.78 Favored 'General case' 0 C--N 1.337 0.035 0 C-N-CA 123.773 0.829 . . . . 0.0 109.35 175.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 64.8 m -63.4 -22.77 67.08 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.059 175.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -76.72 -39.56 51.49 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.484 0.314 . . . . 0.0 110.28 175.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.1 ttpp . . . . . 0 CA--C 1.531 0.216 0 C-N-CA 123.264 0.625 . . . . 0.0 111.05 175.938 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 29.9 mt . . . . . 0 CA--C 1.532 0.261 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.0 t -140.06 125.1 18.56 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 175.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -61.39 -31.22 76.56 Favored Glycine 0 CA--C 1.524 0.615 0 CA-C-O 119.26 -0.744 . . . . 0.0 112.805 -175.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 88.8 p -63.47 -35.5 80.64 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 118.795 1.298 . . . . 0.0 110.879 -174.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.0 mmt-85 -68.39 -45.5 72.51 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 177.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 41.4 mt -62.59 -35.15 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.1 mmtt -71.22 -37.85 72.02 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 118.998 -0.525 . . . . 0.0 111.25 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.58 -42.73 91.4 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.065 0.848 . . . . 0.0 110.183 175.062 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.8 mt -64.15 -59.68 4.14 Favored 'General case' 0 N--CA 1.456 -0.156 0 O-C-N 122.611 -0.056 . . . . 0.0 111.149 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 56.3 p -56.26 -46.38 79.67 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 178.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 t -63.47 -44.69 93.69 Favored 'General case' 0 CA--C 1.521 -0.142 0 C-N-CA 119.814 -0.754 . . . . 0.0 111.295 -177.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -67.34 -35.95 80.43 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 118.928 -1.109 . . . . 0.0 111.12 -178.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.92 -57.56 12.51 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.743 0.306 . . . . 0.0 110.434 174.092 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 63.9 mt -70.51 -16.59 62.91 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.927 0.891 . . . . 0.0 113.045 -174.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -61.92 -29.56 70.3 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -178.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.5 p80 -152.62 -17.01 0.16 Allowed 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 115.243 1.572 . . . . 0.0 115.243 -177.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.565 HG22 HG22 ' A' ' 93' ' ' THR . 27.5 mm 44.82 77.07 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 121.662 0.744 . . . . 0.0 112.084 178.05 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -147.32 21.13 1.21 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.406 0.682 . . . . 0.0 110.367 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.546 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -147.41 37.62 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 C-N-CA 124.407 1.083 . . . . 0.0 109.362 -171.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.47 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -51.11 -57.6 8.29 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -175.47 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 85.2 p -74.38 -25.85 59.75 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -173.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.664 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.04 -45.07 15.79 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 18.9 mt -55.58 -50.87 63.73 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 172.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.436 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 14.9 mm -67.99 -48.04 76.44 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -176.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.2 t -55.47 -42.81 74.86 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 119.96 -0.696 . . . . 0.0 109.96 179.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 73.9 mt -61.27 -62.02 2.14 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.021 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.5 pt -58.77 -35.49 56.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 119.621 1.1 . . . . 0.0 112.144 -174.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.48 HD13 HG21 ' A' ' 104' ' ' VAL . 76.2 mt -60.83 -59.18 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 178.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -63.98 -31.88 73.22 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.769 -178.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.501 ' CD2' ' HG ' ' A' ' 14' ' ' LEU . 3.7 m-85 -66.16 -34.23 77.56 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 122.092 -0.38 . . . . 0.0 110.162 178.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 29.5 t -68.89 -46.76 67.54 Favored 'General case' 0 C--O 1.231 0.087 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 173.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.6 tpp180 -56.14 -37.76 69.91 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 124.959 1.303 . . . . 0.0 112.519 -177.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 69.6 mt -78.35 -14.28 59.48 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 115.068 1.507 . . . . 0.0 115.068 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.463 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 82.4 m -115.18 160.08 35.42 Favored Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -169.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.463 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 93.9 Cg_endo -70.89 179.79 4.03 Favored 'Trans proline' 0 C--N 1.348 0.531 1 C-N-CA 125.344 4.029 . . . . 0.0 113.028 -179.234 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.549 ' HB3' ' HE3' ' A' ' 115' ' ' LYS . 5.0 p-10 -55.53 -34.51 64.74 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 114.53 1.308 . . . . 0.0 114.53 -171.152 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.2 t -63.77 -35.3 80.13 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.902 0.774 . . . . 0.0 109.452 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 62.8 t-80 -83.99 -31.1 25.68 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.078 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -58.71 -44.97 90.52 Favored 'General case' 0 C--N 1.341 0.219 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 53.5 tp -66.92 -52.05 47.83 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 122.757 0.423 . . . . 0.0 111.187 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.83 -39.63 97.75 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 -179.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.0 t -70.51 -33.52 71.29 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 117.322 0.561 . . . . 0.0 110.061 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.4 mt -64.82 -33.65 76.5 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.511 173.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -66.42 -39.15 88.78 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 119.331 0.969 . . . . 0.0 109.697 174.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 83.9 mt -64.12 -50.29 77.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 O-C-N 122.146 -0.346 . . . . 0.0 111.116 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 60.1 mt -62.1 -34.95 66.07 Favored 'Isoleucine or valine' 0 C--O 1.231 0.115 0 C-N-CA 123.712 0.805 . . . . 0.0 109.681 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -67.76 -42.76 81.27 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.985 -0.531 . . . . 0.0 110.442 177.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.42 ' HA ' ' NH1' ' A' ' 74' ' ' ARG . 8.0 t -66.93 -50.65 61.7 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 119.25 -0.98 . . . . 0.0 111.338 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 47.0 mt -64.89 -35.74 76.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.201 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.0 -54.31 25.31 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.966 -0.454 . . . . 0.0 111.966 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.42 ' NH1' ' HA ' ' A' ' 71' ' ' SER . 4.0 mtp-105 -61.74 -37.53 84.57 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-N 117.294 0.547 . . . . 0.0 110.817 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.02 -44.44 72.73 Favored 'General case' 0 N--CA 1.451 -0.375 0 O-C-N 122.46 -0.15 . . . . 0.0 111.004 179.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.2 m-30 -61.8 -45.57 93.27 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 176.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.6 tt -58.83 -52.95 63.53 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -177.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -58.21 -44.97 88.4 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 121.154 -0.218 . . . . 0.0 110.556 179.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -63.61 -43.02 98.08 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -174.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.453 HG23 HH11 ' A' ' 81' ' ' ARG . 14.6 t -82.16 -26.36 33.52 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -176.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.453 HH11 HG23 ' A' ' 80' ' ' THR . 9.5 mpt_? . . . . . 0 C--N 1.339 0.147 0 CA-C-N 118.694 0.679 . . . . 0.0 110.206 175.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.565 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.243 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.0 p -51.13 -27.26 8.07 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -177.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.3 -39.07 82.17 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.253 -0.904 . . . . 0.0 110.126 176.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 -68.55 -34.48 75.91 Favored 'General case' 0 CA--C 1.519 -0.227 0 C-N-CA 122.981 0.512 . . . . 0.0 109.801 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.436 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -63.74 -43.75 95.57 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.349 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.5 -42.89 94.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 175.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -59.98 -33.98 72.68 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 121.393 -0.123 . . . . 0.0 111.022 179.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.7 m -76.0 -41.47 51.03 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-O 119.535 -0.269 . . . . 0.0 111.346 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 62.6 mt -61.7 -29.74 70.29 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 119.782 -0.767 . . . . 0.0 108.985 173.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.88 -14.87 39.67 Favored Glycine 0 CA--C 1.529 0.948 0 CA-C-O 119.171 -0.794 . . . . 0.0 113.672 179.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.67 -6.16 25.54 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.591 1.196 . . . . 0.0 111.562 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.48 HG21 HD13 ' A' ' 51' ' ' ILE . 32.2 m -124.02 -18.12 4.05 Favored 'Isoleucine or valine' 0 C--N 1.338 0.094 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.14 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.449 HD12 ' HA ' ' A' ' 105' ' ' ILE . 11.1 tp -53.15 -31.1 17.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 CA-C-N 118.751 0.705 . . . . 0.0 111.28 -177.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -60.83 -55.08 37.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.884 0.474 . . . . 0.0 110.829 178.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -75.94 -31.56 59.15 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.684 0.394 . . . . 0.0 111.773 -177.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 58.6 mt -64.81 -50.53 66.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 97.4 mt -70.29 -50.41 39.67 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.643 -178.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 88.9 p -52.21 -50.19 62.44 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 118.545 0.611 . . . . 0.0 111.852 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -68.29 -46.38 70.48 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 118.662 0.664 . . . . 0.0 111.167 -178.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -54.11 -54.12 43.9 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.844 0.458 . . . . 0.0 110.499 -179.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 10.8 mt -65.47 -46.0 91.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 CA-C-N 118.005 0.366 . . . . 0.0 110.801 -178.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.01 -21.47 66.4 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 119.74 -0.171 . . . . 0.0 111.292 -176.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.549 ' HE3' ' HB3' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -94.88 -13.68 25.25 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 117.69 0.223 . . . . 0.0 111.432 179.831 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.441 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 50.1 p -90.11 165.9 13.72 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -172.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -83.55 174.08 10.88 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.137 0.975 . . . . 0.0 109.894 179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.7 tt0 -55.55 -44.39 76.73 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.906 0.482 . . . . 0.0 111.851 -178.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -68.44 -37.46 80.26 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 121.964 -0.46 . . . . 0.0 110.606 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.441 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 56.4 m80 -71.51 -52.54 17.78 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 119.001 -0.523 . . . . 0.0 110.969 -177.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -36.99 65.74 Favored 'General case' 0 C--N 1.342 0.258 0 CA-C-N 119.238 0.927 . . . . 0.0 110.922 173.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.69 -43.57 98.47 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.566 178.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -64.7 -36.16 83.39 Favored 'General case' 0 C--O 1.227 -0.109 0 CA-C-O 119.549 -0.262 . . . . 0.0 111.685 177.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.4 mt -68.58 -40.5 81.96 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 178.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 15.4 ttp180 -60.55 -47.04 87.95 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.701 0.401 . . . . 0.0 110.766 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.72 -30.69 64.39 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.278 -178.139 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.415 ' C ' HD23 ' A' ' 127' ' ' LEU . 7.6 tt -60.98 -47.67 85.36 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.621 0.646 . . . . 0.0 109.481 175.388 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 87.9 mt -70.09 -32.08 69.97 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.772 -0.194 . . . . 0.0 111.062 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.0 t70 . . . . . 0 N--CA 1.454 -0.256 0 N-CA-C 110.391 -0.225 . . . . 0.0 110.391 177.991 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 160' ' ' PRO . . . . . 0.467 ' HG2' ' H ' ' B' ' 161' ' ' SER . 61.1 Cg_endo . . . . . 0 N--CA 1.457 -0.62 0 N-CA-C 111.23 -0.335 . . . . 0.0 111.23 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . 0.467 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 68.2 p -169.0 156.18 7.14 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 124.115 0.966 . . . . 0.0 109.377 176.037 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -158.33 139.43 13.19 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.63 0.252 . . . . 0.0 111.618 173.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 27.0 t -140.44 142.66 30.09 Favored Pre-proline 0 N--CA 1.454 -0.26 0 C-N-CA 123.749 0.82 . . . . 0.0 110.78 178.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.85 -7.71 2.55 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 123.776 2.984 . . . . 0.0 112.975 173.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 38.0 m . . . . . 0 CA--C 1.53 0.184 0 C-N-CA 122.967 0.507 . . . . 0.0 110.977 -179.382 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.1 t70 . . . . . 0 CA--C 1.531 0.249 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -55.64 -16.55 4.25 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 118.438 0.563 . . . . 0.0 111.077 175.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.7 tp60 -55.32 -40.1 70.77 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 123.106 0.563 . . . . 0.0 110.81 176.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -60.96 -40.59 93.93 Favored 'General case' 0 N--CA 1.458 -0.072 0 CA-C-N 118.516 0.598 . . . . 0.0 110.781 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -64.57 -55.73 18.56 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 57.6 t -59.09 -53.97 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.123 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -178.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.03 -33.07 70.33 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.165 0.586 . . . . 0.0 111.95 -177.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 56.3 m -70.26 -44.95 67.41 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 118.784 0.72 . . . . 0.0 110.047 177.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.6 tp -65.72 -34.51 78.35 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.385 0.612 . . . . 0.0 109.983 -179.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -67.57 -42.89 81.83 Favored 'General case' 0 CA--C 1.52 -0.2 0 C-N-CA 123.866 0.866 . . . . 0.0 109.763 178.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.0 m -63.94 -30.19 71.3 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 175.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.29 -36.27 76.88 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 176.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.9 tttm . . . . . 0 N--CA 1.456 -0.169 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 177.032 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.1 mm . . . . . 0 CA--C 1.53 0.186 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.3 m -50.53 127.94 18.98 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.836 0.454 . . . . 0.0 111.735 -175.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.22 -14.59 64.21 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-O 119.043 -0.865 . . . . 0.0 113.548 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 66.3 p -64.42 -42.25 96.14 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 119.272 1.536 . . . . 0.0 111.082 -177.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -64.3 -40.63 96.33 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 177.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 55.5 mt -64.03 -37.37 79.65 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -60.39 -47.44 86.07 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 122.722 0.409 . . . . 0.0 110.231 178.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.01 -46.53 88.79 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 118.025 0.375 . . . . 0.0 111.02 177.271 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 99.4 mt -61.6 -59.4 5.26 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 122.196 -0.315 . . . . 0.0 110.806 -177.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 67.3 p -56.36 -46.41 80.03 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.3 t -64.14 -44.28 92.65 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.182 -176.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -75.25 -18.56 60.07 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 120.205 -0.598 . . . . 0.0 112.349 -179.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.37 -59.25 3.56 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.699 0.681 . . . . 0.0 109.288 167.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.5 mp -70.92 -13.42 62.01 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -176.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -55.41 -26.64 42.92 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -153.08 -24.04 0.15 Allowed 'General case' 0 C--N 1.339 0.143 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -178.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.529 HG22 HG22 ' A' ' 93' ' ' THR . 35.8 mm 45.44 72.45 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-O 121.837 0.827 . . . . 0.0 111.446 -177.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -146.6 21.69 1.31 Allowed 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.48 1.112 . . . . 0.0 109.229 179.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.573 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.57 33.24 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.231 0 C-N-CA 124.574 1.15 . . . . 0.0 109.209 -170.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.513 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.2 OUTLIER -49.12 -55.67 11.54 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -177.062 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 80.4 p -74.66 -27.15 60.3 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -173.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.653 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.48 -43.17 17.54 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 -179.306 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 39.2 mt -55.75 -51.77 55.7 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.414 HD13 ' HA ' ' A' ' 47' ' ' ILE . 14.9 mm -67.43 -49.3 72.68 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -176.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 72.2 m -57.53 -35.33 70.16 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 119.277 -0.969 . . . . 0.0 110.404 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.5 tp -70.0 -43.87 70.52 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 118.909 -0.567 . . . . 0.0 112.261 -178.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 36.8 pt -73.37 -33.21 39.89 Favored 'Isoleucine or valine' 0 C--N 1.34 0.187 0 CA-C-N 119.304 0.956 . . . . 0.0 111.809 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.485 HD13 HG21 ' A' ' 104' ' ' VAL . 97.3 mt -65.66 -52.59 48.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -63.06 -29.09 70.54 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.356 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 33.3 t80 -62.75 -47.71 82.34 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 174.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.9 t -62.23 -33.07 73.89 Favored 'General case' 0 C--N 1.338 0.087 0 CA-C-O 120.581 0.229 . . . . 0.0 110.567 176.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -69.23 -40.91 77.64 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.866 0.866 . . . . 0.0 112.597 -177.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.2 mt -91.92 -14.81 28.98 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -174.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.406 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 78.7 m -100.72 159.45 29.56 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -170.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 57' ' ' CYS . 50.7 Cg_exo -57.94 -178.66 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.367 1 C-N-CA 126.153 4.569 . . . . 0.0 115.406 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -62.84 -46.3 88.55 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.459 1.104 . . . . 0.0 112.766 -177.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 50.6 m -62.54 -30.53 71.37 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 20.6 m80 -79.17 -20.58 48.1 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 119.026 -0.512 . . . . 0.0 110.756 176.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.7 tppt? -67.63 -45.86 74.13 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 173.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.4 tp -63.91 -44.48 92.83 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.404 176.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.63 -40.96 95.38 Favored Glycine 0 C--N 1.339 0.712 0 N-CA-C 110.353 -1.099 . . . . 0.0 110.353 177.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 71.0 m -60.74 -44.15 97.05 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.93 -0.557 . . . . 0.0 109.792 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 20.8 mt -57.87 -42.29 84.22 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.586 0.63 . . . . 0.0 111.477 178.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -68.6 -34.99 76.73 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.026 0.83 . . . . 0.0 111.328 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 71.3 mt -69.98 -50.96 44.1 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 O-C-N 122.026 -0.421 . . . . 0.0 110.385 178.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 74.9 mt -60.11 -35.16 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.105 0 C-N-CA 124.211 1.004 . . . . 0.0 109.546 178.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -68.2 -45.99 71.85 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.848 -0.596 . . . . 0.0 110.871 178.18 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.5 t -64.57 -53.39 48.52 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 118.569 0.622 . . . . 0.0 110.955 -178.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 47.3 mt -63.68 -34.32 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.32 -52.79 37.18 Favored Glycine 0 CA--C 1.524 0.64 0 CA-C-O 119.927 -0.374 . . . . 0.0 112.43 -178.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.651 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -70.27 -33.79 72.01 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 117.961 0.88 . . . . 0.0 111.001 -178.857 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.42 -48.17 70.89 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 177.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 -60.02 -45.68 91.99 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 176.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -57.05 -46.19 82.64 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 119.363 -0.351 . . . . 0.0 110.601 -176.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -68.84 -41.7 78.15 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 119.732 -0.787 . . . . 0.0 111.005 178.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -65.77 -23.71 66.78 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -176.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.9 t -99.94 -21.71 15.56 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 118.583 0.629 . . . . 0.0 111.231 175.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 . . . . . 0 C--N 1.339 0.14 0 CA-C-N 117.908 0.322 . . . . 0.0 110.64 175.7 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.529 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.269 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.3 p -49.91 -30.09 9.5 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.194 0.906 . . . . 0.0 113.28 -177.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.56 -45.62 82.61 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.397 -0.814 . . . . 0.0 110.193 175.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -65.45 -31.61 72.78 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 123.579 0.752 . . . . 0.0 110.179 177.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.25 -45.29 81.07 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.617 0.767 . . . . 0.0 110.572 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.4 mt -64.31 -41.74 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 174.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -61.55 -33.48 73.92 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 120.476 0.179 . . . . 0.0 110.873 179.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.3 m -74.14 -41.75 61.07 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 122.085 -0.384 . . . . 0.0 110.928 179.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 61.2 mt -61.42 -30.89 70.85 Favored 'General case' 0 C--O 1.228 -0.074 0 CA-C-N 118.859 0.754 . . . . 0.0 109.014 173.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.93 -14.39 23.52 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-O 119.018 -0.879 . . . . 0.0 113.424 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -100.43 -3.94 29.94 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 118.961 1.38 . . . . 0.0 111.785 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.485 HG21 HD13 ' A' ' 51' ' ' ILE . 33.1 m -127.14 -19.98 2.24 Favored 'Isoleucine or valine' 0 C--N 1.339 0.15 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.1 tp -54.78 -28.39 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 C-N-CA 123.157 0.583 . . . . 0.0 111.891 -175.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -58.85 -58.23 9.56 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 120.739 0.304 . . . . 0.0 111.095 -179.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -78.05 -26.03 48.08 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 122.401 0.281 . . . . 0.0 111.219 -178.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.0 tt -66.45 -50.3 63.83 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 75.7 mt -69.7 -52.63 23.87 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.995 -0.526 . . . . 0.0 109.901 176.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.4 t -40.28 -49.39 2.73 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.073 0.397 . . . . 0.0 112.056 175.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -72.06 -48.48 43.97 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-N 118.222 0.465 . . . . 0.0 111.596 -178.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.04 -29.98 61.24 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 123.314 0.646 . . . . 0.0 112.277 179.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 2.5 mt -85.59 -41.18 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 118.855 0.752 . . . . 0.0 111.272 173.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.13 -25.93 67.21 Favored 'General case' 0 N--CA 1.454 -0.235 0 O-C-N 121.903 -0.498 . . . . 0.0 111.075 -177.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.21 -19.4 43.34 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.119 0.968 . . . . 0.0 110.93 177.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.48 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 24.4 p -83.44 163.13 20.72 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -172.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -94.62 175.45 6.66 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.676 1.191 . . . . 0.0 108.444 173.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -55.86 -38.96 70.8 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.831 0.741 . . . . 0.0 112.603 -176.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -73.29 -37.47 66.21 Favored 'General case' 0 C--O 1.232 0.132 0 O-C-N 121.526 -0.734 . . . . 0.0 110.514 -179.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.48 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 43.3 m170 -72.24 -44.12 63.34 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.856 -0.592 . . . . 0.0 110.857 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.401 ' C ' ' HD2' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -58.25 -38.66 77.33 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 119.573 1.079 . . . . 0.0 109.535 175.199 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -61.21 -44.11 97.81 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.129 177.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -64.17 -35.78 81.91 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 177.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 94.2 mt -74.59 -37.7 44.17 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.067 0 CA-C-N 118.359 0.527 . . . . 0.0 110.108 -178.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -63.68 -39.73 95.05 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 176.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 58.4 ttp -66.34 -42.43 88.14 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.369 0.268 . . . . 0.0 110.289 175.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.2 tt -59.93 -44.7 94.19 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 -178.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -69.36 -37.31 77.54 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 119.151 -0.452 . . . . 0.0 111.319 178.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 24.6 t70 . . . . . 0 N--CA 1.457 -0.102 0 CA-C-N 118.431 0.559 . . . . 0.0 110.119 177.897 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo . . . . . 0 N--CA 1.454 -0.852 0 N-CA-C 110.359 -0.67 . . . . 0.0 110.359 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 73.5 p -71.31 160.38 32.91 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 122.447 0.299 . . . . 0.0 111.229 178.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 162' ' ' TYR . . . . . 0.43 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 16.0 t80 -146.06 138.78 25.6 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.451 0.3 . . . . 0.0 111.477 -179.112 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.9 t -130.72 139.44 35.62 Favored Pre-proline 0 CA--C 1.53 0.197 0 C-N-CA 123.411 0.684 . . . . 0.0 110.619 176.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -58.77 -11.25 11.35 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.293 2.662 . . . . 0.0 112.318 173.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.535 0.371 0 C-N-CA 123.706 0.802 . . . . 0.0 111.872 -175.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.408 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 22.5 t70 . . . . . 0 CA--C 1.534 0.343 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.408 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 18.1 t80 -55.11 -14.65 1.7 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.227 1.011 . . . . 0.0 111.254 176.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.6 tp60 -54.59 -40.53 68.93 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.315 0.646 . . . . 0.0 111.15 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -58.1 -46.62 85.22 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 118.924 0.784 . . . . 0.0 110.811 177.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -63.96 -50.48 68.44 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 117.964 0.347 . . . . 0.0 110.803 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 62.1 t -62.69 -54.46 33.63 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 -178.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.12 -29.79 67.64 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.288 0.635 . . . . 0.0 111.819 -177.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 72.6 m -75.12 -41.36 58.68 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.255 0.479 . . . . 0.0 110.534 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.4 tp -65.85 -33.52 76.03 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -67.42 -42.91 82.43 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.915 0.886 . . . . 0.0 109.819 175.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.7 t -60.69 -31.16 70.42 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 174.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.456 ' CE2' HD11 ' A' ' 68' ' ' ILE . 0.1 OUTLIER -70.88 -38.04 73.05 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 176.479 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.8 tttm . . . . . 0 N--CA 1.455 -0.186 0 C-N-CA 122.501 0.32 . . . . 0.0 111.565 177.147 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 20.8 mm . . . . . 0 C--O 1.231 0.105 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.1 t -124.66 127.56 47.5 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 117.902 0.319 . . . . 0.0 110.203 -176.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.73 -32.44 78.09 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-O 119.497 -0.613 . . . . 0.0 112.468 -175.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 80.0 p -62.23 -39.28 92.29 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.404 1.102 . . . . 0.0 110.703 -175.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.4 mpt_? -68.71 -44.66 73.44 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.147 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 77.0 mt -59.91 -41.7 86.82 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.098 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -67.59 -36.97 81.89 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 118.9 -0.571 . . . . 0.0 111.569 -179.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.62 -41.41 88.39 Favored 'General case' 0 C--N 1.338 0.097 0 CA-C-N 119.534 1.061 . . . . 0.0 110.495 175.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.3 mt -62.14 -52.07 65.31 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 122.395 -0.191 . . . . 0.0 110.568 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 44.0 p -60.87 -42.01 97.08 Favored 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 122.087 -0.383 . . . . 0.0 110.753 179.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.9 m -55.41 -57.52 11.51 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 122.965 0.506 . . . . 0.0 111.101 179.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 63.9 m-85 -76.16 -18.65 59.01 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -173.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.43 -57.76 4.86 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 118.859 0.754 . . . . 0.0 109.141 168.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.5 mt -70.44 -15.2 62.8 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.851 0.86 . . . . 0.0 112.949 -175.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -55.6 -31.41 62.22 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -178.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.2 t-80 -152.74 -20.81 0.16 Allowed 'General case' 0 C--N 1.34 0.171 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.481 HG22 HG22 ' A' ' 93' ' ' THR . 35.9 mm 46.8 73.78 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-O 121.82 0.819 . . . . 0.0 111.514 -178.067 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -143.97 22.65 1.74 Allowed 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.053 1.341 . . . . 0.0 108.656 178.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.557 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.8 pt -147.17 33.42 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 C-N-CA 124.679 1.192 . . . . 0.0 109.778 -170.117 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.455 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -50.45 -54.41 22.27 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 -176.313 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 32.6 t -74.23 -32.6 63.06 Favored 'General case' 0 C--O 1.225 -0.193 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -174.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.707 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -76.77 -45.6 28.34 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -178.617 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 9.6 mm -56.44 -51.73 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 173.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 15.4 mm -66.84 -50.83 61.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -176.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.8 m -59.06 -33.54 70.91 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 119.635 -0.826 . . . . 0.0 110.762 179.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.1 tp -70.02 -43.29 71.63 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 33.1 pt -73.58 -35.13 43.91 Favored 'Isoleucine or valine' 0 C--N 1.341 0.226 0 CA-C-N 119.427 1.012 . . . . 0.0 111.481 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.46 HD13 HG21 ' A' ' 104' ' ' VAL . 97.6 mt -64.2 -52.53 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.213 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.424 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 38.8 t70 -63.44 -31.65 72.87 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.068 179.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -60.18 -46.13 90.77 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 175.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -64.64 -37.07 86.33 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-O 120.796 0.331 . . . . 0.0 110.578 177.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.424 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 52.3 tpt85 -67.15 -34.75 78.24 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 124.207 1.003 . . . . 0.0 112.834 -176.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 71.7 mt -92.25 -14.67 28.56 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -176.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 66.6 m -110.65 150.84 42.31 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -170.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -74.76 -170.67 0.8 Allowed 'Trans proline' 0 CA--C 1.536 0.617 1 C-N-CA 125.65 4.234 . . . . 0.0 114.303 -177.273 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -34.72 -64.38 0.26 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 128.122 2.569 . . . . 0.0 115.027 -175.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 37.5 m -58.09 -28.18 64.36 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 122.505 0.322 . . . . 0.0 110.896 -174.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -90.32 -16.73 28.66 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 118.522 -0.751 . . . . 0.0 111.923 -179.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -70.95 -42.32 69.95 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 169.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 59.9 tp -66.93 -47.49 71.53 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 176.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.64 -46.04 93.86 Favored Glycine 0 C--N 1.338 0.662 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 178.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 92.2 p -63.07 -41.45 99.44 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 117.574 0.687 . . . . 0.0 110.163 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 31.4 mt -61.68 -40.25 94.3 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 119.06 0.845 . . . . 0.0 111.487 177.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -67.84 -34.47 76.77 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 119.721 1.146 . . . . 0.0 111.147 177.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.456 HD11 ' CE2' ' A' ' 17' ' ' PHE . 69.3 mt -68.3 -49.05 70.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 O-C-N 121.72 -0.613 . . . . 0.0 110.497 177.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.25 -34.6 64.79 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.077 0 C-N-CA 124.13 0.972 . . . . 0.0 109.39 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -67.95 -44.17 77.41 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.162 0.585 . . . . 0.0 110.505 177.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 14.3 m -67.64 -49.88 60.71 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 119.725 -0.79 . . . . 0.0 111.038 -177.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 67.5 mt -67.11 -38.13 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 179.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.15 -46.7 78.2 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 -178.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.4 mtp-105 -69.22 -36.72 77.52 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 117.257 0.528 . . . . 0.0 110.773 178.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.16 -40.08 86.59 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 177.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.4 m-30 -64.99 -48.2 74.82 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 175.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.3 tp -56.9 -43.42 81.35 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 123.367 0.417 . . . . 0.0 109.968 -177.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -67.3 -42.43 83.75 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 122.523 -0.111 . . . . 0.0 110.874 178.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -62.8 -40.9 98.8 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 111.444 0.164 . . . . 0.0 111.444 -176.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.5 t -84.02 -26.99 28.68 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 13.7 tpp180 . . . . . 0 C--N 1.34 0.193 0 CA-C-N 118.26 0.482 . . . . 0.0 110.807 175.938 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.481 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.237 0 CA-C-O 119.034 -0.508 . . . . 0.0 109.883 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 23.0 p -48.61 -30.62 5.57 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.107 0.867 . . . . 0.0 113.248 -178.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.64 -46.62 81.77 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.313 -0.867 . . . . 0.0 109.922 175.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 41.0 t60 -65.81 -32.05 73.36 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.949 -0.568 . . . . 0.0 109.955 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.27 -45.35 88.43 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 123.686 0.794 . . . . 0.0 110.597 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.4 mt -63.01 -42.72 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.171 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 174.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -59.83 -35.31 74.48 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 121.232 -0.187 . . . . 0.0 111.156 179.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.6 m -72.49 -41.33 66.1 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-O 119.588 -0.244 . . . . 0.0 111.235 178.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 55.3 mt -60.97 -29.62 69.77 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 119.459 -0.896 . . . . 0.0 108.955 174.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.8 -14.45 16.02 Favored Glycine 0 CA--C 1.533 1.159 0 CA-C-O 118.928 -0.929 . . . . 0.0 113.923 178.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -104.64 -3.73 23.39 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.261 1.531 . . . . 0.0 112.135 -178.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.46 HG21 HD13 ' A' ' 51' ' ' ILE . 35.5 m -123.61 -17.06 4.66 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.149 0 C-N-CA 122.784 0.433 . . . . 0.0 111.949 -178.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -48.3 -28.64 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -58.73 -59.05 6.03 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 117.917 0.326 . . . . 0.0 111.497 -178.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -70.97 -30.71 67.06 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 117.841 0.291 . . . . 0.0 110.711 -177.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.1 mp -63.02 -55.14 28.24 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.497 -0.287 . . . . 0.0 110.44 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 62.3 mt -71.36 -49.18 44.9 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 118.137 0.426 . . . . 0.0 110.965 -178.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 66.0 p -49.94 -52.04 36.5 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 119.003 -0.522 . . . . 0.0 112.327 178.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -72.53 -41.99 65.24 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 119.187 0.903 . . . . 0.0 111.709 -177.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.69 -41.76 82.29 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.575 0.625 . . . . 0.0 111.221 -178.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 10.5 mt -78.55 -35.14 18.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 118.822 0.737 . . . . 0.0 111.12 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.01 -30.14 70.63 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 120.316 -0.554 . . . . 0.0 111.119 -178.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.42 -19.89 48.89 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.141 0.576 . . . . 0.0 110.303 176.353 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 40.3 m -78.16 156.14 30.05 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -173.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.1 t-20 -88.75 176.48 7.06 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 169.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -55.65 -38.47 69.61 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.916 0.78 . . . . 0.0 111.433 -178.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -66.62 -43.51 84.57 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.662 -0.649 . . . . 0.0 111.01 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -72.74 -35.01 67.43 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 119.493 -0.289 . . . . 0.0 110.683 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -41.57 87.98 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 118.828 0.74 . . . . 0.0 109.139 172.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -66.45 -39.21 88.74 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.222 -178.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -61.81 -39.95 93.53 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 119.372 -0.347 . . . . 0.0 111.196 175.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.2 mt -73.36 -34.97 44.93 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.11 0 CA-C-N 118.437 0.562 . . . . 0.0 109.709 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -66.65 -39.32 88.17 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 122.224 -0.298 . . . . 0.0 110.52 177.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 25.6 ttt -64.19 -46.28 84.63 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 176.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.5 tt -55.88 -47.45 77.34 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.942 0.497 . . . . 0.0 110.663 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.1 mt -75.51 -30.9 59.96 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -177.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.6 t70 . . . . . 0 N--CA 1.45 -0.436 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 177.782 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo . . . . . 0 N--CA 1.454 -0.819 0 N-CA-C 110.251 -0.711 . . . . 0.0 110.251 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 31.9 t -66.57 137.96 57.14 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -146.5 141.22 26.84 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 122.813 0.445 . . . . 0.0 111.44 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 16.4 t -133.8 145.69 57.08 Favored Pre-proline 0 C--O 1.233 0.213 0 C-N-CA 123.617 0.767 . . . . 0.0 111.093 -175.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.32 1.98 2.17 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 123.476 2.784 . . . . 0.0 111.341 177.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 24.2 p . . . . . 0 CA--C 1.529 0.171 0 CA-C-O 118.711 -0.661 . . . . 0.0 112.011 176.649 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.1 t70 . . . . . 0 CA--C 1.535 0.39 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -55.77 -13.05 1.51 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.546 0.739 . . . . 0.0 111.557 177.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -52.93 -44.53 67.11 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.512 0.725 . . . . 0.0 110.94 177.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -58.13 -41.74 84.33 Favored 'General case' 0 C--O 1.227 -0.095 0 CA-C-N 118.542 0.61 . . . . 0.0 111.523 177.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -64.86 -53.17 50.95 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 118.166 0.439 . . . . 0.0 110.302 -178.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.1 t -61.69 -53.73 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -178.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.51 -32.31 68.71 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 123.236 0.614 . . . . 0.0 111.916 -178.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 55.7 m -72.59 -44.95 61.34 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 118.403 0.547 . . . . 0.0 110.444 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.9 tp -65.47 -32.45 74.08 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.115 0.416 . . . . 0.0 109.975 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -67.81 -45.64 74.17 Favored 'General case' 0 N--CA 1.458 -0.058 0 C-N-CA 123.876 0.871 . . . . 0.0 109.777 176.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.0 t -63.43 -27.9 69.6 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.225 176.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.25 -43.57 70.28 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 175.646 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt . . . . . 0 CA--C 1.53 0.202 0 C-N-CA 124.014 0.926 . . . . 0.0 112.359 -179.982 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.8 mm . . . . . 0 CA--C 1.532 0.285 0 CA-C-O 121.13 0.49 . . . . 0.0 111.082 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.3 t -57.98 132.74 54.35 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.785 0.434 . . . . 0.0 111.01 -178.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.89 -27.62 71.5 Favored Glycine 0 C--N 1.339 0.697 0 C-N-CA 123.582 0.61 . . . . 0.0 113.177 -175.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.431 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 39.6 t -59.08 -43.84 91.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 117.901 0.851 . . . . 0.0 111.515 -174.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -65.5 -42.32 92.27 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -179.199 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 52.9 mt -62.53 -41.34 91.64 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.2 mmtt -64.59 -35.68 81.76 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 119.327 -0.368 . . . . 0.0 111.383 -179.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.431 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -65.93 -46.25 78.91 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 118.712 0.687 . . . . 0.0 110.115 174.025 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.22 -56.28 23.53 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 121.237 -0.185 . . . . 0.0 110.627 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.433 HG21 ' OG ' ' A' ' 71' ' ' SER . 77.3 p -58.13 -48.29 80.69 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 t -63.02 -44.0 97.16 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 120.084 -0.646 . . . . 0.0 111.389 -176.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -73.57 -22.48 60.05 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.652 0.66 . . . . 0.0 112.418 -178.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.82 -56.45 9.1 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 118.991 0.814 . . . . 0.0 109.172 168.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 55.7 mt -68.89 -15.84 63.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.157 0.983 . . . . 0.0 112.666 -175.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -59.81 -25.81 65.26 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.6 t-160 -150.23 -27.81 0.24 Allowed 'General case' 0 C--N 1.34 0.16 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -176.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.489 HG22 HG22 ' A' ' 93' ' ' THR . 42.2 mm 45.21 74.18 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-O 121.815 0.817 . . . . 0.0 111.899 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -149.41 22.84 0.92 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.435 1.094 . . . . 0.0 109.61 179.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.541 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -147.7 39.54 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 124.69 1.196 . . . . 0.0 109.131 -170.413 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.427 ' HB3' ' HA ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -52.33 -54.87 26.08 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -174.002 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.405 ' N ' ' HG2' ' A' ' 43' ' ' GLU . 78.9 p -75.77 -27.06 57.9 Favored 'General case' 0 CA--C 1.521 -0.166 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -172.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.699 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -81.49 -43.83 18.26 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.146 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 36.7 mt -55.91 -53.5 37.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 171.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' A' ' 47' ' ' ILE . 16.0 mm -66.58 -47.87 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 CA-C-O 119.078 -0.487 . . . . 0.0 112.027 -176.084 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 73.6 m -59.15 -35.5 73.62 Favored 'General case' 0 C--O 1.23 0.054 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.153 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.3 tp -68.53 -43.49 76.62 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 119.17 -0.443 . . . . 0.0 112.055 -178.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 33.2 pt -74.03 -33.33 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 119.217 0.917 . . . . 0.0 112.265 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.482 HD13 HG21 ' A' ' 104' ' ' VAL . 97.1 mt -66.3 -50.32 68.99 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 177.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -57.86 -42.1 83.81 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.266 178.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -58.39 -41.09 84.08 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 175.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.5 t -63.31 -46.22 87.73 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -178.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -80.47 -23.14 40.39 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -175.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.3 mt -84.87 -19.51 32.25 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 179.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.4 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 72.9 m -104.2 156.22 36.07 Favored Pre-proline 0 CA--C 1.534 0.339 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -170.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 57' ' ' CYS . 85.4 Cg_exo -50.74 176.36 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.537 1 C-N-CA 126.498 4.798 . . . . 0.0 115.997 175.067 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.454 ' HB2' ' HE3' ' A' ' 115' ' ' LYS . 10.4 p-10 -56.18 -49.61 73.53 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 125.905 1.682 . . . . 0.0 114.069 -174.019 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 52.8 m -62.75 -27.55 69.36 Favored 'General case' 0 CA--C 1.522 -0.101 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -81.95 -18.68 42.7 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 118.688 -0.673 . . . . 0.0 111.057 178.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -74.72 -40.2 61.44 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 119.381 0.991 . . . . 0.0 108.525 171.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 61.5 tp -64.35 -51.49 63.08 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 174.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.5 -36.82 90.81 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.765 -0.934 . . . . 0.0 110.765 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.7 t -60.58 -48.4 81.94 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.976 0.388 . . . . 0.0 110.137 177.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 31.1 mt -59.88 -35.55 75.06 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 118.55 0.614 . . . . 0.0 111.357 178.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -67.68 -37.23 82.04 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.117 0.872 . . . . 0.0 110.789 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 66.8 mt -70.31 -47.97 63.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 O-C-N 121.683 -0.635 . . . . 0.0 110.219 178.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 85.6 mt -59.98 -38.85 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 C-N-CA 123.993 0.917 . . . . 0.0 109.279 178.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -65.99 -42.97 89.12 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 118.787 -0.625 . . . . 0.0 110.555 178.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.433 ' OG ' HG21 ' A' ' 33' ' ' THR . 6.6 t -65.66 -54.6 25.37 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.621 0.646 . . . . 0.0 111.74 -177.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 55.8 mt -62.82 -33.48 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.18 -50.99 41.53 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-O 119.612 -0.549 . . . . 0.0 112.451 -179.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.634 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -70.82 -33.6 70.85 Favored 'General case' 0 CA--C 1.523 -0.07 0 CA-C-N 118.184 0.992 . . . . 0.0 110.72 -178.475 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.79 -44.49 77.26 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 177.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -62.83 -47.02 85.23 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 176.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.5 tp -57.42 -46.57 83.37 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 123.38 0.425 . . . . 0.0 110.379 -176.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -68.61 -44.45 74.27 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.094 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -68.9 -21.65 64.22 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -176.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 6.9 t -96.55 -28.01 14.58 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-N 118.675 0.67 . . . . 0.0 111.978 178.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 . . . . . 0 C--N 1.341 0.215 0 CA-C-N 118.657 0.662 . . . . 0.0 111.58 176.555 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.489 HG22 HG22 ' A' ' 40' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--O 1.227 -0.094 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 23.1 p -50.29 -32.03 15.89 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.058 1.343 . . . . 0.0 113.758 -172.266 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.14 -48.04 81.87 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.648 0.658 . . . . 0.0 109.973 176.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -75.34 -21.42 58.39 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.586 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.0 -44.88 83.49 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.2 mt -64.26 -43.7 97.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 174.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -58.97 -33.74 70.99 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.48 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.8 m -73.75 -42.6 60.88 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-O 119.301 -0.381 . . . . 0.0 110.887 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 56.8 mt -60.83 -29.55 69.56 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-N 119.053 0.842 . . . . 0.0 109.233 174.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.21 -14.31 25.17 Favored Glycine 0 CA--C 1.531 1.038 0 CA-C-O 119.104 -0.831 . . . . 0.0 113.635 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.8 -4.58 27.72 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.873 1.337 . . . . 0.0 112.044 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.482 HG21 HD13 ' A' ' 51' ' ' ILE . 27.0 m -126.18 -18.44 2.97 Favored 'Isoleucine or valine' 0 C--N 1.337 0.056 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -178.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.0 tp -49.62 -27.84 3.33 Favored 'Isoleucine or valine' 0 C--N 1.339 0.15 0 C-N-CA 123.753 0.821 . . . . 0.0 112.293 -175.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.9 pt20 -61.97 -49.69 75.1 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 117.764 0.256 . . . . 0.0 110.709 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -70.12 -36.51 74.86 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 -177.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.5 mt -63.81 -53.41 51.26 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.612 -177.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.432 ' O ' HG13 ' A' ' 113' ' ' ILE . 65.2 mt -66.05 -64.41 0.86 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.536 -0.745 . . . . 0.0 109.358 177.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 84.6 p -39.91 -49.69 2.44 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -71.66 -44.41 64.33 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 119.496 1.044 . . . . 0.0 111.404 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.13 -43.02 82.0 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.717 0.689 . . . . 0.0 110.874 -178.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.1 OUTLIER -76.88 -32.92 20.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 CA-C-N 119.01 0.823 . . . . 0.0 111.953 178.661 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.95 -30.05 68.41 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.34 0.518 . . . . 0.0 110.902 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.454 ' HE3' ' HB2' ' A' ' 59' ' ' ASP . 0.8 OUTLIER -77.62 -19.46 55.47 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.328 0.651 . . . . 0.0 110.227 175.577 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 56.0 m -81.29 153.96 26.81 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -173.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -92.35 177.61 6.09 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 170.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -55.36 -36.33 66.21 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.001 0.819 . . . . 0.0 111.608 -177.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -67.27 -47.13 71.58 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.779 -0.576 . . . . 0.0 110.382 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -70.11 -33.48 71.9 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 119.474 -0.298 . . . . 0.0 110.519 -179.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -42.25 93.21 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 118.591 0.632 . . . . 0.0 109.325 173.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -66.44 -40.25 89.37 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.149 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp -61.74 -43.83 98.08 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 119.661 -0.209 . . . . 0.0 110.996 176.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 95.6 mt -69.81 -38.38 75.77 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -63.95 -40.89 97.48 Favored 'General case' 0 CA--C 1.523 -0.091 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 60.9 ttp -63.27 -43.92 96.58 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 177.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 8.2 tt -58.76 -45.01 90.73 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 97.1 mt -73.19 -32.9 65.09 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.4 t70 . . . . . 0 N--CA 1.458 -0.051 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 177.455 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 160' ' ' PRO . . . . . 0.442 ' HG2' ' H ' ' B' ' 161' ' ' SER . 59.4 Cg_endo . . . . . 0 N--CA 1.453 -0.902 0 N-CA-C 110.868 -0.474 . . . . 0.0 110.868 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . 0.442 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 34.2 t -175.53 168.3 3.21 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 125.14 1.376 . . . . 0.0 108.079 178.369 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 162' ' ' TYR . . . . . 0.415 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 48.4 t80 -152.02 132.92 14.17 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.187 -0.321 . . . . 0.0 111.804 171.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.1 t -135.29 140.98 36.07 Favored Pre-proline 0 N--CA 1.455 -0.224 0 C-N-CA 123.181 0.592 . . . . 0.0 110.791 177.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -65.71 -6.56 14.22 Favored 'Trans proline' 0 N--CA 1.45 -1.052 0 C-N-CA 122.734 2.29 . . . . 0.0 111.302 177.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 71.1 p . . . . . 0 C--O 1.233 0.2 0 N-CA-C 113.345 0.868 . . . . 0.0 113.345 -177.73 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.436 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 14.1 t70 . . . . . 0 CA--C 1.535 0.382 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.436 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 10.6 t80 -55.59 -14.49 2.15 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.863 0.865 . . . . 0.0 111.297 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -55.27 -35.25 64.83 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.908 0.883 . . . . 0.0 111.485 176.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.6 m-20 -61.82 -45.46 93.72 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.359 0.981 . . . . 0.0 109.292 178.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -66.18 -48.39 70.87 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 110.557 -0.164 . . . . 0.0 110.557 -177.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.6 t -65.92 -54.67 24.82 Favored 'Isoleucine or valine' 0 C--N 1.339 0.118 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 -178.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.59 -31.76 69.76 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.828 0.451 . . . . 0.0 111.737 -178.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 69.5 m -73.63 -40.35 63.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 120.214 -0.595 . . . . 0.0 110.336 176.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.9 tp -66.28 -31.86 72.93 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.009 0.433 . . . . 0.0 109.852 179.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -69.74 -44.19 70.78 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.787 0.835 . . . . 0.0 109.683 175.155 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.2 t -63.26 -26.06 68.61 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 175.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.506 ' CE2' HD11 ' A' ' 68' ' ' ILE . 0.2 OUTLIER -71.19 -45.81 62.61 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 174.992 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt . . . . . 0 N--CA 1.455 -0.199 0 C-N-CA 122.865 0.466 . . . . 0.0 110.783 177.454 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.8 mt . . . . . 0 CA--C 1.53 0.205 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.5 m -139.3 123.88 18.38 Favored 'General case' 0 CA--C 1.523 -0.093 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 176.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.14 -26.96 73.35 Favored Glycine 0 CA--C 1.525 0.714 0 CA-C-O 119.489 -0.617 . . . . 0.0 112.682 -174.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.425 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 83.4 p -65.28 -35.22 80.34 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 118.398 1.099 . . . . 0.0 109.87 -179.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.6 mmt-85 -68.08 -46.0 72.23 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 73.0 mt -60.87 -36.38 71.29 Favored 'Isoleucine or valine' 0 C--O 1.231 0.1 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.104 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.9 mmtt -69.26 -40.86 77.58 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 119.009 -0.52 . . . . 0.0 111.504 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.39 -38.48 87.61 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.188 0.904 . . . . 0.0 110.953 176.153 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.7 mt -63.32 -57.84 9.06 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 122.161 0.184 . . . . 0.0 110.797 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.417 HG21 ' HB2' ' A' ' 71' ' ' SER . 33.4 p -56.27 -42.12 76.95 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 118.074 0.397 . . . . 0.0 111.272 177.028 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.0 m -55.65 -55.08 36.38 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 119.01 -0.519 . . . . 0.0 110.913 -179.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -67.86 -37.18 81.5 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.326 -0.949 . . . . 0.0 111.584 -176.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.09 -58.66 7.22 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 118.063 0.392 . . . . 0.0 110.978 177.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.45 HD21 ' HB1' ' A' ' 75' ' ' ALA . 8.2 mp -67.95 -25.09 65.28 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -178.034 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -71.71 -19.15 62.1 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 117.857 0.299 . . . . 0.0 111.091 176.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -146.74 52.83 1.1 Allowed 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.36 0.264 . . . . 0.0 111.456 -175.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.534 HG22 HG22 ' A' ' 93' ' ' THR . 33.3 mm -65.06 76.18 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-O 121.757 0.789 . . . . 0.0 109.908 171.133 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -144.13 10.96 1.53 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.597 1.559 . . . . 0.0 109.063 174.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.464 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -146.15 95.26 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 C-N-CA 125.68 1.592 . . . . 0.0 107.935 -176.572 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.561 ' CD ' ' H ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -91.76 -79.27 0.38 Allowed 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -177.18 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.561 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 46.1 m -57.72 -21.31 40.14 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 123.554 0.741 . . . . 0.0 112.96 -174.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.558 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -76.02 -54.07 7.41 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.349 0.659 . . . . 0.0 110.346 178.632 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 6.2 mt -56.36 -44.25 79.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 173.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.5 mm -67.14 -47.38 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.166 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.082 -179.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 42.7 t -58.95 -34.49 71.83 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-N 118.406 0.548 . . . . 0.0 109.968 178.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.9 tp -68.71 -45.42 71.64 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.811 -179.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.9 pt -72.3 -34.93 50.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 119.415 1.007 . . . . 0.0 112.183 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.494 HD13 HG21 ' A' ' 104' ' ' VAL . 96.3 mt -64.55 -51.71 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 178.655 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -64.91 -27.92 69.18 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.078 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -61.94 -46.81 87.68 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 175.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.7 t -61.86 -38.8 89.63 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.39 175.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -61.24 -42.77 99.19 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.621 0.769 . . . . 0.0 112.602 -176.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 83.7 mt -86.23 -14.76 42.9 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 -175.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.421 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 76.0 m -105.21 155.74 37.31 Favored Pre-proline 0 CA--C 1.533 0.309 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -170.569 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.421 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 92.3 Cg_endo -69.17 -176.44 1.32 Allowed 'Trans proline' 0 N--CA 1.459 -0.532 1 C-N-CA 125.431 4.088 . . . . 0.0 113.142 -178.882 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -54.82 -44.32 73.75 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.382 1.473 . . . . 0.0 113.98 -171.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.0 m -58.03 -29.32 65.25 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -92.86 -14.48 27.63 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 118.892 -0.575 . . . . 0.0 111.672 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -65.85 -49.0 69.73 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 169.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 44.5 tp -67.74 -48.21 67.1 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.346 179.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -56.84 -43.64 92.27 Favored Glycine 0 C--N 1.337 0.598 0 N-CA-C 110.73 -0.948 . . . . 0.0 110.73 179.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.2 t -67.5 -35.46 79.18 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.699 -0.667 . . . . 0.0 110.91 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 35.9 mt -60.9 -34.58 74.87 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 119.649 1.113 . . . . 0.0 110.66 173.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -71.67 -32.47 67.91 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.887 0.767 . . . . 0.0 111.347 175.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.506 HD11 ' CE2' ' A' ' 17' ' ' PHE . 92.6 mt -70.7 -44.07 76.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 CA-C-N 118.798 0.726 . . . . 0.0 110.413 176.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.1 mt -63.65 -35.41 72.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 177.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -70.07 -39.49 75.6 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 119.057 -0.496 . . . . 0.0 111.252 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.417 ' HB2' HG21 ' A' ' 33' ' ' THR . 95.8 p -69.72 -55.33 10.23 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 118.907 0.776 . . . . 0.0 110.5 -176.418 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 39.3 mt -64.75 -33.42 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.42 -52.21 45.59 Favored Glycine 0 CA--C 1.524 0.622 0 CA-C-O 119.846 -0.419 . . . . 0.0 112.239 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.651 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -72.06 -31.24 65.94 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 118.061 0.931 . . . . 0.0 111.115 -178.703 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.45 ' HB1' HD21 ' A' ' 37' ' ' LEU . . . -70.49 -41.89 72.08 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 177.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -62.84 -48.49 78.82 Favored 'General case' 0 CA--C 1.519 -0.22 0 O-C-N 122.153 -0.342 . . . . 0.0 110.094 175.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 55.1 tp -58.04 -44.03 87.18 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 123.312 0.383 . . . . 0.0 110.277 -176.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -66.12 -46.02 79.06 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 110.598 -0.149 . . . . 0.0 110.598 179.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -64.39 -34.8 79.0 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -176.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.4 t -85.93 -23.7 26.86 Favored 'General case' 0 CA--C 1.527 0.082 0 CA-C-N 118.147 0.43 . . . . 0.0 112.022 -178.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.5 tpp180 . . . . . 0 C--O 1.232 0.157 0 CA-C-N 118.328 0.513 . . . . 0.0 112.003 176.852 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.534 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.296 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.6 p -52.53 -29.08 23.41 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -175.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.65 -44.57 85.97 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 118.842 0.746 . . . . 0.0 109.802 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -67.58 -30.44 70.05 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 120.99 0.424 . . . . 0.0 110.041 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.5 -43.63 80.42 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.344 -178.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.0 mt -63.66 -43.06 97.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 108.741 -0.836 . . . . 0.0 108.741 173.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -60.71 -32.76 71.99 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-O 120.572 0.225 . . . . 0.0 110.774 178.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.9 m -74.18 -40.25 62.65 Favored 'General case' 0 C--N 1.338 0.087 0 O-C-N 121.851 -0.531 . . . . 0.0 110.837 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 44.2 mt -61.56 -30.67 70.81 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 119.637 -0.825 . . . . 0.0 108.884 172.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.12 -14.6 18.7 Favored Glycine 0 CA--C 1.531 1.065 0 CA-C-O 119.027 -0.874 . . . . 0.0 114.019 178.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -102.48 -3.87 26.24 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 118.921 1.36 . . . . 0.0 112.307 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.494 HG21 HD13 ' A' ' 51' ' ' ILE . 27.8 m -123.9 -18.98 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.508 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.2 tp -49.99 -27.46 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 123.846 0.859 . . . . 0.0 112.796 -178.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -63.38 -46.54 86.02 Favored 'General case' 0 N--CA 1.453 -0.289 0 O-C-N 122.008 -0.433 . . . . 0.0 110.988 178.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -74.26 -39.04 63.27 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -178.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 97.1 mt -62.4 -51.02 69.22 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.419 -177.209 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.424 ' O ' HG13 ' A' ' 113' ' ' ILE . 78.5 mt -66.3 -59.15 3.99 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.391 -0.814 . . . . 0.0 109.806 177.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.1 p -48.5 -46.04 37.85 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.526 1.057 . . . . 0.0 112.361 -175.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 -70.97 -45.57 63.85 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 119.192 0.906 . . . . 0.0 111.0 179.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.93 -37.83 74.8 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 119.02 -0.514 . . . . 0.0 112.035 -178.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -82.51 -32.29 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.154 0 C-N-CA 119.312 -0.955 . . . . 0.0 111.888 176.901 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.9 -29.45 66.64 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.469 -179.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.9 -16.56 53.26 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 122.853 0.461 . . . . 0.0 110.754 176.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 15.7 m -77.52 157.91 30.17 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -172.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -95.02 178.7 5.47 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 169.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -55.66 -39.58 71.1 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.64 -0.663 . . . . 0.0 111.949 -177.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -69.84 -37.25 76.12 Favored 'General case' 0 N--CA 1.456 -0.154 0 O-C-N 121.792 -0.567 . . . . 0.0 110.842 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -77.0 -39.15 51.44 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.169 -0.444 . . . . 0.0 111.322 -176.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.66 -34.35 78.0 Favored 'General case' 0 CA--C 1.522 -0.118 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 174.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -63.42 -45.06 92.72 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.478 176.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -61.95 -41.25 97.76 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.994 0.361 . . . . 0.0 111.436 177.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 95.6 mt -68.04 -40.58 83.37 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.117 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.6 tmm_? -62.51 -43.2 99.39 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 178.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -61.61 -45.68 93.04 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.387 0.675 . . . . 0.0 110.681 179.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.0 tt -60.49 -46.23 90.89 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.462 0.305 . . . . 0.0 110.458 177.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 98.1 mt -69.19 -29.98 68.07 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 119.796 -0.145 . . . . 0.0 111.363 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 29.1 t70 . . . . . 0 N--CA 1.453 -0.276 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 177.215 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 160' ' ' PRO . . . . . 0.425 ' HD2' ' N ' ' A' ' 27' ' ' SER . 67.1 Cg_endo . . . . . 0 N--CA 1.455 -0.785 0 N-CA-C 109.167 -1.128 . . . . 0.0 109.167 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 79.5 p -63.46 152.78 37.41 Favored 'General case' 0 N--CA 1.455 -0.186 0 O-C-N 121.983 -0.448 . . . . 0.0 110.451 179.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 162' ' ' TYR . . . . . 0.469 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 10.1 t80 -141.78 136.99 31.25 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.41 0.284 . . . . 0.0 111.439 -178.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 31.3 t -133.15 143.96 50.62 Favored Pre-proline 0 N--CA 1.455 -0.214 0 C-N-CA 123.262 0.625 . . . . 0.0 110.815 178.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -58.6 -11.29 11.07 Favored 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 123.251 2.634 . . . . 0.0 112.653 173.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 69.9 p . . . . . 0 CA--C 1.529 0.153 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.199 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.445 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 17.5 t70 . . . . . 0 CA--C 1.535 0.394 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.445 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 10.9 t80 -55.34 -15.1 2.22 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 121.712 -0.618 . . . . 0.0 111.386 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -55.27 -36.39 66.06 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 123.392 0.677 . . . . 0.0 110.681 175.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 42.9 m-20 -66.55 -44.86 81.21 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 118.952 0.796 . . . . 0.0 109.999 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -65.95 -47.85 73.3 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 117.903 0.32 . . . . 0.0 110.719 -176.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 98.6 t -65.27 -55.57 19.66 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -179.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.64 -31.07 65.91 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -178.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 62.3 m -74.6 -42.01 59.42 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 118.11 0.414 . . . . 0.0 111.051 177.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.7 tp -67.62 -31.08 70.86 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -68.76 -42.34 77.63 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.852 0.861 . . . . 0.0 109.653 174.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.0 t -62.84 -29.36 70.68 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 174.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.471 ' CD2' HD11 ' A' ' 68' ' ' ILE . 0.1 OUTLIER -72.75 -36.61 67.74 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.182 0.193 . . . . 0.0 110.538 176.232 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt . . . . . 0 CA--C 1.529 0.161 0 C-N-CA 122.435 0.294 . . . . 0.0 110.217 175.653 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.2 mm . . . . . 0 CA--C 1.528 0.098 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.8 m -136.84 138.07 40.4 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.806 0.336 . . . . 0.0 110.588 179.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.76 -21.55 65.35 Favored Glycine 0 CA--C 1.523 0.538 0 CA-C-O 119.11 -0.828 . . . . 0.0 112.751 -178.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.417 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 59.6 p -66.19 -45.67 80.0 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.838 1.319 . . . . 0.0 110.907 -175.32 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.43 ' HB3' ' CD2' ' A' ' 17' ' ' PHE . 8.4 mpt_? -68.06 -41.47 81.95 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 74.3 mt -61.68 -39.49 83.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.2 mmtt -63.57 -45.55 89.92 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.556 0.742 . . . . 0.0 110.759 179.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.59 -39.09 91.21 Favored 'General case' 0 C--N 1.339 0.125 0 CA-C-N 118.226 0.466 . . . . 0.0 111.715 179.325 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 93.0 mt -65.79 -53.86 34.71 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 119.408 -0.33 . . . . 0.0 111.249 -179.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.427 HG21 ' HB2' ' A' ' 71' ' ' SER . 41.1 p -57.81 -41.25 81.79 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 118.491 0.587 . . . . 0.0 110.959 177.056 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.1 m -55.85 -57.78 10.63 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.307 179.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -68.67 -31.29 70.3 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 118.993 -1.083 . . . . 0.0 111.777 -175.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.84 -59.2 5.59 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.304 0.502 . . . . 0.0 109.739 174.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.469 HD21 ' HB1' ' A' ' 75' ' ' ALA . 8.7 mp -72.06 -14.35 61.84 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -177.152 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -57.76 -26.73 62.27 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -179.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -151.97 -24.4 0.18 Allowed 'General case' 0 C--N 1.339 0.135 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -177.288 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.542 HG22 HG22 ' A' ' 93' ' ' THR . 25.8 mm 44.2 73.06 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-O 121.708 0.766 . . . . 0.0 111.186 -177.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -147.89 22.19 1.11 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.936 0.894 . . . . 0.0 109.556 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.549 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.3 pt -148.51 35.46 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 C-N-CA 124.562 1.145 . . . . 0.0 109.354 -170.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.425 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -50.99 -55.5 17.05 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 123.887 0.875 . . . . 0.0 113.262 -176.015 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 57.5 p -75.61 -28.32 58.82 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -173.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.673 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -79.51 -45.82 18.59 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -179.833 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 14.8 mt -55.69 -50.26 68.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 118.019 0.372 . . . . 0.0 110.169 172.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.443 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 12.9 mm -66.74 -50.2 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.225 0 CA-C-O 119.341 -0.361 . . . . 0.0 111.894 -176.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.4 m -57.07 -34.28 68.12 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 118.962 0.801 . . . . 0.0 110.491 178.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.3 tp -70.06 -45.02 67.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -179.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 38.2 pt -72.01 -32.57 44.37 Favored 'Isoleucine or valine' 0 C--N 1.341 0.202 0 CA-C-N 119.472 1.033 . . . . 0.0 111.848 -179.512 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.481 HD13 HG21 ' A' ' 104' ' ' VAL . 92.7 mt -66.53 -48.46 80.42 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.329 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -63.8 -25.81 68.34 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.876 177.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -66.37 -43.57 85.6 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 173.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.5 m -59.36 -38.07 79.48 Favored 'General case' 0 C--N 1.341 0.229 0 O-C-N 122.15 -0.344 . . . . 0.0 110.645 174.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -68.17 -43.17 78.79 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.35 1.06 . . . . 0.0 112.859 -177.109 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 73.4 mt -89.55 -15.26 33.3 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -173.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 86.2 m -104.11 159.13 30.33 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -171.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -57.11 177.45 0.19 Allowed 'Trans proline' 0 N--CA 1.46 -0.468 1 C-N-CA 125.524 4.149 . . . . 0.0 115.071 179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.446 ' HB3' ' HE3' ' A' ' 115' ' ' LYS . 72.3 m-20 -58.06 -47.26 83.68 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.19 1.396 . . . . 0.0 112.873 -178.024 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.9 m -60.06 -25.14 65.13 Favored 'General case' 0 N--CA 1.457 -0.096 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 6.2 m80 -86.92 -14.8 40.81 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.707 -0.663 . . . . 0.0 111.172 178.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -72.87 -43.53 62.45 Favored 'General case' 0 C--N 1.342 0.245 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 170.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.2 tp -65.61 -45.4 83.28 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.869 174.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.93 -42.37 98.22 Favored Glycine 0 C--N 1.336 0.534 0 N-CA-C 111.294 -0.723 . . . . 0.0 111.294 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 89.3 p -67.18 -35.55 79.88 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 117.623 0.712 . . . . 0.0 110.292 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 33.7 mt -60.65 -39.01 86.75 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 119.267 -0.973 . . . . 0.0 110.285 173.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -67.31 -35.72 80.01 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.476 1.035 . . . . 0.0 111.772 176.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.471 HD11 ' CD2' ' A' ' 17' ' ' PHE . 87.2 mt -69.03 -45.68 79.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 O-C-N 121.705 -0.622 . . . . 0.0 111.144 176.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 72.9 mt -63.24 -32.94 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 C-N-CA 123.619 0.768 . . . . 0.0 109.263 177.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -71.42 -40.43 70.46 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.188 0.595 . . . . 0.0 110.44 177.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.427 ' HB2' HG21 ' A' ' 33' ' ' THR . 98.6 p -69.45 -54.37 14.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 119.165 0.893 . . . . 0.0 110.523 -177.336 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 39.7 mt -65.07 -33.83 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 117.76 0.255 . . . . 0.0 110.555 176.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.57 -53.01 38.01 Favored Glycine 0 C--N 1.337 0.626 0 N-CA-C 111.909 -0.476 . . . . 0.0 111.909 -179.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.3 mtp-105 -66.49 -36.13 81.98 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 117.308 0.554 . . . . 0.0 110.445 178.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.469 ' HB1' HD21 ' A' ' 37' ' ' LEU . . . -65.45 -45.95 81.79 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 178.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.8 m-30 -62.94 -44.87 94.89 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 175.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.1 tp -55.96 -44.89 78.92 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 -177.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -69.64 -39.98 76.8 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.806 178.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -70.26 -15.02 62.85 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -178.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.6 t -107.48 -19.09 13.68 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.876 0.762 . . . . 0.0 111.928 173.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 . . . . . 0 C--N 1.34 0.193 0 C-N-CA 123.026 0.53 . . . . 0.0 111.697 177.72 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.542 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.262 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.8 p -50.49 -29.49 10.59 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -176.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.22 -45.73 86.95 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.851 0.75 . . . . 0.0 109.872 175.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 27.8 m80 -68.4 -28.6 67.24 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.311 177.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.443 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -65.25 -46.26 81.26 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 178.187 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 95.0 mt -63.32 -42.73 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.077 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 175.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -61.81 -33.0 73.35 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 122.359 -0.213 . . . . 0.0 111.261 179.115 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.8 m -74.35 -41.09 61.63 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.552 -0.261 . . . . 0.0 110.96 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 45.5 mt -60.87 -31.05 70.52 Favored 'General case' 0 C--O 1.226 -0.158 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 173.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.8 -14.4 9.89 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-O 119.021 -0.877 . . . . 0.0 113.813 178.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -103.41 -4.93 23.44 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.177 1.488 . . . . 0.0 112.371 -179.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.481 HG21 HD13 ' A' ' 51' ' ' ILE . 32.4 m -123.18 -18.18 4.43 Favored 'Isoleucine or valine' 0 C--N 1.339 0.141 0 C-N-CA 122.824 0.45 . . . . 0.0 111.964 -179.168 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.8 tp -50.94 -25.2 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 C-N-CA 123.984 0.913 . . . . 0.0 112.601 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -64.86 -49.15 71.67 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 118.079 0.399 . . . . 0.0 111.52 178.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -69.6 -39.85 77.0 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 -177.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 10.7 mp -66.33 -50.91 61.98 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.189 -176.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 65.8 mt -63.99 -60.75 2.87 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 118.767 -0.635 . . . . 0.0 109.78 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 89.4 p -54.88 -41.91 71.45 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 118.622 -1.231 . . . . 0.0 112.318 -172.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -69.79 -40.68 75.86 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-N 119.413 1.006 . . . . 0.0 111.385 178.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.34 -42.62 96.06 Favored 'General case' 0 N--CA 1.457 -0.102 0 CA-C-N 118.531 0.605 . . . . 0.0 110.618 -179.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -38.57 53.53 Favored 'Isoleucine or valine' 0 C--N 1.338 0.093 0 C-N-CA 120.003 -0.679 . . . . 0.0 111.636 178.58 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.99 -25.36 66.27 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 119.607 -0.837 . . . . 0.0 110.094 178.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.446 ' HE3' ' HB3' ' A' ' 59' ' ' ASP . 7.8 tmtt? -75.32 -23.12 57.25 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 125.018 1.327 . . . . 0.0 111.144 175.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.401 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 55.7 p -86.14 159.68 19.46 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -170.151 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.7 p30 -102.33 -175.02 2.71 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 170.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -55.75 -39.01 70.57 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.996 0.816 . . . . 0.0 112.445 -177.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -70.73 -46.4 63.1 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 121.54 -0.725 . . . . 0.0 110.45 -178.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.401 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 35.9 m170 -72.37 -32.49 66.48 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 119.106 -0.474 . . . . 0.0 111.257 -178.085 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -37.65 82.79 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 176.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -62.67 -41.94 99.35 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 110.248 -0.279 . . . . 0.0 110.248 177.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -61.79 -41.5 97.81 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 117.827 0.285 . . . . 0.0 111.072 176.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.5 mt -69.51 -39.02 78.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 CA-C-N 118.004 0.366 . . . . 0.0 110.196 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 37.9 ttt180 -63.86 -40.74 97.27 Favored 'General case' 0 C--O 1.23 0.068 0 C-N-CA 122.56 0.344 . . . . 0.0 110.47 178.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 16.0 tmm? -68.01 -41.97 81.38 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 122.701 0.4 . . . . 0.0 110.253 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.1 tt -60.34 -43.62 96.27 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 176.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 86.2 mt -70.8 -30.27 66.68 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 119.524 -0.274 . . . . 0.0 111.468 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.6 t70 . . . . . 0 N--CA 1.452 -0.342 0 CA-C-N 118.334 0.515 . . . . 0.0 109.96 177.007 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 160' ' ' PRO . . . . . 0.417 ' HD2' ' N ' ' A' ' 27' ' ' SER . 58.6 Cg_endo . . . . . 0 N--CA 1.456 -0.687 0 N-CA-C 110.452 -0.634 . . . . 0.0 110.452 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . 0.406 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 36.8 t -171.55 141.13 1.46 Allowed 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.695 1.198 . . . . 0.0 108.415 174.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -156.54 133.31 10.26 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 118.362 0.528 . . . . 0.0 112.12 174.117 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 25.8 t -134.67 144.63 51.53 Favored Pre-proline 0 N--CA 1.454 -0.228 0 C-N-CA 123.765 0.826 . . . . 0.0 110.76 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -66.65 -1.62 6.12 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.257 2.638 . . . . 0.0 111.638 177.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 34.9 p . . . . . 0 C--N 1.338 0.093 0 O-C-N 121.845 -0.534 . . . . 0.0 112.042 177.804 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 32.8 t70 . . . . . 0 CA--C 1.531 0.232 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -57.11 -17.81 12.21 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.109 0.413 . . . . 0.0 111.196 176.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.4 tp60 -56.61 -45.31 81.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.218 -0.42 . . . . 0.0 110.31 175.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -57.51 -39.98 77.71 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.306 176.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -64.35 -54.04 39.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.888 0.767 . . . . 0.0 110.766 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 59.4 t -63.5 -50.44 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.179 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 -178.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.72 -32.26 69.03 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 123.268 0.627 . . . . 0.0 111.432 -179.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 52.3 m -72.27 -43.91 63.6 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 122.025 -0.422 . . . . 0.0 110.145 176.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 21.0 tp -64.73 -29.33 70.31 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 120.426 -0.51 . . . . 0.0 109.999 179.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -70.44 -41.81 72.35 Favored 'General case' 0 C--N 1.338 0.074 0 C-N-CA 123.667 0.787 . . . . 0.0 110.57 175.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.9 p -63.96 -29.0 70.2 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.067 174.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -33.41 63.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.316 0.647 . . . . 0.0 110.241 174.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt . . . . . 0 C--N 1.339 0.123 0 C-N-CA 123.384 0.674 . . . . 0.0 110.514 178.291 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.4 mm . . . . . 0 CA--C 1.533 0.306 0 CA-C-O 120.8 0.333 . . . . 0.0 110.699 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.0 t -59.5 137.73 57.92 Favored 'General case' 0 C--O 1.23 0.073 0 CA-C-O 120.968 0.413 . . . . 0.0 111.719 -175.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.95 -23.1 67.3 Favored Glycine 0 CA--C 1.526 0.721 0 CA-C-O 119.27 -0.739 . . . . 0.0 113.715 -173.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.465 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 38.5 t -59.01 -40.82 86.12 Favored 'General case' 0 N--CA 1.458 -0.065 0 CA-C-N 118.658 1.229 . . . . 0.0 110.633 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -69.45 -39.05 78.01 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -178.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 69.4 mt -65.61 -36.19 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -69.17 -36.06 76.97 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 119.459 -0.305 . . . . 0.0 111.369 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.465 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -65.85 -44.48 85.37 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 118.332 0.514 . . . . 0.0 110.342 174.626 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.7 mt -62.56 -52.33 63.86 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 122.291 -0.256 . . . . 0.0 110.957 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.431 HG21 ' HB2' ' A' ' 71' ' ' SER . 27.3 p -59.77 -50.72 72.7 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 118.413 0.552 . . . . 0.0 111.936 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.3 t -61.26 -45.13 95.76 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 120.092 -0.643 . . . . 0.0 111.623 -174.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -75.63 -21.46 57.7 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -178.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.06 -57.12 8.45 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 119.172 0.897 . . . . 0.0 109.031 167.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.3 mp -69.05 -14.75 63.21 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -177.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -64.94 -16.83 63.78 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.991 0.814 . . . . 0.0 113.065 178.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -140.4 -41.63 0.42 Allowed 'General case' 0 C--N 1.34 0.185 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -178.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.541 HG22 HG22 ' A' ' 93' ' ' THR . 44.8 mm 43.06 67.0 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-O 122.352 1.072 . . . . 0.0 111.07 -172.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -147.34 20.65 1.21 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 114.709 -1.132 . . . . 0.0 108.865 179.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.603 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.38 33.85 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 C-N-CA 125.157 1.383 . . . . 0.0 109.456 -171.471 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.519 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.3 OUTLIER -49.57 -55.64 12.77 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -177.131 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 83.6 p -75.38 -24.73 57.28 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -173.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.638 ' H ' ' HD3' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -84.95 -42.72 14.68 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 -179.511 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 30.8 mt -56.21 -52.82 46.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 118.277 0.489 . . . . 0.0 109.752 171.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.439 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 15.4 mm -66.17 -48.94 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 CA-C-O 119.335 -0.364 . . . . 0.0 111.643 -177.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.0 t -56.53 -37.15 70.08 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 119.891 -0.724 . . . . 0.0 110.101 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.3 tp -70.55 -40.19 73.51 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 118.624 -0.703 . . . . 0.0 112.782 -177.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.8 pt -73.67 -37.52 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 119.775 1.17 . . . . 0.0 111.965 178.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.432 HD13 HG21 ' A' ' 104' ' ' VAL . 93.9 mt -63.4 -49.2 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.099 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -59.41 -41.43 89.48 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.855 177.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -55.73 -40.12 72.04 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 176.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.6 t -68.0 -53.63 24.53 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 179.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -68.63 -24.6 64.58 Favored 'General case' 0 C--O 1.228 -0.074 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -172.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 47.1 mt -80.56 -15.89 55.54 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 83.1 m -121.74 164.26 26.07 Favored Pre-proline 0 CA--C 1.536 0.426 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -169.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_exo -55.57 -177.83 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.407 1 C-N-CA 126.001 4.467 . . . . 0.0 116.072 -179.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -56.19 -40.44 73.97 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 125.611 1.565 . . . . 0.0 113.427 -176.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 74.9 m -61.5 -23.1 65.67 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 19.3 m80 -87.59 -23.63 24.24 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 118.906 -0.568 . . . . 0.0 110.928 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -67.18 -42.21 84.61 Favored 'General case' 0 C--N 1.343 0.321 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 169.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.7 tp -66.84 -51.99 48.92 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 120.915 0.388 . . . . 0.0 110.365 177.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.43 -39.65 90.91 Favored Glycine 0 C--N 1.336 0.574 0 N-CA-C 110.246 -1.142 . . . . 0.0 110.246 178.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 40.1 t -63.24 -45.65 90.6 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 117.483 0.641 . . . . 0.0 110.767 178.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 33.9 mt -57.93 -38.2 75.5 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 118.854 0.752 . . . . 0.0 111.403 178.146 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -74.45 -31.51 62.29 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 119.492 -0.883 . . . . 0.0 112.16 178.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 81.0 mt -73.47 -41.65 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 118.92 0.782 . . . . 0.0 110.669 176.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.8 mt -62.71 -40.06 87.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 176.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -66.8 -42.77 85.42 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 119.278 -0.391 . . . . 0.0 110.959 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.431 ' HB2' HG21 ' A' ' 33' ' ' THR . 84.1 p -66.93 -56.52 9.88 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 118.338 0.517 . . . . 0.0 111.148 -174.789 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 38.3 mt -65.19 -31.17 52.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 176.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.89 -52.92 37.64 Favored Glycine 0 CA--C 1.522 0.489 0 CA-C-O 119.751 -0.471 . . . . 0.0 112.191 -179.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.661 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -72.28 -31.1 65.44 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 117.992 0.896 . . . . 0.0 110.824 -179.242 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.74 -46.61 74.87 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 176.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -62.32 -45.23 94.15 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 175.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -57.34 -43.08 83.12 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -178.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -67.16 -41.17 86.45 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 121.38 -0.128 . . . . 0.0 110.902 178.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -64.58 -40.41 95.48 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 119.51 -0.281 . . . . 0.0 111.227 -178.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.3 t -82.78 -18.85 39.14 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 118.192 0.451 . . . . 0.0 111.496 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 56.6 ttp180 . . . . . 0 N--CA 1.455 -0.194 0 O-C-N 122.078 -0.389 . . . . 0.0 110.417 171.78 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.541 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.195 0 CA-C-O 119.718 -0.182 . . . . 0.0 110.528 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 26.7 p -47.91 -32.64 6.57 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 -176.204 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.76 -46.9 80.2 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.582 -0.699 . . . . 0.0 110.137 176.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 67.2 m80 -67.24 -28.78 68.33 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.299 0.639 . . . . 0.0 110.202 177.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.439 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -66.22 -45.45 80.64 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 122.434 0.294 . . . . 0.0 110.546 177.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 93.3 mt -62.89 -42.41 96.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 175.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -61.48 -33.69 74.2 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.779 -0.191 . . . . 0.0 111.389 178.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.3 m -73.21 -42.29 62.81 Favored 'General case' 0 C--O 1.227 -0.084 0 C-N-CA 122.332 0.253 . . . . 0.0 111.185 179.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 44.9 mt -60.85 -30.78 70.32 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 173.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.17 -14.65 19.22 Favored Glycine 0 CA--C 1.534 1.237 0 CA-C-O 118.826 -0.986 . . . . 0.0 113.81 178.095 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -100.59 -6.92 24.6 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 119.061 1.431 . . . . 0.0 111.805 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.432 HG21 HD13 ' A' ' 51' ' ' ILE . 35.3 m -121.15 -18.31 5.35 Favored 'Isoleucine or valine' 0 C--N 1.338 0.108 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.422 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.7 tp -53.69 -26.03 12.74 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 C-N-CA 122.92 0.488 . . . . 0.0 111.817 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.4 pt20 -59.49 -61.42 2.64 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 122.77 0.428 . . . . 0.0 110.614 176.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -71.13 -28.27 64.17 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.929 -0.482 . . . . 0.0 111.332 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.51 -55.67 25.25 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.38 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 59.9 mt -62.95 -58.14 8.36 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 118.44 -0.791 . . . . 0.0 110.428 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 91.1 p -55.27 -43.13 74.43 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 118.857 -1.137 . . . . 0.0 112.133 -172.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -70.69 -41.67 71.7 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 119.237 0.926 . . . . 0.0 111.077 177.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.17 -37.25 71.82 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 119.157 -0.449 . . . . 0.0 111.359 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -80.91 -35.31 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.101 0 C-N-CA 119.572 -0.851 . . . . 0.0 112.135 175.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.09 -25.4 65.31 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 119.813 -0.755 . . . . 0.0 111.125 -178.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.52 -14.3 38.08 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.293 0.637 . . . . 0.0 111.225 177.008 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.435 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 46.3 p -71.42 156.49 39.41 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -170.462 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 68.4 m-20 -96.36 177.89 5.55 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 106.908 -1.515 . . . . 0.0 106.908 168.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -56.26 -45.1 80.19 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.738 0.699 . . . . 0.0 111.149 -177.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -64.99 -41.13 95.68 Favored 'General case' 0 CA--C 1.53 0.173 0 O-C-N 121.974 -0.454 . . . . 0.0 110.481 -179.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.435 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 31.6 m170 -69.42 -37.35 77.41 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 119.295 -0.383 . . . . 0.0 110.882 -178.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -41.16 96.83 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 174.551 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -64.4 -39.54 94.06 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.568 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -64.21 -41.08 97.21 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 121.15 -0.22 . . . . 0.0 111.19 176.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.9 mt -69.8 -37.39 73.34 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.087 0 CA-C-N 118.281 0.492 . . . . 0.0 109.719 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 80.5 ttt-85 -64.8 -38.1 89.84 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 177.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 65.6 ttp -66.05 -40.76 91.23 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 55.1 tp -60.4 -44.62 95.51 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 110.53 -0.174 . . . . 0.0 110.53 178.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.9 mt -68.06 -35.59 78.47 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 122.094 0.158 . . . . 0.0 111.028 179.039 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.8 t70 . . . . . 0 N--CA 1.455 -0.199 0 N-CA-C 110.332 -0.248 . . . . 0.0 110.332 178.567 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo . . . . . 0 N--CA 1.454 -0.84 0 N-CA-C 109.806 -0.882 . . . . 0.0 109.806 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 47.5 m -68.01 155.18 40.07 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 174.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 162' ' ' TYR . . . . . 0.416 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 15.8 t80 -139.95 127.42 21.5 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 120.574 0.225 . . . . 0.0 110.938 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.9 t -124.17 124.54 25.88 Favored Pre-proline 0 C--O 1.234 0.276 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.543 177.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.18 -12.66 35.8 Favored 'Trans proline' 0 N--CA 1.449 -1.143 0 C-N-CA 122.386 2.057 . . . . 0.0 109.828 -179.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 22.5 m . . . . . 0 C--N 1.34 0.178 0 C-N-CA 123.536 0.735 . . . . 0.0 111.853 -174.914 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 . . . . . 0 CA--C 1.532 0.274 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -55.41 -15.42 2.62 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.179 0.592 . . . . 0.0 111.714 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 34.3 tp60 -55.27 -41.26 71.99 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.137 0.575 . . . . 0.0 110.362 176.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -63.96 -37.89 89.08 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 118.246 0.475 . . . . 0.0 110.615 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -64.72 -55.38 20.29 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.536 0.607 . . . . 0.0 109.899 179.19 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 66.5 t -60.72 -53.08 53.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -177.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.53 -35.73 70.66 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.118 0.567 . . . . 0.0 111.627 -178.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 77.5 m -69.12 -44.95 71.36 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-N 118.352 0.524 . . . . 0.0 110.452 177.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 20.7 tp -66.46 -29.16 69.23 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.487 -179.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.4 -45.16 66.52 Favored 'General case' 0 CA--C 1.523 -0.079 0 C-N-CA 123.787 0.835 . . . . 0.0 109.85 177.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 72.8 m -61.44 -29.35 69.89 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 173.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.86 -32.47 61.9 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 120.601 0.238 . . . . 0.0 110.623 175.494 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt . . . . . 0 N--CA 1.456 -0.126 0 C-N-CA 123.348 0.659 . . . . 0.0 110.57 179.531 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.6 mm . . . . . 0 C--O 1.231 0.108 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 42.9 t -138.98 121.67 16.37 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.72 -20.08 63.64 Favored Glycine 0 CA--C 1.523 0.562 0 CA-C-O 119.229 -0.762 . . . . 0.0 112.208 -176.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.445 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 47.7 t -65.42 -42.34 92.58 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 118.611 1.205 . . . . 0.0 109.853 177.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.4 mmp_? -60.42 -48.16 82.94 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 176.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.5 mt -63.15 -34.33 66.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.201 -177.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 23.0 mmtp -69.1 -39.67 78.85 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 118.83 -0.605 . . . . 0.0 110.777 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.445 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.3 OUTLIER -65.22 -42.58 93.29 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.359 0.982 . . . . 0.0 110.225 175.296 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.5 mt -62.45 -56.91 13.65 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 122.487 -0.133 . . . . 0.0 110.82 -178.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.555 HG21 ' HB2' ' A' ' 71' ' ' SER . 41.6 p -55.29 -42.97 74.34 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 121.986 -0.447 . . . . 0.0 111.593 176.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.9 m -55.37 -55.92 26.06 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 119.279 -0.391 . . . . 0.0 111.131 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -79.07 -18.54 53.24 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -173.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.26 -56.0 8.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 119.041 0.837 . . . . 0.0 109.15 167.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 50.0 mt -72.92 -14.58 61.5 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.913 0.885 . . . . 0.0 113.154 -174.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -55.37 -30.33 60.14 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -178.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -153.1 -20.78 0.15 Allowed 'General case' 0 C--N 1.341 0.214 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 -178.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.491 HG22 HG22 ' A' ' 93' ' ' THR . 35.0 mm 45.75 74.15 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-O 121.837 0.827 . . . . 0.0 111.173 -177.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -134.52 6.74 3.53 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.177 0.991 . . . . 0.0 109.835 178.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.491 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -142.5 108.64 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 124.888 1.275 . . . . 0.0 108.359 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.57 ' CD ' ' H ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -102.13 -82.77 0.47 Allowed 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -178.54 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.57 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 99.2 p -55.86 -24.48 37.09 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 123.504 0.722 . . . . 0.0 112.569 -174.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.641 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -70.86 -56.42 6.33 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 177.812 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.432 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 6.5 mt -57.52 -40.64 75.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 123.179 0.591 . . . . 0.0 110.556 175.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 14.8 mm -69.68 -51.71 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-O 119.275 -0.393 . . . . 0.0 111.481 -178.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.4 m -60.63 -27.13 67.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 118.821 0.737 . . . . 0.0 110.03 177.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.9 tp -70.39 -45.01 66.83 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 118.72 -0.657 . . . . 0.0 111.778 178.265 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 25.7 pt -74.91 -33.83 31.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 119.581 1.082 . . . . 0.0 111.437 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.41 HD13 HG21 ' A' ' 104' ' ' VAL . 96.2 mt -65.63 -52.19 53.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -65.18 -29.46 70.28 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.071 178.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -59.13 -42.54 90.87 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 173.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.6 m -58.33 -49.36 77.47 Favored 'General case' 0 C--N 1.338 0.093 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 174.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 52.5 tpt85 -56.15 -30.55 62.35 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.803 0.841 . . . . 0.0 112.486 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 80.3 mt -90.59 -14.59 32.15 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -179.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 50.7 m -97.05 159.01 32.38 Favored Pre-proline 0 CA--C 1.531 0.231 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -171.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -75.79 -139.54 0.02 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.707 1 C-N-CA 125.723 4.282 . . . . 0.0 109.063 172.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -56.12 -19.6 13.96 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.002 0.819 . . . . 0.0 112.125 178.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.8 m -59.46 -25.69 64.61 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.755 0.422 . . . . 0.0 109.961 173.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -55.28 -64.64 0.78 Allowed 'General case' 0 C--N 1.341 0.204 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 172.543 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.3 ttpt -50.44 -75.68 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.871 -179.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 33.0 tp -74.27 -43.14 58.14 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 119.102 -1.039 . . . . 0.0 111.639 -168.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.57 -48.32 44.28 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -174.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.9 m -70.66 -38.61 73.8 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 118.504 -1.278 . . . . 0.0 110.041 -178.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 66' ' ' LEU . 60.7 mt -58.26 -42.08 85.69 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 118.293 -1.363 . . . . 0.0 110.826 177.32 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -68.66 -40.03 80.38 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.324 0.966 . . . . 0.0 112.168 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 79.0 mt -66.89 -42.09 88.52 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-N 118.395 0.543 . . . . 0.0 111.15 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.2 mt -66.89 -29.94 47.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -76.75 -37.85 55.2 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-O 119.041 -0.504 . . . . 0.0 111.975 178.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.555 ' HB2' HG21 ' A' ' 33' ' ' THR . 61.2 p -70.78 -52.68 19.09 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 119.286 0.948 . . . . 0.0 110.324 178.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 53.1 mt -67.81 -36.21 75.05 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 178.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.9 -46.79 64.45 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 -178.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 28.2 mtt-85 -63.05 -43.51 98.44 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 117.623 0.711 . . . . 0.0 109.942 176.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.33 -40.54 93.82 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.769 -0.196 . . . . 0.0 110.694 -178.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -63.96 -45.62 88.3 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 175.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.8 tp -57.88 -41.62 82.91 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 -177.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -67.94 -41.36 82.66 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 117.725 0.238 . . . . 0.0 110.397 177.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -60.07 -39.72 87.02 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.877 -0.147 . . . . 0.0 111.074 -177.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 9.3 t -87.31 -20.34 26.94 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 117.995 0.362 . . . . 0.0 111.702 178.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 67.2 ttp85 . . . . . 0 CA--C 1.529 0.166 0 CA-C-N 118.371 0.532 . . . . 0.0 110.185 174.047 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.491 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.393 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 28.6 p -49.3 -30.31 7.25 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -175.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.4 -46.69 79.03 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 118.787 0.722 . . . . 0.0 110.073 177.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 43.0 t60 -69.52 -27.53 65.26 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 121.038 0.447 . . . . 0.0 110.21 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.09 -42.69 79.97 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.185 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.3 mt -64.77 -41.78 93.14 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.163 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 173.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -59.82 -33.3 71.57 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 110.782 -0.081 . . . . 0.0 110.782 178.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 88.6 m -75.57 -42.72 51.41 Favored 'General case' 0 N--CA 1.457 -0.075 0 CA-C-O 119.526 -0.273 . . . . 0.0 111.026 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 49.6 mt -60.54 -29.02 68.87 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 173.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.4 -15.38 31.28 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-O 119.154 -0.803 . . . . 0.0 113.563 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -98.28 -6.28 31.36 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.961 1.38 . . . . 0.0 111.684 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.41 HG21 HD13 ' A' ' 51' ' ' ILE . 31.1 m -123.71 -22.68 2.66 Favored 'Isoleucine or valine' 0 C--O 1.23 0.027 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -178.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.42 HD12 ' HA ' ' A' ' 105' ' ' ILE . 11.0 tp -55.87 -26.49 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 C-N-CA 122.935 0.494 . . . . 0.0 111.44 -177.237 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -61.93 -59.08 5.65 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.144 0.578 . . . . 0.0 111.198 178.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -73.75 -29.87 62.47 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 122.168 0.187 . . . . 0.0 110.766 -179.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.0 tt -63.03 -56.64 15.21 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.41 ' O ' HG13 ' A' ' 113' ' ' ILE . 49.5 mt -61.2 -57.98 10.2 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 118.695 -0.669 . . . . 0.0 110.261 176.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 55.9 p -54.84 -44.26 73.76 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 119.605 -0.838 . . . . 0.0 112.053 -172.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -69.04 -42.46 76.31 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-N 119.13 0.877 . . . . 0.0 110.794 177.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.28 -50.89 70.1 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.85 0.46 . . . . 0.0 111.603 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -69.94 -35.46 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 O-C-N 121.781 -0.575 . . . . 0.0 111.224 179.253 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.65 -24.6 64.56 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.05 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.62 -14.21 38.04 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.071 0.548 . . . . 0.0 110.827 178.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.436 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 29.5 p -79.46 157.4 27.51 Favored 'General case' 0 N--CA 1.457 -0.102 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 -171.274 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -90.16 173.42 8.18 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 172.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 85.2 mt-30 -55.56 -45.78 77.26 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.772 0.714 . . . . 0.0 111.679 -176.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -63.99 -39.03 93.21 Favored 'General case' 0 N--CA 1.454 -0.244 0 O-C-N 121.719 -0.613 . . . . 0.0 110.404 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.436 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 31.7 m170 -70.83 -45.43 64.56 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.125 -178.148 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -35.95 71.69 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-N 118.839 0.745 . . . . 0.0 109.984 174.542 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.31 -41.99 88.91 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.237 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.6 mtpp -61.57 -44.26 97.35 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.349 175.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 98.0 mt -65.28 -38.23 82.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 43.7 ttt85 -62.26 -39.34 92.57 Favored 'General case' 0 CA--C 1.521 -0.145 0 C-N-CA 122.693 0.397 . . . . 0.0 109.932 177.286 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 51.1 ttp -66.09 -44.03 85.56 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.547 -0.168 . . . . 0.0 110.547 178.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.3 mp -57.83 -46.34 84.86 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 177.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.9 mt -73.66 -32.7 64.13 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -177.052 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.0 t70 . . . . . 0 N--CA 1.455 -0.195 0 CA-C-N 118.673 0.67 . . . . 0.0 110.029 179.028 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo . . . . . 0 N--CA 1.458 -0.59 0 CA-C-O 120.797 0.249 . . . . 0.0 112.233 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 13.0 t -107.26 173.79 6.17 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.876 0.87 . . . . 0.0 111.713 -178.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -131.92 143.06 49.86 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 124.577 1.151 . . . . 0.0 109.265 176.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 26.7 t -121.25 137.07 26.32 Favored Pre-proline 0 N--CA 1.451 -0.386 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 176.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -66.47 -9.74 25.21 Favored 'Trans proline' 0 N--CA 1.447 -1.253 0 C-N-CA 122.912 2.408 . . . . 0.0 111.205 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 71.7 p . . . . . 0 C--N 1.34 0.166 0 CA-C-O 118.801 -0.619 . . . . 0.0 111.76 -178.251 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 . . . . . 0 N--CA 1.453 -0.311 0 N-CA-C 110.536 -0.172 . . . . 0.0 110.536 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -54.16 -14.49 1.13 Allowed 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.477 0.711 . . . . 0.0 110.58 175.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -54.7 -36.29 64.52 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 123.041 0.537 . . . . 0.0 110.352 174.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -56.76 -48.56 77.57 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-N 119.138 0.881 . . . . 0.0 109.812 176.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -65.3 -50.32 66.15 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 120.408 0.147 . . . . 0.0 111.2 -177.023 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 62.1 t -64.56 -53.08 46.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 O-C-N 122.368 -0.208 . . . . 0.0 110.488 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.65 -31.54 70.76 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 119.588 -0.244 . . . . 0.0 111.441 -178.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 53.3 m -71.46 -40.97 69.96 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.487 177.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.9 tp -66.37 -33.38 75.59 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -67.4 -42.62 83.0 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.894 0.878 . . . . 0.0 110.079 175.271 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 66.3 m -63.8 -27.47 69.21 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 174.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.425 ' CE2' HD11 ' A' ' 68' ' ' ILE . 0.1 OUTLIER -68.99 -39.59 79.26 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 175.199 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt . . . . . 0 C--N 1.341 0.227 0 C-N-CA 122.614 0.366 . . . . 0.0 111.02 175.144 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 17.1 mm . . . . . 0 CA--C 1.53 0.198 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.3 t -145.1 137.78 26.19 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 118.099 0.409 . . . . 0.0 111.067 -178.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -61.89 -37.97 95.24 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-O 119.267 -0.74 . . . . 0.0 112.793 -176.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.427 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 35.6 t -56.2 -44.06 79.08 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 118.438 1.119 . . . . 0.0 111.419 -173.417 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? -69.42 -44.85 70.55 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 -178.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 91.1 mt -58.52 -38.49 70.84 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.2 mmtp -73.39 -35.65 65.91 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-O 118.605 -0.712 . . . . 0.0 111.849 -178.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.427 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.1 OUTLIER -65.18 -38.47 90.61 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-N 119.516 1.053 . . . . 0.0 110.095 174.646 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.0 mt -64.06 -55.7 20.3 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 119.386 -0.34 . . . . 0.0 110.802 178.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.409 HG21 ' HB2' ' A' ' 71' ' ' SER . 41.3 p -58.01 -42.42 85.18 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 118.622 0.646 . . . . 0.0 111.066 177.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.3 m -55.65 -58.14 9.05 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 119.101 -0.476 . . . . 0.0 111.057 -179.071 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -69.12 -31.64 70.47 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 118.74 -1.184 . . . . 0.0 111.367 -175.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.54 -59.81 4.78 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.994 177.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.487 HD21 ' HB1' ' A' ' 75' ' ' ALA . 6.8 mp -68.93 -23.24 64.14 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 122.268 0.227 . . . . 0.0 111.525 -177.577 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -72.38 -18.77 61.71 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 122.205 -0.309 . . . . 0.0 111.26 176.023 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -148.6 52.53 0.99 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 117.758 0.254 . . . . 0.0 111.648 -175.142 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.508 HG22 HG22 ' A' ' 93' ' ' THR . 35.8 mm -62.84 80.96 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 121.494 0.664 . . . . 0.0 110.425 172.075 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -153.28 20.21 0.56 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.421 1.489 . . . . 0.0 108.541 175.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.579 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -148.94 34.89 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 C-N-CA 125.343 1.457 . . . . 0.0 109.114 -171.284 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.5 ' CD ' ' H ' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -49.28 -55.28 13.22 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -176.408 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 86.6 p -75.97 -24.27 55.4 Favored 'General case' 0 CA--C 1.522 -0.106 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -173.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.644 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -86.0 -39.16 17.15 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 119.286 -0.388 . . . . 0.0 110.108 -179.686 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 24.3 mt -59.11 -51.65 70.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.096 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 170.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.436 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 11.5 mm -65.55 -47.26 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-O 119.281 -0.39 . . . . 0.0 111.187 -178.122 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 48.3 t -55.82 -38.29 69.82 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.232 176.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.6 tp -68.54 -43.6 76.34 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 118.954 -0.546 . . . . 0.0 112.458 -177.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 38.5 pt -73.09 -37.31 52.77 Favored 'Isoleucine or valine' 0 C--N 1.343 0.286 0 CA-C-N 119.495 1.043 . . . . 0.0 111.993 -179.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.0 mt -64.26 -50.42 76.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.469 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 38.9 t70 -63.72 -31.05 72.1 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.451 178.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -58.98 -45.19 91.18 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 173.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.9 t -67.94 -31.3 70.94 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 111.656 0.243 . . . . 0.0 111.656 177.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.469 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 53.0 tpt85 -71.12 -36.29 72.08 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.911 0.884 . . . . 0.0 112.716 -177.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 78.5 mt -93.77 -14.71 25.93 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 -176.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 92.1 m -104.73 155.85 36.85 Favored Pre-proline 0 C--N 1.331 -0.206 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -171.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -66.11 -176.69 0.66 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 1 C-N-CA 125.349 4.033 . . . . 0.0 114.004 -178.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.405 ' HB3' ' HE3' ' A' ' 115' ' ' LYS . 53.0 m-20 -56.44 -44.44 80.45 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 125.654 1.582 . . . . 0.0 114.367 -172.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.4 p -57.45 -30.27 64.88 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 178.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -86.94 -13.4 44.79 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-O 118.472 -0.775 . . . . 0.0 111.62 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -74.19 -37.5 63.91 Favored 'General case' 0 C--N 1.342 0.252 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 169.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.3 mt -65.07 -51.77 59.52 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.145 173.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.38 -39.28 90.21 Favored Glycine 0 C--N 1.337 0.635 0 N-CA-C 110.323 -1.111 . . . . 0.0 110.323 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.5 t -55.71 -59.21 5.18 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 176.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 32.5 mt -49.39 -43.47 44.33 Favored 'General case' 0 C--O 1.228 -0.054 0 CA-C-O 118.837 -0.601 . . . . 0.0 111.625 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -66.96 -34.11 77.06 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 119.24 -0.984 . . . . 0.0 111.471 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.425 HD11 ' CE2' ' A' ' 17' ' ' PHE . 69.3 mt -72.13 -48.63 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 O-C-N 122.003 -0.436 . . . . 0.0 111.19 178.069 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 1.8 mp -59.46 -37.18 68.56 Favored 'Isoleucine or valine' 0 C--N 1.339 0.119 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -71.33 -39.42 71.37 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 119.414 -0.327 . . . . 0.0 111.285 -177.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.447 ' HB3' ' CE2' ' B' ' 162' ' ' TYR . 89.9 p -69.34 -52.96 22.2 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.527 0.603 . . . . 0.0 111.012 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 35.1 mt -66.47 -36.31 77.0 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 CA-C-N 118.166 0.439 . . . . 0.0 110.205 179.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.91 -44.6 91.49 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.651 -0.579 . . . . 0.0 111.651 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 32.6 ttm105 -67.39 -40.12 85.63 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 117.107 0.453 . . . . 0.0 110.528 178.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.487 ' HB1' HD21 ' A' ' 37' ' ' LEU . . . -68.78 -41.29 78.99 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.43 -179.018 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -64.15 -49.2 73.04 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 175.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.45 -46.51 83.54 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -62.49 -44.68 95.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 122.439 -0.163 . . . . 0.0 110.797 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -64.89 -40.1 94.57 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -176.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.7 t -84.61 -20.15 31.86 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -177.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 25.9 mmm180 . . . . . 0 C--N 1.339 0.151 0 CA-C-N 118.775 0.716 . . . . 0.0 111.651 174.483 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.508 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.267 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 28.4 p -47.81 -31.55 5.08 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -177.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.43 -44.23 91.84 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.272 -0.892 . . . . 0.0 110.244 176.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -72.26 -25.58 61.67 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 122.612 0.365 . . . . 0.0 110.225 177.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.436 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -65.24 -45.36 84.94 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.026 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.14 -43.13 98.71 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -60.57 -33.51 72.81 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.803 -0.181 . . . . 0.0 111.344 178.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.4 m -74.76 -40.75 61.02 Favored 'General case' 0 C--N 1.338 0.072 0 CA-C-O 119.686 -0.197 . . . . 0.0 110.974 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 48.7 mt -61.94 -29.45 70.24 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 173.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.76 -14.54 16.01 Favored Glycine 0 CA--C 1.53 1.027 0 CA-C-O 118.911 -0.939 . . . . 0.0 113.829 178.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -102.2 -6.6 23.0 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.085 1.442 . . . . 0.0 112.002 -179.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 35.4 m -121.29 -16.78 6.13 Favored 'Isoleucine or valine' 0 C--N 1.338 0.079 0 C-N-CA 122.917 0.487 . . . . 0.0 111.904 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.6 tp -52.79 -27.34 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 C-N-CA 123.039 0.536 . . . . 0.0 111.642 179.262 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -60.6 -58.45 8.44 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 122.598 0.359 . . . . 0.0 110.965 178.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -74.53 -29.36 61.35 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 122.403 0.281 . . . . 0.0 111.092 -177.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 49.2 tp -63.92 -54.87 27.82 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 179.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.451 ' O ' HG13 ' A' ' 113' ' ' ILE . 87.0 mt -63.0 -63.86 1.08 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.51 -0.757 . . . . 0.0 109.156 176.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 87.5 p -40.49 -49.48 2.9 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -177.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -73.6 -38.74 65.02 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 119.821 1.191 . . . . 0.0 112.109 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.52 -48.14 82.8 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.802 0.728 . . . . 0.0 110.706 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.2 OUTLIER -76.01 -34.62 27.39 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 117.963 0.347 . . . . 0.0 111.774 -179.69 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.72 -27.51 67.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 119.585 -0.846 . . . . 0.0 109.81 179.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.405 ' HE3' ' HB3' ' A' ' 59' ' ' ASP . 3.3 tmtt? -78.43 -26.94 46.44 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.308 0.643 . . . . 0.0 110.986 175.679 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.436 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 53.6 p -69.05 153.17 44.23 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -168.217 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -89.58 175.76 7.15 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 125.045 1.338 . . . . 0.0 108.439 172.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -55.84 -41.96 75.07 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 119.253 0.933 . . . . 0.0 111.838 -178.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -69.25 -38.89 78.66 Favored 'General case' 0 C--O 1.232 0.173 0 O-C-N 121.666 -0.646 . . . . 0.0 110.479 179.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.436 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 46.9 m170 -72.19 -39.19 68.79 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 119.397 -0.335 . . . . 0.0 111.188 -178.314 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.84 -36.41 83.4 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 176.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -62.09 -44.46 96.62 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.43 177.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -63.15 -43.89 97.06 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 117.545 0.157 . . . . 0.0 111.394 177.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.6 mt -68.03 -38.69 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-N 117.781 0.264 . . . . 0.0 110.546 -179.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -68.68 -33.97 74.88 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.3 0.24 . . . . 0.0 110.504 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 64.1 ttp -68.31 -43.87 76.68 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 176.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.41 ' C ' HD23 ' A' ' 127' ' ' LEU . 7.6 tt -57.8 -47.46 82.52 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 178.115 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.4 mt -71.9 -31.23 66.2 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 111.76 0.281 . . . . 0.0 111.76 -179.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 30.6 t70 . . . . . 0 N--CA 1.456 -0.132 0 CA-C-N 118.29 0.496 . . . . 0.0 109.787 177.65 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo . . . . . 0 N--CA 1.454 -0.824 0 N-CA-C 111.357 -0.286 . . . . 0.0 111.357 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 38.8 t -177.97 152.08 0.72 Allowed 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.046 0.938 . . . . 0.0 109.351 176.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 162' ' ' TYR . . . . . 0.447 ' CE2' ' HB3' ' A' ' 71' ' ' SER . 44.5 t80 -152.25 125.86 8.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.732 0.301 . . . . 0.0 110.933 169.516 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 9.3 t -131.93 148.77 71.18 Favored Pre-proline 0 N--CA 1.453 -0.32 0 C-N-CA 124.607 1.163 . . . . 0.0 109.558 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_exo -58.22 -1.46 0.65 Allowed 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 123.607 2.871 . . . . 0.0 112.954 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 28.0 m . . . . . 0 N--CA 1.456 -0.159 0 O-C-N 122.226 -0.297 . . . . 0.0 111.139 -179.136 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.476 0.836 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 54.0 mm-40 -131.3 178.5 6.67 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.484 0.713 . . . . 0.0 109.848 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -68.12 -6.5 23.36 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.633 0.373 . . . . 0.0 111.32 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -88.57 -3.37 58.82 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.503 0.721 . . . . 0.0 111.035 178.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -109.08 23.22 14.85 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.685 0.794 . . . . 0.0 111.435 -178.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -72.95 -157.15 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.521 0.728 . . . . 0.0 109.907 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -55.21 -14.19 1.61 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.167 0.587 . . . . 0.0 110.876 178.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -52.89 -37.09 60.13 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 124.396 1.078 . . . . 0.0 111.214 175.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -65.18 -43.88 90.27 Favored 'General case' 0 N--CA 1.457 -0.101 0 CA-C-N 119.328 0.967 . . . . 0.0 110.342 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -65.65 -50.52 64.68 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -177.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 99.7 t -63.13 -54.52 32.32 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -178.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.51 -33.62 70.03 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 119.437 -0.316 . . . . 0.0 111.654 -178.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 67.1 m -70.65 -43.98 68.04 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 118.62 0.646 . . . . 0.0 110.495 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.3 tp -65.59 -33.99 77.19 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.208 0.528 . . . . 0.0 110.064 -179.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -66.62 -45.72 78.16 Favored 'General case' 0 CA--C 1.522 -0.101 0 C-N-CA 124.164 0.985 . . . . 0.0 110.063 177.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 74.2 m -65.43 -26.36 67.93 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 110.371 -0.233 . . . . 0.0 110.371 176.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -68.03 -45.06 75.02 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 174.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -66.44 -32.79 74.39 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.768 0.827 . . . . 0.0 111.659 177.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -69.07 -14.38 62.98 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.206 0.602 . . . . 0.0 112.614 -177.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.3 mt -115.62 163.55 15.62 Favored 'General case' 0 N--CA 1.457 -0.087 0 CA-C-O 121.066 0.46 . . . . 0.0 111.571 -175.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -128.73 144.79 51.25 Favored 'General case' 0 C--N 1.337 0.064 0 C-N-CA 123.781 0.833 . . . . 0.0 109.804 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.7 t 59.33 154.88 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.214 1.405 . . . . 0.0 113.117 -175.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.17 131.9 0.4 Allowed Glycine 0 CA--C 1.527 0.836 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 -178.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 18.7 mm -116.26 56.62 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.5 m -51.7 132.06 30.67 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.354 0.661 . . . . 0.0 112.049 -174.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -70.04 -16.0 72.41 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-O 118.909 -0.939 . . . . 0.0 113.366 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.422 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 41.2 t -65.93 -42.79 89.63 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-N 118.974 1.387 . . . . 0.0 110.625 -177.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -68.04 -37.46 81.36 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 62.8 mt -63.59 -41.71 93.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -58.39 -43.28 88.46 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 118.561 -0.733 . . . . 0.0 111.967 176.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.401 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -65.62 -43.54 89.23 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 119.735 1.152 . . . . 0.0 111.102 178.459 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.3 mt -61.44 -57.08 13.65 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.612 0.244 . . . . 0.0 110.413 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 43.3 p -56.69 -41.17 76.9 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.474 0.31 . . . . 0.0 111.748 177.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.9 m -56.02 -56.23 23.29 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 119.143 -0.456 . . . . 0.0 110.698 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -67.27 -33.64 75.75 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 118.971 -1.091 . . . . 0.0 111.548 -175.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.52 -59.76 4.89 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 118.225 0.466 . . . . 0.0 110.817 174.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 53.9 mt -71.62 -14.66 62.13 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.181 0.992 . . . . 0.0 112.889 -173.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -55.82 -34.85 65.75 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -178.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -153.11 -17.9 0.15 Allowed 'General case' 0 C--N 1.34 0.155 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -177.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 31.3 mm 47.75 75.91 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-O 121.829 0.823 . . . . 0.0 111.417 -178.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -132.09 8.19 4.37 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.911 0.884 . . . . 0.0 109.83 177.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.548 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.8 pt -144.54 123.72 6.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 C-N-CA 125.301 1.44 . . . . 0.0 108.145 -178.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.22 -66.72 1.04 Allowed 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 179.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 50.8 m -66.85 -22.47 65.99 Favored 'General case' 0 N--CA 1.46 0.051 0 C-N-CA 122.714 0.406 . . . . 0.0 111.844 -174.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.618 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -75.17 -52.99 9.59 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 123.996 0.918 . . . . 0.0 109.203 179.012 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.435 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 10.8 mt -58.95 -45.81 91.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 C-N-CA 123.041 0.536 . . . . 0.0 110.025 175.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.419 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 12.3 mm -69.59 -46.28 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-O 119.298 -0.382 . . . . 0.0 111.517 -177.046 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 40.4 t -58.68 -36.59 74.44 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 118.712 0.687 . . . . 0.0 109.697 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.9 tp -67.87 -45.01 75.74 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 118.754 -0.641 . . . . 0.0 112.282 -178.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 28.5 pt -73.41 -37.07 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-N 119.608 1.095 . . . . 0.0 111.893 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.444 HD13 HG21 ' A' ' 104' ' ' VAL . 97.4 mt -63.25 -52.65 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -66.91 -25.63 66.47 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.516 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -61.49 -43.68 98.44 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 173.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.3 t -64.51 -42.78 95.59 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 120.747 0.308 . . . . 0.0 110.346 175.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.64 -48.91 76.51 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 124.809 1.244 . . . . 0.0 112.536 -176.042 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 78.4 mt -81.89 -14.59 55.98 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -174.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 78.9 m -108.91 156.17 39.51 Favored Pre-proline 0 CA--C 1.535 0.375 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -169.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_exo -55.77 -179.87 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.351 1 C-N-CA 126.069 4.513 . . . . 0.0 115.409 176.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -55.46 -43.65 75.67 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.574 1.55 . . . . 0.0 114.036 -174.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.9 p -58.7 -28.44 65.79 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 31.8 m80 -92.02 -14.93 28.6 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 118.861 -0.59 . . . . 0.0 111.208 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.403 ' HB2' ' HE2' ' A' ' 115' ' ' LYS . 35.5 mmtp -69.15 -47.47 64.95 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 169.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.1 tp -66.14 -45.41 81.11 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.383 177.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.94 -43.65 96.65 Favored Glycine 0 C--N 1.336 0.556 0 N-CA-C 111.124 -0.79 . . . . 0.0 111.124 178.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.7 t -67.0 -37.72 84.72 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 117.579 0.689 . . . . 0.0 110.608 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 28.5 mt -57.89 -39.58 78.21 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.317 0.962 . . . . 0.0 110.579 174.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -71.57 -32.03 67.63 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.251 0.932 . . . . 0.0 111.835 178.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 83.7 mt -70.96 -47.02 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 O-C-N 121.609 -0.682 . . . . 0.0 110.18 176.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 79.7 mt -61.02 -36.05 69.64 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 C-N-CA 124.208 1.003 . . . . 0.0 109.156 176.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -62.9 -50.05 72.39 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 123.729 0.812 . . . . 0.0 110.656 176.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.5 t -70.47 -49.07 52.37 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 118.887 -1.125 . . . . 0.0 111.952 -175.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 46.2 mt -65.33 -37.55 80.4 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.8 -48.97 58.28 Favored Glycine 0 CA--C 1.523 0.583 0 CA-C-O 119.596 -0.558 . . . . 0.0 112.309 -178.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.413 HH22 ' C ' ' B' ' 166' ' ' SEP . 6.5 mtp-105 -66.12 -38.53 88.43 Favored 'General case' 0 CA--C 1.522 -0.106 0 CA-C-N 117.845 0.823 . . . . 0.0 110.92 178.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.74 -42.57 81.62 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 121.091 -0.243 . . . . 0.0 110.47 178.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.0 m-30 -61.39 -47.52 85.42 Favored 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 175.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.0 tp -59.09 -44.94 91.97 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.743 0.417 . . . . 0.0 110.813 -176.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -67.62 -41.65 83.63 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.631 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 59.2 tt0 -65.95 -38.96 89.94 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.502 -176.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.3 t -82.93 -23.17 33.61 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 117.928 0.331 . . . . 0.0 111.303 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 28.9 ttp180 -68.42 -32.76 73.04 Favored 'General case' 0 N--CA 1.463 0.177 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 172.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 28.8 t -70.97 -14.47 62.37 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.118 0.567 . . . . 0.0 111.444 176.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -103.61 170.91 7.66 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.748 0.819 . . . . 0.0 109.947 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 39.2 t -145.97 157.63 43.88 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 122.724 0.41 . . . . 0.0 110.749 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -73.96 -7.74 53.52 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.039 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 83.4 p -92.45 1.46 57.23 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.035 0.534 . . . . 0.0 111.09 176.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 40.7 m -136.39 14.53 3.23 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 123.567 0.747 . . . . 0.0 111.034 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.0 t -145.36 159.24 43.35 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 123.157 0.583 . . . . 0.0 110.337 -178.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 48.3 m-80 -142.05 165.77 26.54 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.745 0.818 . . . . 0.0 109.61 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.409 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 28.9 tptp 54.85 101.58 0.04 OUTLIER Pre-proline 0 CA--C 1.534 0.347 0 C-N-CA 125.285 1.434 . . . . 0.0 111.934 -177.143 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 90' ' ' LYS . 58.4 Cg_endo -64.6 153.12 79.03 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 122.843 2.362 . . . . 0.0 111.111 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 142.9 -147.05 18.35 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -175.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 53.86 -161.8 0.12 Allowed 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 175.043 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.9 p -50.95 -30.01 13.76 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.088 0.955 . . . . 0.0 113.416 -175.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.98 -46.83 89.14 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 118.753 0.706 . . . . 0.0 109.579 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -74.72 -23.09 58.52 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.987 178.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.419 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -64.29 -45.59 87.33 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 175.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.77 -42.25 91.99 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -59.35 -34.97 73.03 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 121.303 -0.159 . . . . 0.0 110.969 178.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.3 m -76.61 -40.77 48.36 Favored 'General case' 0 C--O 1.227 -0.098 0 O-C-N 122.288 -0.258 . . . . 0.0 111.244 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.8 mt -61.41 -29.49 69.97 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 174.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.47 -14.58 28.25 Favored Glycine 0 CA--C 1.529 0.95 0 CA-C-O 119.016 -0.88 . . . . 0.0 113.816 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -100.51 -6.79 24.94 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 118.776 1.288 . . . . 0.0 111.689 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.444 HG21 HD13 ' A' ' 51' ' ' ILE . 27.3 m -123.72 -18.28 4.13 Favored 'Isoleucine or valine' 0 C--N 1.339 0.134 0 N-CA-C 112.5 0.555 . . . . 0.0 112.5 -178.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -54.53 -28.08 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 118.48 0.582 . . . . 0.0 111.548 -177.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -62.29 -51.79 66.29 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.778 0.431 . . . . 0.0 111.215 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -77.94 -28.49 49.62 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 122.093 -0.379 . . . . 0.0 111.008 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.0 mt -65.25 -49.78 68.32 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 178.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 69.2 mt -65.56 -60.14 3.24 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 118.5 -0.762 . . . . 0.0 110.31 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.9 p -53.67 -40.37 65.87 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 119.011 -1.076 . . . . 0.0 112.199 -173.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -72.67 -45.0 61.11 Favored 'General case' 0 C--N 1.342 0.24 0 CA-C-N 119.44 1.018 . . . . 0.0 111.095 178.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.409 ' O ' ' HE3' ' A' ' 115' ' ' LYS . . . -55.96 -33.98 65.26 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.148 0.579 . . . . 0.0 111.635 177.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.564 HG21 ' HB2' ' A' ' 151' ' ' ALA . 0.0 OUTLIER -79.2 -41.97 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 CA-C-N 119.345 0.975 . . . . 0.0 112.019 173.955 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.54 -27.08 66.66 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.001 0.364 . . . . 0.0 111.746 -177.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.409 ' HE3' ' O ' ' A' ' 112' ' ' ALA . 0.1 OUTLIER -81.33 -18.41 45.8 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.647 0.779 . . . . 0.0 110.653 177.933 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.2 m -80.44 164.63 22.91 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -173.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -101.4 -179.41 4.02 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 169.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 15.9 tp60 -51.33 -39.92 58.01 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.639 0.654 . . . . 0.0 111.592 -178.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -69.08 -54.56 14.38 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -177.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -64.87 -35.87 82.52 Favored 'General case' 0 C--N 1.339 0.131 0 O-C-N 122.2 -0.312 . . . . 0.0 110.4 -178.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 11.9 ttpt -56.71 -51.9 67.04 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 175.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.5 -35.29 78.91 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.885 -176.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -63.59 -39.64 94.91 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 122.215 -0.303 . . . . 0.0 111.239 175.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.5 mt -68.88 -37.38 77.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 49.7 tpt85 -60.89 -41.41 95.97 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 122.792 0.437 . . . . 0.0 109.967 175.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 65.9 ttp -68.42 -37.67 80.5 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 122.62 0.368 . . . . 0.0 110.611 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 8.4 tt -59.48 -51.71 68.72 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.4 mt -71.03 -25.87 62.85 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 120.444 -0.502 . . . . 0.0 111.446 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -66.92 -39.46 87.37 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.285 0.493 . . . . 0.0 109.874 175.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.3 mt -70.82 -35.91 62.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 27.3 m0 -59.73 -44.13 93.91 Favored 'General case' 0 C--N 1.34 0.171 0 CA-C-N 118.2 0.455 . . . . 0.0 110.037 174.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -71.62 -33.36 68.91 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 111.501 0.186 . . . . 0.0 111.501 179.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 24.4 ttm180 -72.33 -31.1 65.37 Favored 'General case' 0 N--CA 1.458 -0.054 0 C-N-CA 123.207 0.603 . . . . 0.0 111.565 -178.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 35.6 t -70.49 -21.13 62.8 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.121 0.569 . . . . 0.0 111.412 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 71.56 4.87 58.84 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 111.776 -0.53 . . . . 0.0 111.776 -177.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 40.1 tp -79.54 -8.58 59.26 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.35 0.66 . . . . 0.0 110.755 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -127.87 162.93 25.54 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.703 0.801 . . . . 0.0 109.844 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -135.61 171.65 14.15 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 122.886 0.474 . . . . 0.0 110.721 -176.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -66.19 165.66 13.34 Favored 'General case' 0 N--CA 1.458 -0.068 0 C-N-CA 123.249 0.619 . . . . 0.0 110.832 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 22.1 m 58.35 15.85 3.71 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.139 0.976 . . . . 0.0 113.578 -177.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -132.8 11.19 4.34 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.223 0.609 . . . . 0.0 110.955 176.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.52 ' H ' HD23 ' A' ' 142' ' ' LEU . 1.5 pt? -135.4 10.34 3.47 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.958 0.503 . . . . 0.0 111.962 -179.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 36.8 m-20 -64.45 -6.75 7.88 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.855 0.862 . . . . 0.0 111.982 -179.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.501 ' C ' ' H ' ' A' ' 146' ' ' ARG . . . -36.85 -36.71 0.12 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 127.621 2.368 . . . . 0.0 114.106 -179.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.578 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -65.53 15.82 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 177.252 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.501 ' H ' ' C ' ' A' ' 144' ' ' ALA . 22.6 mmm180 50.86 50.32 19.29 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 123.827 0.851 . . . . 0.0 109.484 -174.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 13.4 t 71.03 161.1 0.23 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.33 1.052 . . . . 0.0 112.594 -174.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -51.5 -18.79 1.18 Allowed 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 117.058 2.244 . . . . 0.0 117.058 -166.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 81.1 m -41.23 -64.37 0.56 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 120.158 1.345 . . . . 0.0 112.107 -174.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . 0.454 ' HD1' ' H ' ' A' ' 150' ' ' PHE . 28.3 m-85 -32.01 -85.8 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 127.915 2.486 . . . . 0.0 114.305 -171.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . 0.564 ' HB2' HG21 ' A' ' 113' ' ' ILE . . . -105.63 -6.33 19.33 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 118.498 0.59 . . . . 0.0 112.423 176.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . 0.404 ' SD ' ' N ' ' A' ' 152' ' ' MET . 0.9 OUTLIER -99.85 -14.52 18.75 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 118.609 -0.71 . . . . 0.0 112.179 -171.672 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -84.21 -20.79 31.72 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 119.77 1.168 . . . . 0.0 111.765 175.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 2.4 tm? . . . . . 0 C--O 1.249 1.077 0 CA-C-O 117.863 -1.065 . . . . 0.0 110.032 -179.942 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 53.9 p90 . . . . . 0 N--CA 1.473 0.71 0 CA-C-O 120.492 0.187 . . . . 0.0 110.595 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 88.8 p -141.6 169.62 10.89 Favored Pre-proline 0 CA--C 1.532 0.283 0 C-N-CA 123.427 0.691 . . . . 0.0 109.842 -177.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -61.4 1.35 0.72 Allowed 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 124.457 3.438 . . . . 0.0 114.097 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 40.6 p -132.54 151.61 51.86 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 118.471 0.578 . . . . 0.0 110.433 -179.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 160' ' ' PRO . . . . . 0.422 ' HD2' ' N ' ' A' ' 27' ' ' SER . 80.7 Cg_endo -69.94 175.13 38.38 Favored 'Cis proline' 0 N--CA 1.451 -0.975 0 N-CA-C 109.742 -0.907 . . . . 0.0 109.742 -10.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 45.5 m -65.74 144.9 56.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -151.23 142.6 23.4 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.634 0.254 . . . . 0.0 111.326 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 36.5 p -144.09 159.71 51.83 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-O 120.996 0.427 . . . . 0.0 111.328 177.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -57.02 -0.91 0.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 124.335 3.357 . . . . 0.0 113.464 174.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 26.9 m -67.79 -39.83 83.99 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.045 0.384 . . . . 0.0 110.877 178.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 166' ' ' SEP . . . . . 0.413 ' C ' HH22 ' A' ' 74' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -70.77 -12.14 30.54 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 123.648 2.899 . . . . 0.0 112.747 177.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 72.9 p . . . . . 0 C--O 1.251 1.168 0 CA-C-O 116.611 -1.661 . . . . 0.0 111.115 -175.485 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.2 mmm . . . . . 0 N--CA 1.475 0.811 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -88.34 13.29 11.97 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -177.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -126.98 1.74 6.57 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.951 0.5 . . . . 0.0 111.857 -178.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -71.33 137.76 48.72 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.442 0.565 . . . . 0.0 109.9 179.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 52.39 19.01 1.03 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.371 1.068 . . . . 0.0 113.043 -176.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -105.57 -117.68 0.23 Allowed 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -56.97 -17.12 8.53 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.018 0.372 . . . . 0.0 110.469 174.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -55.52 -42.75 74.95 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.109 0.564 . . . . 0.0 110.327 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -56.55 -43.32 79.82 Favored 'General case' 0 C--N 1.337 0.064 0 CA-C-N 118.264 0.484 . . . . 0.0 110.506 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -66.91 -52.68 40.22 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 110.576 -0.157 . . . . 0.0 110.576 -177.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 67.1 t -61.44 -53.49 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 -179.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.6 -34.66 71.37 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.921 0.488 . . . . 0.0 111.906 -177.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 78.4 m -72.03 -41.03 67.97 Favored 'General case' 0 CA--C 1.523 -0.079 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.707 177.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.3 tp -65.36 -33.05 75.04 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -68.42 -44.76 74.31 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.934 0.894 . . . . 0.0 109.941 176.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 72.1 m -64.36 -26.31 68.41 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 175.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.1 -45.82 69.28 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 174.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -63.45 -31.37 72.51 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 122.967 0.507 . . . . 0.0 111.197 177.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -71.46 -14.49 62.16 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.259 0.624 . . . . 0.0 112.461 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 96.7 mt -115.9 162.39 17.41 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.072 0.549 . . . . 0.0 111.05 -176.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -142.47 167.18 22.7 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 123.2 0.6 . . . . 0.0 110.633 -177.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 29.2 m 51.27 34.95 12.47 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.022 0.929 . . . . 0.0 113.423 176.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -166.45 126.84 1.51 Allowed Glycine 0 C--N 1.338 0.641 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 15.8 mm -111.23 50.71 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 C-N-CA 124.172 0.989 . . . . 0.0 108.505 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.4 m -54.88 132.05 45.65 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.045 0.538 . . . . 0.0 111.988 -176.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.14 -19.23 63.6 Favored Glycine 0 C--N 1.338 0.658 0 C-N-CA 124.542 1.067 . . . . 0.0 113.208 -178.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.45 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 63.1 p -67.32 -39.54 85.89 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 118.707 1.253 . . . . 0.0 110.649 -176.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -67.55 -40.24 84.97 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 178.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.5 mt -63.72 -39.48 85.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 177.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 47.5 mmtt -63.41 -40.19 96.53 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-O 118.939 -0.553 . . . . 0.0 110.77 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.95 -47.29 75.15 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 118.822 0.737 . . . . 0.0 110.554 175.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.7 mt -59.23 -58.77 7.16 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 122.452 -0.155 . . . . 0.0 110.833 -178.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.4 p -57.39 -49.13 77.17 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 t -62.53 -43.98 97.48 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 119.965 -0.694 . . . . 0.0 111.282 -175.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -77.27 -21.38 53.72 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -178.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.29 -55.81 10.83 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 119.029 0.831 . . . . 0.0 110.019 169.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.5 mt -65.46 -26.14 67.81 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.178 0.991 . . . . 0.0 111.334 -176.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -76.06 -16.81 59.86 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.077 0.551 . . . . 0.0 111.654 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -145.65 48.95 1.24 Allowed 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.206 0.203 . . . . 0.0 111.436 -173.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.634 HG22 HG22 ' A' ' 93' ' ' THR . 43.9 mm -63.07 79.05 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-O 121.468 0.651 . . . . 0.0 110.45 171.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -153.36 18.15 0.55 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.068 1.747 . . . . 0.0 108.538 176.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.576 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.8 OUTLIER -147.09 36.88 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.065 0 C-N-CA 125.542 1.537 . . . . 0.0 108.541 -171.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.469 ' HB2' ' HB2' ' A' ' 97' ' ' ALA . 0.0 OUTLIER -51.37 -53.81 32.75 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -175.237 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 85.6 p -75.4 -23.62 57.08 Favored 'General case' 0 CA--C 1.522 -0.107 0 O-C-N 121.577 -0.702 . . . . 0.0 112.369 -173.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.626 ' H ' ' HD3' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -86.25 -41.61 14.47 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 -179.323 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 45.4 mt -57.37 -50.84 75.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 171.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.509 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 13.9 mm -66.85 -50.4 65.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 CA-C-O 119.128 -0.463 . . . . 0.0 112.094 -177.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 87.6 p -58.95 -31.98 69.2 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 118.973 -1.091 . . . . 0.0 110.438 178.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 57.1 tp -68.97 -44.7 72.4 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 118.765 -0.636 . . . . 0.0 112.145 178.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.0 pt -72.01 -34.71 51.49 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 119.682 1.128 . . . . 0.0 112.0 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.472 HD13 HG21 ' A' ' 104' ' ' VAL . 96.4 mt -64.86 -50.83 73.32 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.103 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 177.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -58.43 -41.2 84.48 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.498 177.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -57.95 -40.86 81.57 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 176.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.2 t -64.21 -53.57 47.09 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 121.245 -0.182 . . . . 0.0 111.42 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -72.4 -23.42 61.09 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 113.761 1.022 . . . . 0.0 113.761 -172.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.9 mt -84.03 -15.06 48.96 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.415 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 95.0 m -112.45 158.31 37.66 Favored Pre-proline 0 CA--C 1.533 0.318 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -171.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.415 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 74.3 Cg_endo -66.51 -177.47 0.91 Allowed 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 125.09 3.86 . . . . 0.0 113.486 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -55.18 -41.15 71.52 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.114 1.365 . . . . 0.0 114.26 -171.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.4 p -59.74 -32.33 70.46 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 28.9 m170 -88.99 -15.95 32.9 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 119.086 -0.483 . . . . 0.0 111.527 -178.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -68.87 -46.35 68.68 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 170.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 64.3 tp -66.5 -46.66 75.5 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.81 0.338 . . . . 0.0 110.111 177.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.81 -44.07 96.14 Favored Glycine 0 C--N 1.337 0.592 0 N-CA-C 110.7 -0.96 . . . . 0.0 110.7 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.3 t -66.18 -38.53 88.24 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 117.467 0.633 . . . . 0.0 110.367 -179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 66' ' ' LEU . 23.3 mt -58.62 -40.12 82.4 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 119.123 0.874 . . . . 0.0 110.717 175.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -69.02 -32.46 71.99 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 119.137 0.881 . . . . 0.0 111.497 178.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 70.8 mt -71.38 -48.21 54.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 O-C-N 121.639 -0.663 . . . . 0.0 110.252 177.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.6 mt -59.56 -36.15 63.32 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.176 0 C-N-CA 124.111 0.964 . . . . 0.0 109.307 176.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -64.33 -52.46 58.34 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.597 0.759 . . . . 0.0 110.54 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.8 t -66.14 -50.56 63.56 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 118.855 -1.138 . . . . 0.0 111.93 -176.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 52.2 mt -65.07 -37.43 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 110.289 -0.263 . . . . 0.0 110.289 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.41 -48.48 57.47 Favored Glycine 0 C--N 1.338 0.658 0 N-CA-C 111.95 -0.46 . . . . 0.0 111.95 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.471 HH22 ' C ' ' B' ' 166' ' ' SEP . 4.8 mtp-105 -67.61 -35.11 78.34 Favored 'General case' 0 C--O 1.23 0.061 0 CA-C-N 117.685 0.742 . . . . 0.0 110.701 179.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.61 -42.77 81.86 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 177.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 -62.43 -46.84 86.71 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 176.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 57.6 tp -58.63 -45.1 89.99 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 123.461 0.476 . . . . 0.0 110.424 -177.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -65.79 -46.56 78.27 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.553 -0.092 . . . . 0.0 110.878 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -69.89 -30.9 68.44 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -174.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.5 t -86.35 -26.58 24.77 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 118.61 0.641 . . . . 0.0 111.37 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -73.39 -31.07 63.69 Favored 'General case' 0 CA--C 1.529 0.152 0 O-C-N 122.206 -0.309 . . . . 0.0 110.326 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 31.2 t -61.97 -14.46 35.24 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.634 0.774 . . . . 0.0 112.365 179.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -71.09 -20.17 62.38 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.949 -0.469 . . . . 0.0 111.013 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 36.7 m 49.45 24.45 1.1 Allowed 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 177.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -147.93 160.17 43.09 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.21 0.459 . . . . 0.0 110.506 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 33.0 t -147.67 161.54 40.96 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 123.368 0.667 . . . . 0.0 109.9 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 93.2 p -149.19 171.36 16.58 Favored 'General case' 0 C--O 1.231 0.113 0 C-N-CA 122.831 0.453 . . . . 0.0 110.95 -178.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 35.7 m -80.24 5.69 13.93 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.931 0.493 . . . . 0.0 111.823 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -75.29 159.4 31.54 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 122.9 0.48 . . . . 0.0 110.29 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -70.22 152.85 95.58 Favored Pre-proline 0 CA--C 1.531 0.241 0 C-N-CA 123.092 0.557 . . . . 0.0 110.604 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -70.16 164.42 34.99 Favored 'Trans proline' 0 N--CA 1.452 -0.945 0 C-N-CA 123.746 2.964 . . . . 0.0 111.302 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -175.6 177.45 47.41 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.609 -0.996 . . . . 0.0 110.609 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.634 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER 50.62 -151.72 0.2 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.46 0.704 . . . . 0.0 112.58 176.621 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 26.3 p -50.24 -30.37 11.52 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.98 -41.37 95.49 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.308 -0.87 . . . . 0.0 110.152 176.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 -66.11 -34.72 78.7 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.111 0.481 . . . . 0.0 110.33 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.509 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -63.56 -45.15 91.81 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.964 179.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 98.3 mt -63.54 -42.92 97.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 175.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -61.03 -33.24 72.98 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 122.379 -0.201 . . . . 0.0 110.852 179.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 86.1 m -75.48 -41.33 55.73 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.467 0.307 . . . . 0.0 111.191 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.5 mt -62.01 -30.29 70.85 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 174.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.08 -14.58 25.51 Favored Glycine 0 CA--C 1.53 1.014 0 CA-C-O 119.174 -0.792 . . . . 0.0 113.668 178.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -101.95 -3.73 27.32 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.846 1.323 . . . . 0.0 112.136 -179.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.472 HG21 HD13 ' A' ' 51' ' ' ILE . 26.8 m -125.86 -18.82 3.0 Favored 'Isoleucine or valine' 0 C--N 1.338 0.074 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -178.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.4 tp -50.83 -27.12 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -177.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -64.98 -46.35 81.83 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 118.03 0.377 . . . . 0.0 110.886 178.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -74.23 -40.81 62.16 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -178.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 89.5 mt -60.32 -50.3 74.18 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.422 -177.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.415 HD12 ' CB ' ' A' ' 144' ' ' ALA . 78.0 mt -66.51 -59.62 3.48 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 118.383 -0.818 . . . . 0.0 110.245 177.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 62.2 p -49.45 -42.09 42.05 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 118.951 0.796 . . . . 0.0 111.898 -173.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -70.57 -51.69 26.77 Favored 'General case' 0 C--O 1.226 -0.152 0 CA-C-N 118.638 0.654 . . . . 0.0 110.863 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.407 ' O ' ' HE3' ' A' ' 115' ' ' LYS . . . -56.06 -32.43 64.08 Favored 'General case' 0 C--O 1.228 -0.078 0 C-N-CA 123.836 0.854 . . . . 0.0 113.044 -178.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -86.94 -36.43 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.151 0 CA-C-N 119.446 1.021 . . . . 0.0 112.35 175.237 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.92 -28.37 66.6 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.395 0.543 . . . . 0.0 111.0 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.407 ' HE3' ' O ' ' A' ' 112' ' ' ALA . 0.1 OUTLIER -79.0 -18.12 54.18 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.0 0.92 . . . . 0.0 110.843 178.386 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 14.9 m -79.07 166.4 22.33 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -174.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -107.93 -174.15 2.45 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.307 1.443 . . . . 0.0 107.886 173.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -50.89 -55.22 18.15 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.349 0.66 . . . . 0.0 112.097 -177.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -68.79 -32.74 72.69 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 122.004 -0.435 . . . . 0.0 111.617 -176.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 58.8 m-70 -76.67 -42.04 43.31 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 118.796 -0.621 . . . . 0.0 111.419 -177.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.73 -33.19 75.09 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 119.328 0.967 . . . . 0.0 108.787 176.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.07 -46.21 90.12 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.172 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.504 ' HE3' ' CE1' ' B' ' 155' ' ' TYR . 34.7 mtmm -62.42 -42.33 99.37 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.352 176.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.6 mt -66.19 -35.06 74.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -67.43 -38.31 84.36 Favored 'General case' 0 C--O 1.227 -0.107 0 O-C-N 121.986 -0.446 . . . . 0.0 110.637 178.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 64.6 ttp -66.07 -40.99 91.33 Favored 'General case' 0 N--CA 1.457 -0.116 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 176.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.9 tt -59.24 -45.01 92.31 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 177.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 91.2 mt -71.36 -28.68 64.22 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -67.51 -38.33 84.12 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 118.482 0.583 . . . . 0.0 109.506 176.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 95.6 mt -69.81 -37.7 74.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 176.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 16.6 m0 -64.5 -33.3 75.57 Favored 'General case' 0 C--N 1.341 0.226 0 O-C-N 122.06 -0.4 . . . . 0.0 110.817 175.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -73.48 -36.29 65.78 Favored 'General case' 0 CA--C 1.531 0.218 0 O-C-N 122.374 -0.204 . . . . 0.0 110.825 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -74.71 -33.82 62.47 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 21.3 t -100.22 -14.9 18.29 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 -176.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -70.4 164.26 52.59 Favored Glycine 0 CA--C 1.528 0.847 0 O-C-N 121.953 -0.467 . . . . 0.0 112.457 -176.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 85.3 mt -104.29 0.03 28.8 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.615 0.766 . . . . 0.0 110.862 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.415 ' CG ' ' N ' ' A' ' 138' ' ' GLN . 57.4 t80 -88.82 -177.77 5.59 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.693 0.797 . . . . 0.0 109.877 178.355 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . 0.415 ' N ' ' CG ' ' A' ' 137' ' ' PHE . 85.5 mt-30 -55.82 151.79 10.82 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 122.829 0.452 . . . . 0.0 109.846 177.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -115.32 174.79 5.81 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -170.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 20.3 m 63.28 -2.2 0.47 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 125.586 1.554 . . . . 0.0 114.3 -178.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 26.0 p90 -161.82 156.9 23.29 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 118.465 0.575 . . . . 0.0 110.719 175.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 95.8 mt -136.95 160.15 39.76 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 124.495 1.118 . . . . 0.0 108.747 178.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -99.93 -37.74 8.9 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -176.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.415 ' CB ' HD12 ' A' ' 109' ' ' LEU . . . -47.58 -39.88 17.83 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 124.725 1.21 . . . . 0.0 113.359 -171.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.448 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -71.64 29.39 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 123.043 0.537 . . . . 0.0 112.374 174.898 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 80.7 mtp180 48.51 30.24 2.36 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 123.72 0.808 . . . . 0.0 110.718 -172.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 75.4 m 46.87 22.59 0.2 Allowed 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 -175.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -125.02 -169.84 2.06 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 -172.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 29.0 p -51.68 -14.74 0.37 Allowed 'General case' 0 C--O 1.231 0.103 0 C-N-CA 126.191 1.797 . . . . 0.0 115.417 -169.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -37.39 -69.69 0.11 Allowed 'General case' 0 C--N 1.341 0.208 0 CA-C-N 118.829 0.74 . . . . 0.0 110.576 176.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -111.65 -11.75 13.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 119.101 -0.476 . . . . 0.0 111.218 169.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 31.6 mmt -71.34 -14.14 62.09 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.198 0.908 . . . . 0.0 110.335 175.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 8.1 t70 63.79 -14.28 0.08 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.853 1.661 . . . . 0.0 114.534 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 1.5 pt? . . . . . 0 C--O 1.254 1.296 0 CA-C-O 117.654 -1.165 . . . . 0.0 111.28 173.55 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 155' ' ' TYR . . . . . 0.504 ' CE1' ' HE3' ' A' ' 123' ' ' LYS . 29.0 t80 . . . . . 0 N--CA 1.473 0.68 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 84.2 p -71.86 156.49 90.96 Favored Pre-proline 0 N--CA 1.456 -0.152 0 C-N-CA 122.491 0.316 . . . . 0.0 111.085 -178.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -74.26 -2.95 13.05 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 123.879 3.053 . . . . 0.0 112.088 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 72.1 p 46.93 34.31 2.64 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.285 1.034 . . . . 0.0 112.7 -179.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 160' ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' ' 27' ' ' SER . 58.4 Cg_endo -65.62 -62.7 0.03 OUTLIER 'Cis proline' 0 N--CA 1.457 -0.62 0 CA-C-N 119.176 0.741 . . . . 0.0 111.698 -2.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . 0.421 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 65.9 p -170.47 148.48 3.14 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.18 0.992 . . . . 0.0 108.997 175.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -158.62 137.96 11.62 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 120.677 0.275 . . . . 0.0 111.628 172.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 16.3 t -137.69 144.76 45.93 Favored Pre-proline 0 CA--C 1.529 0.138 0 C-N-CA 123.743 0.817 . . . . 0.0 110.152 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -66.23 -1.46 5.46 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 123.305 2.67 . . . . 0.0 111.712 177.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 39.4 p -75.33 -26.31 58.52 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 119.125 -0.464 . . . . 0.0 111.414 178.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 166' ' ' SEP . . . . . 0.471 ' C ' HH22 ' A' ' 74' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -65.84 170.84 10.77 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 123.2 2.6 . . . . 0.0 111.543 174.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 75.5 m . . . . . 0 C--O 1.251 1.173 0 CA-C-O 116.955 -1.497 . . . . 0.0 111.68 179.708 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.3 ptt? . . . . . 0 N--CA 1.474 0.77 0 CA-C-O 120.27 0.081 . . . . 0.0 110.994 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -148.77 -25.07 0.31 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 122.958 0.503 . . . . 0.0 111.294 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -149.3 16.99 0.93 Allowed 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.146 0.43 . . . . 0.0 111.911 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 58.82 9.17 1.1 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.73 1.212 . . . . 0.0 113.462 -177.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -142.64 15.6 1.98 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.96 0.904 . . . . 0.0 110.423 177.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -77.42 -151.32 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.469 1.108 . . . . 0.0 110.0 176.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -54.98 -16.41 2.73 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.199 0.6 . . . . 0.0 110.776 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -54.53 -39.16 67.4 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 118.944 -0.551 . . . . 0.0 110.289 173.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 -64.82 -42.31 95.08 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-N 118.947 0.794 . . . . 0.0 110.216 178.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -64.89 -50.32 67.0 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 118.087 0.403 . . . . 0.0 110.425 -178.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 93.0 t -63.75 -54.15 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.6 -30.69 67.42 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 122.781 0.432 . . . . 0.0 111.589 -178.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 54.0 m -74.64 -41.91 59.5 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.268 0.485 . . . . 0.0 110.594 177.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.4 tp -67.05 -29.75 69.62 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -71.04 -39.92 71.99 Favored 'General case' 0 CA--C 1.523 -0.09 0 C-N-CA 124.032 0.933 . . . . 0.0 109.868 175.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.6 t -63.78 -28.75 70.09 Favored 'General case' 0 N--CA 1.456 -0.134 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 173.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.52 -32.25 60.42 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 110.002 -0.369 . . . . 0.0 110.002 174.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -67.74 -33.28 74.56 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 122.678 0.391 . . . . 0.0 110.203 176.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -72.26 -14.3 61.74 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.956 0.502 . . . . 0.0 110.835 174.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.2 pp 51.67 170.59 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 128.02 2.528 . . . . 0.0 115.531 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.2 tptm -141.1 26.02 2.05 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.741 1.216 . . . . 0.0 109.499 -179.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 24.3 m 56.13 22.09 5.73 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.482 0.713 . . . . 0.0 112.003 -175.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -164.9 -162.14 15.32 Favored Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 178.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 20.7 mm -125.63 68.06 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 C-N-CA 124.732 1.213 . . . . 0.0 108.641 -173.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.42 ' HB2' HH11 ' A' ' 28' ' ' ARG . 73.8 m -59.35 132.41 53.93 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.112 0.565 . . . . 0.0 112.41 -175.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.73 -23.62 72.44 Favored Glycine 0 C--N 1.337 0.627 0 C-N-CA 124.117 0.865 . . . . 0.0 112.581 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.49 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 36.6 t -65.08 -41.12 95.32 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 118.533 1.167 . . . . 0.0 110.46 -175.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.42 HH11 ' HB2' ' A' ' 25' ' ' SER . 81.0 mtt85 -69.57 -38.8 77.54 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 75.9 mt -64.17 -39.42 85.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 176.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp -67.7 -36.86 81.41 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.348 -0.358 . . . . 0.0 111.412 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.453 ' HE3' ' O ' ' A' ' 27' ' ' SER . 0.0 OUTLIER -68.98 -43.93 73.94 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.676 0.671 . . . . 0.0 110.703 175.484 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.4 mt -62.85 -56.47 17.05 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 110.605 -0.146 . . . . 0.0 110.605 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.573 HG21 ' HB2' ' A' ' 71' ' ' SER . 50.8 p -56.3 -49.18 75.04 Favored 'General case' 0 CA--C 1.522 -0.13 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 177.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 t -62.28 -43.86 97.86 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.964 -174.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -68.47 -35.54 77.71 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 118.721 -1.192 . . . . 0.0 111.503 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.86 -58.0 10.57 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.132 0.424 . . . . 0.0 110.226 174.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.83 -16.23 63.23 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -176.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -59.62 -27.25 66.15 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -179.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.3 t-80 -152.3 -23.63 0.17 Allowed 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 -176.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.51 HG22 HG22 ' A' ' 93' ' ' THR . 33.5 mm 46.51 74.96 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 123.431 0.693 . . . . 0.0 111.675 -178.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -147.24 20.57 1.22 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.857 0.863 . . . . 0.0 109.8 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.58 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.3 pt -147.45 35.33 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 C-N-CA 124.291 1.036 . . . . 0.0 109.805 -171.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.487 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -50.61 -58.16 6.5 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.205 1.002 . . . . 0.0 113.601 -177.05 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 52.9 m -73.09 -26.8 61.38 Favored 'General case' 0 CA--C 1.52 -0.192 0 O-C-N 121.864 -0.523 . . . . 0.0 112.4 -174.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.655 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.76 -44.12 15.95 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 119.305 -0.378 . . . . 0.0 109.989 -178.741 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 16.7 mt -56.22 -51.93 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.125 0 CA-C-N 118.303 0.502 . . . . 0.0 109.711 171.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.43 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 13.4 mm -66.8 -49.45 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -176.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 34.2 t -56.66 -36.72 69.88 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 119.987 -0.685 . . . . 0.0 109.646 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.1 tp -69.71 -42.37 74.12 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 118.444 -0.789 . . . . 0.0 112.63 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 32.1 pt -72.99 -37.64 54.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 120.003 1.274 . . . . 0.0 111.773 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.446 HD13 HG21 ' A' ' 104' ' ' VAL . 95.5 mt -63.39 -49.6 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -59.21 -41.72 89.28 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.762 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -55.83 -40.13 72.38 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 176.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -67.9 -52.6 34.47 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -69.0 -23.03 64.05 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -173.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 55.9 mt -81.33 -14.84 56.85 Favored 'General case' 0 C--O 1.231 0.113 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 177.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.546 ' HB3' ' CG ' ' A' ' 61' ' ' HIS . 76.4 m -126.39 157.89 68.91 Favored Pre-proline 0 CA--C 1.539 0.554 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -170.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.452 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 64.0 Cg_endo -74.76 -166.56 0.35 Allowed 'Trans proline' 0 CA--C 1.537 0.665 1 C-N-CA 125.34 4.027 . . . . 0.0 114.648 -176.07 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -38.77 -57.2 1.24 Allowed 'General case' 0 C--O 1.236 0.358 0 C-N-CA 128.167 2.587 . . . . 0.0 115.342 -173.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.3 t -58.92 -31.49 68.7 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.774 0.321 . . . . 0.0 110.46 -175.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.546 ' CG ' ' HB3' ' A' ' 57' ' ' CYS . 16.2 m80 -82.49 -23.9 34.45 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.076 0.551 . . . . 0.0 111.272 -178.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -68.31 -44.67 74.89 Favored 'General case' 0 C--N 1.342 0.25 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 172.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 49.2 tp -66.39 -46.2 77.42 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.271 178.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.63 -44.0 97.22 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.153 -1.179 . . . . 0.0 110.153 177.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.3 t -55.82 -50.51 70.32 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.941 0.371 . . . . 0.0 110.064 177.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 37.5 mt -58.58 -39.94 81.74 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 118.692 -0.671 . . . . 0.0 111.645 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -69.2 -29.36 67.32 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.081 0.855 . . . . 0.0 111.789 179.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 64.1 mt -79.1 -39.24 21.18 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 O-C-N 121.797 -0.564 . . . . 0.0 110.588 178.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 75.9 mt -64.81 -35.8 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 175.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.12 -52.79 53.25 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.102 1.361 . . . . 0.0 110.127 177.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.573 ' HB2' HG21 ' A' ' 33' ' ' THR . 81.3 p -66.38 -52.52 45.96 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 120.049 -0.66 . . . . 0.0 112.015 -175.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 37.6 mt -67.86 -34.43 67.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 CA-C-N 117.641 0.2 . . . . 0.0 110.649 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.98 -50.16 59.27 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 111.692 -0.563 . . . . 0.0 111.692 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.7 mtp-105 -68.02 -36.96 80.82 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-N 117.364 0.582 . . . . 0.0 110.866 178.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.95 -40.95 83.14 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 117.623 0.192 . . . . 0.0 110.551 179.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.8 m-30 -64.79 -45.45 86.24 Favored 'General case' 0 CA--C 1.516 -0.332 0 O-C-N 122.147 -0.346 . . . . 0.0 110.093 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 48.4 tp -59.34 -44.7 92.61 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 123.37 0.419 . . . . 0.0 110.209 -177.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -66.3 -43.74 85.42 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 122.259 -0.276 . . . . 0.0 110.315 177.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.1 tp10 -67.03 -27.71 67.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 119.485 -0.293 . . . . 0.0 111.745 -176.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.9 t -94.04 -23.76 17.88 Favored 'General case' 0 CA--C 1.528 0.115 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 69.9 mtm180 -91.61 -33.68 15.01 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-N 119.097 0.862 . . . . 0.0 112.592 176.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 39.5 m -90.29 -10.32 44.61 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -176.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -141.14 158.27 44.14 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.593 0.357 . . . . 0.0 110.221 -178.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 50.3 m -81.59 165.13 21.38 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 122.953 0.501 . . . . 0.0 110.763 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -143.8 162.39 36.18 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.308 0.643 . . . . 0.0 109.788 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 83.8 p -78.74 169.15 18.68 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.225 0.61 . . . . 0.0 111.229 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 52.2 m -137.21 155.05 50.0 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 123.054 0.542 . . . . 0.0 110.227 178.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 50.6 m 57.69 176.17 0.05 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.37 1.068 . . . . 0.0 112.737 -176.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 48.4 t30 55.65 16.01 1.78 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.235 1.014 . . . . 0.0 113.085 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -145.69 150.79 44.53 Favored Pre-proline 0 CA--C 1.53 0.178 0 C-N-CA 123.825 0.85 . . . . 0.0 109.827 179.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -76.39 -14.89 18.06 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 123.424 2.75 . . . . 0.0 110.837 177.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 148.24 -176.13 27.21 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.181 -1.168 . . . . 0.0 110.181 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.51 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -152.76 -157.22 0.77 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 122.897 0.479 . . . . 0.0 110.392 176.305 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.9 p -48.35 -32.58 7.67 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -176.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.82 -46.73 83.8 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.835 0.743 . . . . 0.0 110.074 176.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 66.9 m80 -67.07 -29.79 69.67 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.005 0.522 . . . . 0.0 110.593 178.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.43 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -65.14 -46.6 80.25 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 122.99 0.516 . . . . 0.0 110.462 177.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.8 -42.77 97.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 176.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -61.48 -33.94 74.63 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 122.257 -0.277 . . . . 0.0 111.165 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.1 m -73.36 -42.16 62.56 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.161 -0.337 . . . . 0.0 110.889 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 47.8 mt -60.09 -31.4 69.99 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 174.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.55 -14.53 14.47 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-O 119.019 -0.878 . . . . 0.0 114.23 178.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -101.63 -6.25 24.03 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.957 1.379 . . . . 0.0 112.059 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.446 HG21 HD13 ' A' ' 51' ' ' ILE . 30.1 m -121.75 -19.36 4.56 Favored 'Isoleucine or valine' 0 C--N 1.337 0.048 0 C-N-CA 123.099 0.56 . . . . 0.0 111.846 -178.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.406 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.9 tp -52.14 -26.99 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 C-N-CA 122.891 0.476 . . . . 0.0 112.055 -178.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.427 ' HA ' ' HB1' ' A' ' 144' ' ' ALA . 17.3 pt20 -59.44 -57.21 14.0 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 122.896 0.479 . . . . 0.0 111.499 177.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -76.37 -32.81 58.82 Favored 'General case' 0 N--CA 1.457 -0.115 0 O-C-N 122.137 -0.352 . . . . 0.0 111.409 -177.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.4 mt -61.65 -49.48 76.39 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.415 HD12 ' CB ' ' A' ' 144' ' ' ALA . 70.7 mt -65.41 -58.18 6.49 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.343 -0.836 . . . . 0.0 109.989 177.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 98.0 p -50.33 -43.93 54.14 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.093 0.861 . . . . 0.0 111.735 -173.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -68.49 -52.53 31.32 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 118.422 0.555 . . . . 0.0 110.776 177.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.461 ' O ' ' HE3' ' A' ' 115' ' ' LYS . . . -56.19 -33.06 64.96 Favored 'General case' 0 N--CA 1.457 -0.107 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -177.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -87.15 -36.16 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 119.853 1.206 . . . . 0.0 112.374 175.295 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.44 -25.49 63.22 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 119.771 -0.772 . . . . 0.0 110.747 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.461 ' HE3' ' O ' ' A' ' 112' ' ' ALA . 0.1 OUTLIER -80.2 -20.09 45.52 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.629 0.772 . . . . 0.0 110.536 177.277 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.7 m -77.08 159.18 30.03 Favored 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -171.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -90.62 175.79 6.91 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.831 1.253 . . . . 0.0 107.859 170.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -55.97 -40.76 73.73 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.832 -0.542 . . . . 0.0 112.069 -177.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -69.7 -36.77 76.22 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.958 -0.464 . . . . 0.0 110.654 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -75.3 -42.92 53.63 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 118.734 -0.651 . . . . 0.0 110.843 -178.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.404 ' HD2' ' C ' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -64.88 -33.66 76.54 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 119.539 1.063 . . . . 0.0 109.78 176.348 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.1 -46.5 87.04 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.023 177.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -63.89 -37.59 87.97 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.688 177.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 92.7 mt -68.58 -35.55 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -65.44 -40.1 92.86 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 176.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 24.2 ttt -62.41 -43.13 99.55 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 176.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.0 tt -58.04 -44.63 87.52 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 178.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.9 mt -71.45 -32.13 67.97 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -64.66 -43.55 93.24 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.3 mt -66.26 -39.52 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 59.8 t-105 -63.66 -29.21 70.48 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 122.177 0.191 . . . . 0.0 110.743 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -73.17 -42.39 62.82 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 174.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -70.51 -16.24 62.87 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 67.6 m -62.39 -14.67 42.78 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 118.381 0.537 . . . . 0.0 112.068 175.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 75.5 10.74 84.62 Favored Glycine 0 CA--C 1.531 1.049 0 CA-C-O 119.696 -0.502 . . . . 0.0 113.035 176.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 54.0 tp -68.12 -20.48 64.91 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.06 0.93 . . . . 0.0 110.461 178.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -144.67 170.05 16.82 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.174 0.99 . . . . 0.0 108.959 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 54.3 mm-40 -68.73 163.73 23.32 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -62.96 138.56 58.59 Favored 'General case' 0 N--CA 1.455 -0.183 0 O-C-N 122.07 -0.394 . . . . 0.0 110.571 -178.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 23.5 m 54.48 21.65 3.43 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.109 0.964 . . . . 0.0 112.958 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -86.26 -7.14 58.74 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 122.245 -0.285 . . . . 0.0 111.684 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 82.7 mt -68.4 138.35 55.27 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -132.73 -17.34 2.52 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 119.307 -0.378 . . . . 0.0 111.459 -177.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.439 ' C ' ' H ' ' A' ' 146' ' ' ARG . . . -40.67 -40.29 1.26 Allowed 'General case' 0 C--N 1.343 0.29 0 C-N-CA 125.766 1.627 . . . . 0.0 113.439 -174.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -68.77 22.03 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 123.245 0.618 . . . . 0.0 112.387 175.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.439 ' H ' ' C ' ' A' ' 144' ' ' ALA . 79.3 mtp180 51.34 24.61 2.18 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 124.684 1.193 . . . . 0.0 110.959 -170.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 9.1 t 49.39 23.76 0.93 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.06 0.544 . . . . 0.0 111.96 -171.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -97.78 170.13 9.2 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.614 0.766 . . . . 0.0 112.773 -173.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 28.6 p -55.09 -14.09 1.45 Allowed 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 124.426 1.091 . . . . 0.0 112.306 -177.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 18.6 m-30 -29.96 -66.21 0.1 Allowed 'General case' 0 C--N 1.34 0.164 0 C-N-CA 125.033 1.333 . . . . 0.0 110.35 175.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -113.18 -13.11 13.03 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.168 167.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 32.3 mmt -73.46 0.14 13.26 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.934 0.788 . . . . 0.0 111.969 179.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -55.45 -20.6 12.99 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.508 0.723 . . . . 0.0 112.066 175.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 95.6 mt . . . . . 0 C--O 1.249 1.063 0 CA-C-O 117.666 -1.159 . . . . 0.0 109.75 179.106 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 54.1 p90 . . . . . 0 N--CA 1.475 0.783 0 CA-C-O 120.568 0.223 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 90.1 p -150.97 166.61 14.69 Favored Pre-proline 0 CA--C 1.532 0.287 0 C-N-CA 123.209 0.604 . . . . 0.0 109.839 -179.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -54.02 149.83 33.5 Favored 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 123.69 2.927 . . . . 0.0 112.794 178.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 43.5 p -139.86 21.02 2.49 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 123.158 0.583 . . . . 0.0 111.752 -177.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 160' ' ' PRO . . . . . 0.49 ' HD2' ' N ' ' A' ' 27' ' ' SER . 63.5 Cg_endo -69.21 -65.16 0.03 OUTLIER 'Cis proline' 0 N--CA 1.456 -0.69 0 CA-C-N 119.572 0.883 . . . . 0.0 110.864 -4.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . 0.482 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 41.2 t -168.43 145.55 3.96 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 124.186 0.994 . . . . 0.0 108.585 175.109 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -157.75 137.84 12.52 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 117.842 0.292 . . . . 0.0 111.434 174.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 12.2 t -135.37 144.98 51.87 Favored Pre-proline 0 N--CA 1.454 -0.227 0 C-N-CA 123.773 0.829 . . . . 0.0 110.362 -178.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -67.81 -0.09 4.95 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 123.186 2.591 . . . . 0.0 110.707 178.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 37.9 m -71.08 -30.24 66.31 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.582 0.353 . . . . 0.0 110.568 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -74.15 -20.81 18.62 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 123.369 2.713 . . . . 0.0 112.446 178.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 31.0 t . . . . . 0 C--O 1.252 1.222 0 CA-C-O 117.268 -1.348 . . . . 0.0 110.703 -177.424 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.474 0.756 0 N-CA-C 110.56 -0.163 . . . . 0.0 110.56 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -137.44 163.84 30.11 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.243 0.617 . . . . 0.0 109.93 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -147.58 148.74 31.46 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 120.974 0.416 . . . . 0.0 110.588 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -149.11 156.86 42.83 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.969 0.908 . . . . 0.0 108.821 176.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -137.52 24.66 2.91 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -177.188 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -81.3 -151.73 0.09 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 175.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -55.81 -14.77 2.55 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.768 -0.583 . . . . 0.0 111.189 177.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.5 tp60 -55.3 -40.18 70.79 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.265 0.626 . . . . 0.0 110.836 177.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -64.44 -38.64 91.72 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.754 0.706 . . . . 0.0 111.004 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -64.46 -55.13 22.86 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.501 0.591 . . . . 0.0 109.897 178.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.8 t -60.04 -55.37 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 -178.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.12 -33.28 67.19 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 123.248 0.619 . . . . 0.0 112.026 -178.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 53.5 m -70.22 -45.17 67.11 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.847 0.749 . . . . 0.0 110.415 177.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.8 tp -65.6 -33.06 75.04 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.216 0.531 . . . . 0.0 109.741 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -66.72 -45.92 77.15 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 123.916 0.886 . . . . 0.0 110.325 178.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 73.1 m -63.23 -29.45 70.79 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 174.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.79 -29.62 64.66 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.545 0.338 . . . . 0.0 110.264 176.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -77.7 -43.54 30.79 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.894 0.478 . . . . 0.0 111.635 176.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -76.1 -26.61 56.61 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 112.956 0.725 . . . . 0.0 112.956 -173.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.1 mt -141.61 160.0 41.07 Favored 'General case' 0 N--CA 1.458 -0.057 0 C-N-CA 122.868 0.467 . . . . 0.0 110.756 -177.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -104.44 158.58 16.37 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 123.194 0.597 . . . . 0.0 109.793 177.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 92.3 p -146.56 11.18 1.11 Allowed 'General case' 0 CA--C 1.527 0.083 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.81 30.96 62.91 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 110.354 -1.099 . . . . 0.0 110.354 -176.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.4 mm 58.29 42.99 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 C-N-CA 124.123 0.969 . . . . 0.0 110.389 -175.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.0 t -57.53 136.56 56.74 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 120.974 0.416 . . . . 0.0 110.844 -177.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.59 -24.12 72.4 Favored Glycine 0 CA--C 1.526 0.731 0 CA-C-O 118.999 -0.889 . . . . 0.0 113.911 -172.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.422 ' O ' ' HE3' ' A' ' 31' ' ' LYS . 81.0 p -63.36 -35.89 81.9 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 118.958 1.379 . . . . 0.0 111.217 -175.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -65.52 -44.54 86.65 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 178.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 48.7 mt -61.5 -40.59 86.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -63.68 -38.5 91.36 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 119.241 -0.409 . . . . 0.0 111.415 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.422 ' HE3' ' O ' ' A' ' 27' ' ' SER . 0.0 OUTLIER -64.28 -47.32 79.96 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 118.627 0.649 . . . . 0.0 109.85 175.194 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 92.8 mt -60.28 -56.82 16.89 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 122.395 -0.191 . . . . 0.0 110.973 -178.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.405 HG21 ' OG ' ' A' ' 71' ' ' SER . 75.9 p -58.28 -48.06 81.65 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 t -63.27 -42.48 99.13 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.247 -0.581 . . . . 0.0 111.453 -175.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -75.56 -22.94 56.57 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.99 -55.6 13.77 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 119.043 0.838 . . . . 0.0 109.166 167.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 61.8 mt -69.78 -15.72 63.17 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.21 1.004 . . . . 0.0 113.05 -175.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -57.07 -29.49 63.49 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -178.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.5 t-160 -150.91 -24.65 0.22 Allowed 'General case' 0 N--CA 1.461 0.122 0 N-CA-C 113.994 1.109 . . . . 0.0 113.994 -176.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.405 HG22 HG22 ' A' ' 93' ' ' THR . 40.3 mm 45.73 73.92 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-O 122.06 0.933 . . . . 0.0 111.351 -179.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -138.02 8.63 2.75 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.23 1.012 . . . . 0.0 109.83 178.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.528 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -142.72 109.61 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 125.142 1.377 . . . . 0.0 107.913 -178.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.472 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -104.92 -67.96 0.88 Allowed 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -177.342 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.431 ' H ' ' HG2' ' A' ' 43' ' ' GLU . 81.6 p -68.29 -23.16 64.71 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 122.98 0.512 . . . . 0.0 111.894 -173.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.622 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -73.36 -54.8 7.45 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.799 0.84 . . . . 0.0 109.299 178.377 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.419 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 8.6 mt -57.25 -45.79 84.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 C-N-CA 122.836 0.454 . . . . 0.0 110.143 175.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 14.6 mm -69.5 -47.98 69.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 CA-C-O 119.143 -0.456 . . . . 0.0 111.988 -177.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 95.5 p -63.02 -30.65 71.76 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-N 119.294 0.952 . . . . 0.0 110.227 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 46.4 tp -68.66 -45.72 71.0 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 119.15 -0.452 . . . . 0.0 111.772 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.5 pt -73.08 -36.77 51.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 119.192 0.905 . . . . 0.0 111.677 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.474 HD13 HG21 ' A' ' 104' ' ' VAL . 93.7 mt -62.03 -53.33 49.23 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.124 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.451 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 36.3 t70 -62.67 -31.47 72.37 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.517 179.12 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -61.14 -41.42 96.72 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.1 t -69.36 -35.99 76.4 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.935 175.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.451 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 50.9 tpt85 -66.53 -41.82 88.15 Favored 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -174.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 71.7 mt -96.06 -14.51 22.86 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 113.952 1.093 . . . . 0.0 113.952 -172.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 82.0 m -101.61 162.48 20.31 Favored Pre-proline 0 CA--C 1.536 0.432 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -170.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_exo -55.68 177.49 0.13 Allowed 'Trans proline' 0 N--CA 1.461 -0.431 1 C-N-CA 125.637 4.225 . . . . 0.0 115.188 179.261 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -56.88 -46.2 82.03 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.28 1.032 . . . . 0.0 113.293 -175.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 73.1 m -60.87 -26.88 67.72 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 5.5 m80 -81.77 -23.74 36.43 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 119.243 -0.408 . . . . 0.0 110.803 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -73.82 -44.77 54.77 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.877 0.762 . . . . 0.0 109.23 175.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.99 -50.09 65.51 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 177.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.59 -41.85 93.8 Favored Glycine 0 C--N 1.337 0.619 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.8 t -67.55 -37.76 83.16 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.713 0.756 . . . . 0.0 110.538 179.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 32.1 mt -59.79 -36.12 76.07 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 119.522 1.056 . . . . 0.0 110.756 175.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -73.08 -32.76 65.2 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 119.485 -0.886 . . . . 0.0 111.644 176.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 79.0 mt -67.04 -48.03 80.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 118.819 0.736 . . . . 0.0 109.915 175.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 72.1 mt -61.12 -35.9 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 C-N-CA 124.226 1.01 . . . . 0.0 109.431 178.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -66.91 -45.49 77.77 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 118.88 -0.581 . . . . 0.0 110.418 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.405 ' OG ' HG21 ' A' ' 33' ' ' THR . 7.5 t -63.86 -54.52 33.63 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 118.794 0.724 . . . . 0.0 111.336 -178.213 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 55.5 mt -63.16 -33.77 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.22 -51.95 34.96 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-O 119.545 -0.586 . . . . 0.0 112.437 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.646 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -70.51 -31.83 69.08 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 118.056 0.928 . . . . 0.0 110.625 -178.525 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.71 -46.75 71.33 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -61.29 -46.95 88.21 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 176.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 66.4 tp -56.91 -45.63 82.53 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.587 0.355 . . . . 0.0 110.483 -177.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -66.61 -48.28 70.0 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.761 179.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.9 mm-40 -61.87 -27.77 69.03 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -175.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.2 t -97.79 -24.84 15.27 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 36.9 ptt180 -79.13 -24.68 43.18 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 119.346 0.976 . . . . 0.0 111.408 177.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.3 m -68.35 -14.05 62.72 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 175.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -80.27 153.48 28.45 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 120.823 0.344 . . . . 0.0 110.85 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 49.3 m -139.0 23.5 2.59 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.844 0.858 . . . . 0.0 110.353 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.8 p30 -130.7 -174.86 3.48 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.765 0.826 . . . . 0.0 110.383 -176.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 80.7 p -71.25 -2.81 17.33 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -177.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 36.1 m -77.79 0.45 23.7 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.418 0.554 . . . . 0.0 111.747 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 77.8 p -130.71 18.26 5.19 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 123.588 0.755 . . . . 0.0 110.421 177.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -127.33 26.04 6.06 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.725 0.81 . . . . 0.0 110.507 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -129.91 155.56 80.37 Favored Pre-proline 0 C--O 1.231 0.091 0 C-N-CA 124.139 0.976 . . . . 0.0 109.805 -178.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.27 166.4 27.11 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 123.472 2.781 . . . . 0.0 110.864 177.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 82.45 178.03 52.18 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.084 -178.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.405 HG22 HG22 ' A' ' 40' ' ' ILE . 0.6 OUTLIER 53.87 -169.87 0.05 Allowed 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 125.514 1.526 . . . . 0.0 114.901 179.249 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.5 p -50.06 -31.54 13.33 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 -173.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.08 -47.52 82.54 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.872 0.76 . . . . 0.0 109.981 176.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -67.69 -31.29 71.15 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.3 0.572 . . . . 0.0 110.4 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.37 -45.93 82.16 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.366 -178.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.6 mt -64.72 -42.73 95.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 174.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -59.75 -32.81 70.91 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 122.546 -0.096 . . . . 0.0 111.034 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.9 m -76.39 -41.39 48.07 Favored 'General case' 0 C--O 1.227 -0.08 0 C-N-CA 122.421 0.288 . . . . 0.0 111.162 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 58.4 mt -61.79 -29.26 70.02 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-N 118.867 0.758 . . . . 0.0 109.166 174.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.99 -14.38 31.11 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-O 119.199 -0.779 . . . . 0.0 113.562 178.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -101.84 -3.81 27.36 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 118.806 1.303 . . . . 0.0 112.136 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.474 HG21 HD13 ' A' ' 51' ' ' ILE . 27.4 m -125.86 -17.97 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.1 tp -48.96 -30.5 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 C-N-CA 123.171 0.588 . . . . 0.0 112.458 -178.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -64.23 -45.42 88.26 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.24 0.473 . . . . 0.0 110.713 178.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -74.07 -38.95 63.78 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.282 0.633 . . . . 0.0 110.082 -178.233 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.0 mt -62.92 -53.04 60.2 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.24 -178.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.437 ' O ' HG13 ' A' ' 113' ' ' ILE . 81.0 mt -63.82 -59.11 4.96 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.71 -0.662 . . . . 0.0 109.463 177.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.443 ' HB2' ' CZ ' ' A' ' 150' ' ' PHE . 77.7 p -48.82 -45.53 40.63 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 119.008 0.822 . . . . 0.0 112.457 -174.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 89.5 m-20 -69.13 -44.76 71.72 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 118.852 0.751 . . . . 0.0 110.764 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.05 -44.88 94.39 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 118.306 0.503 . . . . 0.0 111.434 -177.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -74.73 -33.44 31.24 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.13 0 CA-C-N 118.661 0.664 . . . . 0.0 112.138 179.864 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.21 -26.94 65.97 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.572 176.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.75 -17.65 57.34 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 125.963 1.705 . . . . 0.0 110.842 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 37.6 m -83.48 155.89 23.15 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -172.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 -103.32 -175.94 2.94 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 169.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 22.2 tm0? -55.54 -41.2 72.87 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 119.398 0.999 . . . . 0.0 110.982 -178.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.81 -45.85 87.77 Favored 'General case' 0 C--O 1.233 0.206 0 O-C-N 121.583 -0.698 . . . . 0.0 110.891 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 46.6 m170 -73.29 -37.6 66.19 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 118.783 -0.627 . . . . 0.0 111.737 -176.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.72 -34.03 76.95 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 119.278 0.945 . . . . 0.0 109.0 176.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -66.04 -41.69 90.54 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -65.39 -42.63 92.42 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 176.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.4 -35.87 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 80.1 ttt-85 -67.77 -34.34 76.61 Favored 'General case' 0 N--CA 1.453 -0.316 0 O-C-N 122.31 -0.244 . . . . 0.0 110.708 177.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.2 ttt -66.1 -44.37 84.53 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 176.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.422 ' C ' HD23 ' A' ' 127' ' ' LEU . 6.4 tt -56.29 -48.9 75.7 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 79.0 mt -73.03 -26.54 61.34 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -178.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -68.42 -36.56 79.26 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 175.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 84.8 mt -69.23 -42.62 81.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.112 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 175.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 28.3 m0 -62.68 -30.64 71.54 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 121.12 -0.232 . . . . 0.0 110.579 177.23 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -75.44 -40.27 57.79 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 122.115 -0.365 . . . . 0.0 111.378 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 47.1 mtm105 -78.84 -14.08 59.44 Favored 'General case' 0 C--O 1.231 0.098 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 55.7 p -57.68 -18.79 22.71 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 118.394 0.543 . . . . 0.0 111.836 176.032 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 71.78 9.81 70.87 Favored Glycine 0 CA--C 1.53 0.995 0 CA-C-O 119.435 -0.647 . . . . 0.0 112.528 177.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 58.5 tp -56.72 121.36 9.6 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 118.024 0.912 . . . . 0.0 110.646 -177.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 52.01 11.35 0.15 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.348 1.459 . . . . 0.0 114.058 -178.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 48.85 28.79 2.04 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.391 1.077 . . . . 0.0 113.687 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -75.69 -27.98 58.46 Favored 'General case' 0 C--N 1.34 0.18 0 O-C-N 121.879 -0.513 . . . . 0.0 111.223 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 21.7 m 51.18 18.24 0.57 Allowed 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 177.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -149.58 154.57 38.9 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.236 0.471 . . . . 0.0 110.986 179.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 65.3 tp -153.24 124.25 7.42 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 175.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 53.2 p-10 -77.34 -15.42 59.41 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -175.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -54.84 -32.03 60.11 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.305 0.642 . . . . 0.0 111.703 -173.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.65 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -116.72 -29.37 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.14 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 171.81 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 95.0 mtt-85 -67.98 -14.09 62.69 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 118.013 0.37 . . . . 0.0 111.491 -177.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 35.6 t -69.21 -23.82 63.94 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 118.746 -0.645 . . . . 0.0 112.167 178.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.555 ' HG2' ' H ' ' A' ' 149' ' ' CYS . 40.6 tttt -155.12 178.52 10.11 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 123.085 1.422 . . . . 0.0 114.729 -176.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . 0.555 ' H ' ' HG2' ' A' ' 148' ' ' LYS . 69.9 m -55.41 -8.54 0.35 Allowed 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 125.785 1.634 . . . . 0.0 112.359 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . 0.443 ' CZ ' ' HB2' ' A' ' 110' ' ' SER . 22.0 m-85 -33.03 -71.41 0.06 Allowed 'General case' 0 CA--C 1.519 -0.229 0 C-N-CA 125.014 1.325 . . . . 0.0 109.408 176.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -113.47 -8.99 13.36 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.111 167.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 34.4 mmt -73.84 -16.6 61.13 Favored 'General case' 0 C--N 1.345 0.401 0 CA-C-N 120.131 1.332 . . . . 0.0 111.713 176.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 2.3 p30 50.03 -2.07 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 127.136 2.174 . . . . 0.0 116.137 -178.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 62.1 tp . . . . . 0 C--O 1.25 1.092 0 CA-C-O 117.18 -1.39 . . . . 0.0 110.173 179.273 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 39.2 t80 . . . . . 0 N--CA 1.475 0.776 0 CA-C-O 120.498 0.189 . . . . 0.0 110.568 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 62.9 p -144.85 153.75 54.44 Favored Pre-proline 0 CA--C 1.529 0.164 0 C-N-CA 123.537 0.735 . . . . 0.0 110.054 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -70.67 160.05 50.7 Favored 'Trans proline' 0 N--CA 1.453 -0.898 0 C-N-CA 123.941 3.094 . . . . 0.0 111.407 -178.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 64.5 p -135.71 165.0 26.58 Favored 'General case' 0 C--O 1.231 0.115 0 C-N-CA 123.46 0.704 . . . . 0.0 109.85 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 159' ' ' SEP . . . . . 0.401 ' HA ' ' HA ' ' B' ' 160' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 160' ' ' PRO . . . . . 0.401 ' HA ' ' HA ' ' B' ' 159' ' ' SEP . 78.4 Cg_endo -76.27 -179.88 28.68 Favored 'Cis proline' 0 N--CA 1.457 -0.675 0 CA-C-N 118.857 0.628 . . . . 0.0 110.743 -5.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 38.9 t -68.02 152.47 45.47 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 174.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 162' ' ' TYR . . . . . 0.464 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 17.8 t80 -143.81 132.13 22.03 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 29.2 t -127.59 144.36 50.77 Favored Pre-proline 0 N--CA 1.452 -0.365 0 C-N-CA 123.348 0.659 . . . . 0.0 110.619 177.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -65.54 -7.01 14.91 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 122.888 2.392 . . . . 0.0 111.564 175.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 80.6 p -91.95 22.79 4.05 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.043 0.537 . . . . 0.0 111.975 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -61.14 168.4 7.65 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.306 2.004 . . . . 0.0 111.02 170.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 44.8 m . . . . . 0 C--O 1.252 1.185 0 CA-C-O 117.977 -1.011 . . . . 0.0 111.546 -179.067 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt . . . . . 0 N--CA 1.476 0.85 0 CA-C-O 120.537 0.208 . . . . 0.0 110.641 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -139.08 154.38 48.16 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.114 0.566 . . . . 0.0 110.025 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -153.24 147.68 25.98 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.07 0.548 . . . . 0.0 110.114 179.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -150.67 147.29 27.2 Favored 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 175.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -139.08 26.82 2.41 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 123.131 0.572 . . . . 0.0 110.793 -179.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.406 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 16.4 t70 -85.02 -145.06 0.09 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 177.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.406 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 18.1 t80 -55.54 -16.03 3.47 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.351 0.66 . . . . 0.0 111.636 179.205 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -56.04 -43.43 77.84 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.737 0.415 . . . . 0.0 111.018 177.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -63.4 -36.87 85.17 Favored 'General case' 0 C--O 1.227 -0.118 0 CA-C-N 118.321 0.509 . . . . 0.0 110.542 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -65.85 -54.44 26.77 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 117.812 0.278 . . . . 0.0 110.366 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 63.9 t -60.63 -53.73 44.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.03 -32.81 68.33 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 123.453 0.701 . . . . 0.0 112.162 -177.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 88.1 m -73.71 -40.88 63.27 Favored 'General case' 0 C--N 1.338 0.101 0 CA-C-N 118.557 0.617 . . . . 0.0 110.469 176.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.1 tp -66.7 -30.55 70.81 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.957 0.408 . . . . 0.0 110.061 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -72.65 -40.38 66.4 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.03 0.932 . . . . 0.0 109.691 176.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.0 t -62.12 -30.4 71.0 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 174.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.64 -41.53 68.7 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 122.917 0.487 . . . . 0.0 109.89 175.316 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.412 ' HB2' ' HE3' ' A' ' 18' ' ' LYS . 39.1 ttmt -65.05 -28.92 69.81 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 123.821 0.848 . . . . 0.0 111.269 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -69.13 -14.47 63.01 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.758 0.423 . . . . 0.0 112.056 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.2 mt -101.13 167.76 10.02 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.238 0.615 . . . . 0.0 110.521 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -132.74 -0.64 3.47 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.24 0.616 . . . . 0.0 111.519 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 32.2 t -153.59 159.72 42.23 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.195 0.598 . . . . 0.0 109.475 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.29 137.16 2.12 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -178.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.8 mm -118.37 50.65 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.107 0 C-N-CA 124.5 1.12 . . . . 0.0 108.079 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.2 m -49.9 124.55 10.11 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.025 0.53 . . . . 0.0 111.951 -174.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.86 -19.41 63.19 Favored Glycine 0 CA--C 1.525 0.659 0 CA-C-O 119.584 -0.565 . . . . 0.0 112.301 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.426 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 42.0 t -66.31 -39.2 89.14 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.173 0.987 . . . . 0.0 110.169 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.6 mmp_? -60.09 -45.66 92.19 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 58.3 mt -65.65 -34.51 70.84 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.924 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.7 tmtt? -63.02 -43.75 97.85 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 122.084 -0.385 . . . . 0.0 110.466 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.426 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.4 OUTLIER -65.26 -43.73 90.38 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 118.152 0.433 . . . . 0.0 110.705 176.251 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.5 mt -62.17 -57.93 9.65 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 121.261 -0.176 . . . . 0.0 110.875 -178.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.565 HG21 ' HB2' ' A' ' 71' ' ' SER . 51.5 p -56.29 -48.98 75.55 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 178.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.3 t -63.44 -44.86 93.32 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 120.021 -0.672 . . . . 0.0 111.6 -174.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -76.78 -21.33 55.31 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.07 -56.66 9.09 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 167.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 46.9 mt -68.97 -17.51 63.94 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.524 1.13 . . . . 0.0 113.075 -175.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -59.9 -26.14 65.66 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -178.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -149.04 -28.46 0.28 Allowed 'General case' 0 C--N 1.34 0.154 0 N-CA-C 113.84 1.052 . . . . 0.0 113.84 -175.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.575 HG22 HG22 ' A' ' 93' ' ' THR . 37.9 mm 44.87 74.76 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-O 121.923 0.868 . . . . 0.0 111.605 -179.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -147.98 22.41 1.1 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.354 1.062 . . . . 0.0 109.234 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.558 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -148.63 38.83 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.116 0 C-N-CA 124.765 1.226 . . . . 0.0 109.251 -171.176 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.53 ' CD ' ' H ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -52.95 -57.13 11.35 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -174.508 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.53 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 88.4 p -72.67 -26.35 61.6 Favored 'General case' 0 CA--C 1.521 -0.144 0 O-C-N 121.489 -0.757 . . . . 0.0 112.37 -173.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.682 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.18 -44.35 16.53 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 119.189 -0.434 . . . . 0.0 109.932 -179.074 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 38.0 mt -55.48 -50.85 63.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 171.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 15.9 mm -66.92 -51.81 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -176.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 73.8 m -57.68 -33.59 68.52 Favored 'General case' 0 N--CA 1.458 -0.058 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.324 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.1 tp -69.4 -45.41 69.3 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 118.582 -0.723 . . . . 0.0 112.083 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 38.1 pt -71.35 -34.42 53.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 119.63 1.105 . . . . 0.0 111.699 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.532 HD13 HG21 ' A' ' 104' ' ' VAL . 97.7 mt -63.05 -55.49 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -64.51 -27.12 68.75 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.308 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -62.78 -45.56 92.1 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 175.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.7 t -61.2 -43.37 98.99 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.903 0.382 . . . . 0.0 110.154 175.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 14.7 tpp180 -59.31 -44.86 92.51 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.801 0.84 . . . . 0.0 112.698 -176.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 70.2 mt -89.66 -15.04 33.54 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 -173.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 72.5 m -100.5 165.28 14.67 Favored Pre-proline 0 CA--C 1.537 0.461 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -172.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.68 177.31 0.24 Allowed 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 125.298 3.998 . . . . 0.0 115.036 -178.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -58.78 -41.47 86.74 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.853 0.861 . . . . 0.0 111.875 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.9 m -60.09 -21.3 61.33 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 177.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -93.55 -20.13 20.54 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 118.848 -0.596 . . . . 0.0 111.141 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.8 mptt -64.49 -46.63 82.15 Favored 'General case' 0 C--N 1.342 0.239 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 167.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -65.15 -52.46 55.01 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.47 -42.51 93.91 Favored Glycine 0 C--N 1.338 0.641 0 N-CA-C 111.581 -0.608 . . . . 0.0 111.581 -179.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.9 t -68.83 -34.81 76.11 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 117.735 0.767 . . . . 0.0 110.493 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.4 mt -62.57 -32.45 73.43 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 119.47 1.032 . . . . 0.0 110.818 174.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -73.81 -31.47 63.26 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.845 0.748 . . . . 0.0 111.417 175.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 80.7 mt -72.58 -40.43 62.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 118.622 0.646 . . . . 0.0 110.769 175.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.7 mt -66.63 -35.05 73.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -67.17 -45.47 76.89 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 119.023 -0.513 . . . . 0.0 110.82 176.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.565 ' HB2' HG21 ' A' ' 33' ' ' THR . 79.3 p -66.03 -57.14 8.42 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 118.534 0.606 . . . . 0.0 110.832 -176.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 59.3 mt -64.19 -32.07 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.76 -55.87 17.69 Favored Glycine 0 CA--C 1.527 0.796 0 CA-C-O 119.813 -0.437 . . . . 0.0 112.52 178.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.635 ' HG3' HH11 ' A' ' 74' ' ' ARG . 0.0 OUTLIER -66.6 -30.8 71.17 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-N 117.964 0.882 . . . . 0.0 110.561 -178.929 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.03 -44.93 71.72 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 122.574 -0.078 . . . . 0.0 110.828 176.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -64.05 -48.24 77.02 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 177.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 57.5 tp -58.26 -47.52 83.33 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 122.834 0.454 . . . . 0.0 110.08 -176.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -64.12 -43.15 96.18 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.407 -0.183 . . . . 0.0 110.599 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -65.18 -34.58 78.71 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -175.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.5 t -94.6 -18.63 21.2 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -177.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -100.42 -24.18 14.56 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 119.027 0.83 . . . . 0.0 112.802 178.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 11.8 t -91.35 -14.05 31.42 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 118.383 0.538 . . . . 0.0 112.196 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -141.07 161.75 37.12 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.549 0.34 . . . . 0.0 110.095 -177.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 92.5 p -147.22 173.24 12.72 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.386 0.674 . . . . 0.0 110.475 -178.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -130.16 27.46 5.1 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 122.852 0.461 . . . . 0.0 110.648 -179.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 36.3 m 55.55 27.19 10.01 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.756 0.822 . . . . 0.0 112.707 -178.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 71.0 m -135.66 160.89 37.09 Favored 'General case' 0 C--O 1.23 0.073 0 C-N-CA 123.505 0.722 . . . . 0.0 110.43 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 79.5 p -150.32 173.28 14.17 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.435 0.694 . . . . 0.0 110.508 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 37.4 t30 58.98 -177.79 0.08 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.452 1.101 . . . . 0.0 111.772 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt 50.15 55.17 16.65 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 124.435 1.094 . . . . 0.0 112.161 -179.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.02 156.81 64.14 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 123.369 2.712 . . . . 0.0 110.689 -179.168 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 176.27 28.73 0.04 OUTLIER Glycine 0 CA--C 1.525 0.692 0 N-CA-C 111.659 -0.576 . . . . 0.0 111.659 -178.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.575 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -146.4 -155.14 0.59 Allowed 'General case' 0 C--N 1.34 0.189 0 CA-C-N 117.205 0.503 . . . . 0.0 110.868 -175.93 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.6 p -47.37 -31.74 4.27 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -176.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.27 -45.61 87.34 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.807 0.73 . . . . 0.0 109.943 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 46.1 t60 -66.87 -29.62 69.57 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 123.482 0.713 . . . . 0.0 109.927 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.17 -43.82 77.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 123.045 0.538 . . . . 0.0 110.548 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.17 -43.58 98.91 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.069 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 174.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -59.53 -33.83 71.87 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.682 -0.236 . . . . 0.0 111.13 178.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.1 m -73.72 -42.05 61.72 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 122.302 -0.249 . . . . 0.0 111.218 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 48.7 mt -60.39 -30.21 69.44 Favored 'General case' 0 C--N 1.339 0.126 0 O-C-N 121.418 -0.802 . . . . 0.0 109.274 173.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.43 -14.91 22.15 Favored Glycine 0 CA--C 1.531 1.076 0 CA-C-O 119.112 -0.827 . . . . 0.0 113.918 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -100.82 -6.92 24.15 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.016 1.408 . . . . 0.0 112.074 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.532 HG21 HD13 ' A' ' 51' ' ' ILE . 27.1 m -123.42 -17.91 4.42 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -177.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.434 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.0 tp -55.22 -26.08 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 CA-C-N 118.246 0.476 . . . . 0.0 111.527 -177.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.402 ' HG2' ' H ' ' A' ' 106' ' ' GLN . 16.9 pt20 -61.54 -53.32 57.86 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.379 0.672 . . . . 0.0 111.65 176.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -75.55 -34.48 60.73 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 122.002 -0.436 . . . . 0.0 110.912 -178.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 88.9 mt -62.38 -46.94 86.37 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.554 ' O ' HD12 ' A' ' 113' ' ' ILE . 55.9 mt -71.31 -53.95 12.49 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 118.532 -0.747 . . . . 0.0 111.19 179.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 69.2 p -55.06 -35.76 64.86 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 119.033 0.833 . . . . 0.0 111.118 -176.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -70.1 -48.62 56.87 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-N 118.798 0.726 . . . . 0.0 110.269 173.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.96 -34.39 65.64 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.984 0.914 . . . . 0.0 113.369 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.554 HD12 ' O ' ' A' ' 109' ' ' LEU . 0.2 OUTLIER -84.5 -38.08 13.27 Favored 'Isoleucine or valine' 0 C--N 1.343 0.288 0 C-N-CA 117.482 -1.687 . . . . 0.0 112.667 170.794 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.27 -22.42 66.94 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.881 0.764 . . . . 0.0 110.85 -178.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.04 -17.11 30.02 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.064 0.946 . . . . 0.0 110.995 178.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.42 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 53.1 p -85.41 167.57 15.4 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -172.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -102.5 177.17 4.94 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 168.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.3 -33.27 63.13 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 118.546 0.612 . . . . 0.0 112.32 -176.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -70.63 -49.93 42.36 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 122.03 -0.419 . . . . 0.0 111.312 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.42 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 6.2 m170 -67.56 -34.07 76.31 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-O 119.052 -0.499 . . . . 0.0 110.41 179.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.5 ttpt -55.67 -51.94 65.55 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 118.736 0.698 . . . . 0.0 109.204 171.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -58.94 -38.96 80.22 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 120.674 -0.411 . . . . 0.0 110.864 -176.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.8 mtpp -63.06 -41.59 99.5 Favored 'General case' 0 N--CA 1.455 -0.187 0 O-C-N 122.338 -0.226 . . . . 0.0 110.955 175.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 97.9 mt -67.65 -36.45 76.13 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 O-C-N 121.863 -0.523 . . . . 0.0 109.595 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -66.26 -32.58 74.08 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 176.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.4 ttt -65.67 -42.68 91.04 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 175.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 89.2 mt -58.99 -43.32 91.46 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.119 175.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.1 mt -65.62 -36.1 82.73 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 117.676 0.216 . . . . 0.0 111.315 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -66.22 -39.74 89.81 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 118.05 0.386 . . . . 0.0 110.51 178.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.4 mt -67.15 -42.76 88.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 N-CA-C 110.321 -0.252 . . . . 0.0 110.321 177.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 48.4 m0 -67.7 -31.27 71.11 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 117.938 0.336 . . . . 0.0 110.872 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -73.38 -36.44 66.06 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 117.516 0.144 . . . . 0.0 110.94 176.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 51.1 tpt85 -70.67 -31.53 68.47 Favored 'General case' 0 CA--C 1.528 0.12 0 O-C-N 122.325 -0.235 . . . . 0.0 111.03 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 69.1 m -82.06 -8.55 59.67 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.966 0.506 . . . . 0.0 111.446 176.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -67.34 164.09 45.08 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 111.762 -0.535 . . . . 0.0 111.762 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 91.2 mt -117.57 9.72 13.25 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.432 0.693 . . . . 0.0 111.133 -178.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 18.4 t80 60.48 147.5 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.918 1.687 . . . . 0.0 113.433 -178.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 52.66 11.45 0.19 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.646 1.178 . . . . 0.0 113.756 -177.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm -139.22 11.12 2.58 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.591 0.756 . . . . 0.0 111.075 -177.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 50.1 m -140.16 166.78 23.75 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 123.552 0.741 . . . . 0.0 110.584 -178.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -136.26 155.31 50.28 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 123.189 0.596 . . . . 0.0 110.221 -179.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 11.2 tp -145.47 3.42 1.0 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.475 -178.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -65.43 -15.87 63.06 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.814 0.846 . . . . 0.0 112.6 -177.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.468 ' C ' ' H ' ' A' ' 146' ' ' ARG . . . -37.83 -40.27 0.43 Allowed 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 126.135 1.774 . . . . 0.0 114.735 -172.504 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.443 HG22 HD11 ' A' ' 113' ' ' ILE . 0.2 OUTLIER -69.39 21.41 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 118.424 0.556 . . . . 0.0 112.077 176.347 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.468 ' H ' ' C ' ' A' ' 144' ' ' ALA . 34.2 mmt180 53.06 19.77 1.51 Allowed 'General case' 0 C--N 1.339 0.121 0 C-N-CA 124.888 1.275 . . . . 0.0 111.183 -169.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 17.7 t 51.54 19.47 0.85 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.642 0.777 . . . . 0.0 112.974 -170.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -85.35 168.62 14.49 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 122.19 0.995 . . . . 0.0 113.102 -176.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 73.0 m -55.34 -14.78 2.02 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 114.47 -1.241 . . . . 0.0 111.389 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . 0.406 ' HB3' HD13 ' A' ' 113' ' ' ILE . 17.1 m-30 -28.86 -60.86 0.13 Allowed 'General case' 0 C--N 1.343 0.286 0 C-N-CA 126.039 1.736 . . . . 0.0 110.31 176.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . 0.417 ' HB2' HG21 ' A' ' 113' ' ' ILE . . . -128.88 -9.54 4.92 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 123.73 0.644 . . . . 0.0 110.929 169.062 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . 0.408 ' C ' ' H ' ' A' ' 154' ' ' LEU . 31.4 mmt -74.07 -15.6 61.06 Favored 'General case' 0 C--N 1.341 0.212 0 CA-C-N 119.176 0.898 . . . . 0.0 111.027 177.396 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 33.1 t70 56.38 -8.68 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.045 1.738 . . . . 0.0 114.886 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.408 ' H ' ' C ' ' A' ' 152' ' ' MET . 96.1 mt . . . . . 0 C--O 1.252 1.194 0 CA-C-O 116.98 -1.486 . . . . 0.0 110.542 -178.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 87.1 t80 . . . . . 0 N--CA 1.477 0.878 0 CA-C-O 120.478 0.18 . . . . 0.0 110.654 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 63.7 p -149.27 151.93 34.88 Favored Pre-proline 0 CA--C 1.532 0.251 0 C-N-CA 123.423 0.689 . . . . 0.0 109.707 178.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -77.28 -11.47 17.51 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 123.418 2.745 . . . . 0.0 112.261 -178.123 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 48.3 p -144.07 145.83 32.42 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 118.209 0.459 . . . . 0.0 111.056 -177.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -73.2 -179.07 23.71 Favored 'Cis proline' 0 N--CA 1.451 -1.001 0 N-CA-C 110.119 -0.762 . . . . 0.0 110.119 -8.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 36.5 t -69.12 156.83 38.02 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 176.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 162' ' ' TYR . . . . . 0.418 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 13.0 t80 -145.99 131.89 19.14 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.575 0.35 . . . . 0.0 110.988 -179.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 31.2 t -119.65 128.83 25.69 Favored Pre-proline 0 N--CA 1.452 -0.329 0 C-N-CA 122.95 0.5 . . . . 0.0 110.153 175.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.15 -16.25 48.41 Favored 'Trans proline' 0 N--CA 1.449 -1.091 0 C-N-CA 122.64 2.227 . . . . 0.0 109.696 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 2.1 m -69.39 -9.14 52.17 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.972 0.909 . . . . 0.0 112.47 -175.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 166' ' ' SEP . . . . . 0.423 ' HA ' ' HD2' ' B' ' 167' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' B' ' 166' ' ' SEP . 29.8 Cg_endo -55.17 154.79 21.54 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 123.222 2.615 . . . . 0.0 111.94 170.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 C--O 1.25 1.125 0 CA-C-O 117.347 -1.311 . . . . 0.0 111.406 -177.193 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.475 0.781 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.1 pm0 -140.59 6.3 2.06 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 122.673 0.389 . . . . 0.0 112.007 -178.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 -94.02 151.34 19.59 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -144.48 158.76 43.6 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.522 0.329 . . . . 0.0 110.873 -178.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -142.33 20.94 2.06 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.623 0.769 . . . . 0.0 111.384 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -83.51 -144.34 0.07 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.054 0.941 . . . . 0.0 109.61 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -55.18 -14.38 1.67 Allowed 'General case' 0 C--N 1.339 0.111 0 C-N-CA 123.483 0.713 . . . . 0.0 111.507 178.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -54.56 -42.88 71.5 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.264 0.626 . . . . 0.0 110.481 177.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 56.1 m-20 -55.91 -46.35 78.42 Favored 'General case' 0 C--O 1.227 -0.104 0 CA-C-N 118.285 0.493 . . . . 0.0 110.51 177.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -65.98 -50.03 65.74 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 117.777 0.262 . . . . 0.0 110.591 -176.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.8 t -63.72 -54.6 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 -178.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.89 -32.72 67.99 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.069 0.548 . . . . 0.0 111.897 -178.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 80.0 m -73.02 -41.46 64.21 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 118.312 0.505 . . . . 0.0 110.525 177.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.2 tp -66.12 -32.7 74.31 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.086 0.47 . . . . 0.0 110.097 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -68.58 -43.49 76.41 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.967 0.907 . . . . 0.0 109.616 175.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 65.4 m -64.39 -26.36 68.43 Favored 'General case' 0 C--O 1.227 -0.105 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 175.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.423 ' CE2' HD11 ' A' ' 68' ' ' ILE . 0.1 OUTLIER -71.81 -40.55 69.06 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 175.574 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -64.93 -32.63 74.44 Favored 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 176.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -76.31 -14.55 60.1 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.863 0.465 . . . . 0.0 111.762 176.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 57.5 tp -92.18 150.48 20.89 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.011 0.524 . . . . 0.0 110.482 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -150.13 163.4 38.3 Favored 'General case' 0 CA--C 1.523 -0.082 0 C-N-CA 123.388 0.675 . . . . 0.0 110.22 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 29.9 m 52.28 29.44 6.71 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.377 0.671 . . . . 0.0 112.782 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -177.97 135.76 2.8 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.452 -1.059 . . . . 0.0 110.452 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 19.7 mm -111.71 58.35 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.109 0 C-N-CA 124.659 1.184 . . . . 0.0 107.982 178.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.0 m -50.56 127.99 19.18 Favored 'General case' 0 CA--C 1.522 -0.099 0 C-N-CA 122.954 0.502 . . . . 0.0 111.641 -174.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.55 -20.11 67.59 Favored Glycine 0 CA--C 1.526 0.758 0 CA-C-O 119.098 -0.834 . . . . 0.0 112.546 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.428 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 40.3 t -66.05 -37.19 85.23 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 118.801 1.3 . . . . 0.0 110.059 -178.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.5 mmp_? -61.99 -49.0 77.83 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 176.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.6 mt -61.5 -38.53 80.33 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.883 -179.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -65.76 -38.96 90.51 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 118.954 -0.546 . . . . 0.0 111.291 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.1 OUTLIER -66.61 -41.38 88.51 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 119.279 0.945 . . . . 0.0 110.238 175.52 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.2 mt -62.0 -57.47 11.55 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 119.55 -0.262 . . . . 0.0 111.042 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.527 HG21 ' HB2' ' A' ' 71' ' ' SER . 66.6 p -56.85 -42.46 79.74 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 118.228 0.467 . . . . 0.0 111.707 177.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.7 m -55.44 -56.27 22.1 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 119.234 -0.413 . . . . 0.0 110.873 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -69.35 -32.72 71.97 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 118.524 -1.27 . . . . 0.0 111.815 -175.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.29 -58.4 8.78 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 174.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.7 mt -71.36 -15.81 62.4 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.711 0.804 . . . . 0.0 112.697 -174.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -61.09 -28.42 69.07 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 25.0 t60 -150.76 -24.37 0.22 Allowed 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -175.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.5 HG22 HG22 ' A' ' 93' ' ' THR . 30.3 mm 46.65 74.67 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-O 121.645 0.736 . . . . 0.0 111.522 -178.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -147.62 21.16 1.17 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.898 0.879 . . . . 0.0 109.918 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.555 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.01 37.76 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.087 0 C-N-CA 124.331 1.052 . . . . 0.0 109.365 -171.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.467 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -53.2 -54.19 39.67 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -174.676 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 81.0 p -75.22 -28.42 59.92 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -173.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.703 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -79.44 -45.41 19.5 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -179.247 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 24.4 mt -56.11 -51.76 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 172.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.431 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 11.7 mm -66.17 -50.83 65.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-O 119.02 -0.514 . . . . 0.0 112.124 -176.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 63.6 m -58.03 -33.55 69.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 119.198 0.908 . . . . 0.0 110.558 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 54.1 tp -70.06 -43.36 71.37 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 36.5 pt -73.24 -35.48 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-N 119.588 1.086 . . . . 0.0 111.927 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.475 HD13 HG21 ' A' ' 104' ' ' VAL . 96.8 mt -64.02 -52.37 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 178.079 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.411 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 37.3 t70 -62.39 -30.53 71.27 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.286 178.252 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -61.37 -42.51 98.82 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 175.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.1 t -68.39 -35.73 78.1 Favored 'General case' 0 C--N 1.338 0.098 0 O-C-N 122.097 -0.377 . . . . 0.0 110.701 175.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.411 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 8.3 tpt180 -64.82 -42.24 95.12 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.925 0.89 . . . . 0.0 113.056 -174.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 79.6 mt -91.24 -14.31 31.19 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -174.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 71.1 m -106.1 155.53 38.32 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -170.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.69 -174.95 0.79 Allowed 'Trans proline' 0 N--CA 1.459 -0.52 1 C-N-CA 125.788 4.325 . . . . 0.0 113.823 -179.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -53.77 -45.1 70.54 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 125.732 1.613 . . . . 0.0 114.738 -170.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 73.3 m -61.21 -27.33 68.36 Favored 'General case' 0 CA--C 1.523 -0.06 0 CA-C-N 118.484 0.584 . . . . 0.0 110.152 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 24.0 m170 -91.58 -16.99 26.29 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.263 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -66.09 -47.57 73.79 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 169.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 58.4 tp -66.86 -48.64 68.17 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.449 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.11 -46.45 92.67 Favored Glycine 0 C--N 1.338 0.643 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.8 t -62.65 -45.22 93.85 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 117.495 0.647 . . . . 0.0 110.069 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 25.2 mt -54.22 -41.18 68.37 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 119.162 0.892 . . . . 0.0 110.774 176.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -68.31 -27.0 65.91 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.028 0.831 . . . . 0.0 111.263 178.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.423 HD11 ' CE2' ' A' ' 17' ' ' PHE . 72.0 mt -75.12 -44.4 43.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 CA-C-N 118.247 0.476 . . . . 0.0 111.23 174.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 1.6 mp -60.33 -34.69 58.49 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 175.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.425 ' CG ' HH22 ' A' ' 74' ' ' ARG . 38.3 t70 -71.53 -45.4 62.47 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.744 1.218 . . . . 0.0 111.584 -178.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.527 ' HB2' HG21 ' A' ' 33' ' ' THR . 65.8 p -67.29 -56.04 11.42 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 119.009 0.822 . . . . 0.0 110.478 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 49.2 mt -63.37 -32.27 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.6 -55.68 21.44 Favored Glycine 0 CA--C 1.525 0.677 0 CA-C-O 119.65 -0.528 . . . . 0.0 112.02 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.436 ' HD3' ' HD3' ' B' ' 167' ' ' PRO . 5.1 ptp85 -67.14 -32.85 74.24 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 118.086 0.943 . . . . 0.0 110.658 -178.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.87 -44.7 69.26 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 121.514 -0.074 . . . . 0.0 110.803 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.2 m-30 -62.45 -47.93 81.86 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 176.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -59.17 -47.76 84.12 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 123.344 0.402 . . . . 0.0 110.144 -176.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -62.27 -47.74 83.01 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 120.515 0.198 . . . . 0.0 110.651 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -66.11 -38.04 87.23 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 121.039 -0.264 . . . . 0.0 111.591 -175.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 6.2 t -82.61 -19.42 38.41 Favored 'General case' 0 C--O 1.226 -0.138 0 CA-C-N 118.108 0.413 . . . . 0.0 111.592 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 79.8 ttt-85 -85.12 -27.15 26.43 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-N 117.978 0.354 . . . . 0.0 111.351 174.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 68.2 m -71.61 -14.77 62.17 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -178.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -147.61 158.36 43.97 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.668 0.667 . . . . 0.0 110.557 -178.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 53.4 m -143.14 159.61 41.96 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.18 0.592 . . . . 0.0 110.921 -178.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 54.3 t-20 -149.83 149.06 29.93 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.1 m -138.79 15.54 2.69 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 123.284 0.634 . . . . 0.0 111.577 -176.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 29.8 t -132.58 160.81 35.53 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 122.569 0.348 . . . . 0.0 111.161 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 43.5 m 58.6 161.83 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.77 1.628 . . . . 0.0 113.744 -177.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -80.44 148.0 30.71 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -156.17 156.16 29.98 Favored Pre-proline 0 CA--C 1.531 0.231 0 C-N-CA 122.602 0.361 . . . . 0.0 111.254 -176.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -71.47 171.99 15.12 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 123.796 2.997 . . . . 0.0 110.487 174.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -73.24 -30.81 62.23 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 111.759 -0.536 . . . . 0.0 111.759 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.5 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER 47.57 -158.78 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.646 1.178 . . . . 0.0 114.07 176.668 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.6 p -52.52 -28.88 22.44 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.162 0.985 . . . . 0.0 113.546 -176.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.11 -46.17 88.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.819 0.736 . . . . 0.0 109.758 176.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 9.4 m170 -73.38 -24.28 60.29 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.506 178.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.431 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -63.67 -46.45 85.5 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 175.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.1 mt -64.46 -44.24 96.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.171 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 176.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -58.17 -36.39 72.98 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 122.516 -0.115 . . . . 0.0 111.042 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.3 m -74.04 -41.03 62.41 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-O 119.626 -0.226 . . . . 0.0 111.482 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.4 mt -60.36 -30.21 69.41 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.824 0.738 . . . . 0.0 109.348 174.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.0 -15.44 21.13 Favored Glycine 0 CA--C 1.528 0.861 0 CA-C-O 119.222 -0.765 . . . . 0.0 113.967 179.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -101.3 -6.02 24.68 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.01 1.405 . . . . 0.0 112.28 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.475 HG21 HD13 ' A' ' 51' ' ' ILE . 35.0 m -123.02 -16.72 5.14 Favored 'Isoleucine or valine' 0 C--N 1.339 0.135 0 C-N-CA 122.941 0.496 . . . . 0.0 112.005 -178.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.44 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.6 tp -52.2 -26.34 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 122.884 0.474 . . . . 0.0 111.58 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.2 pt20 -63.89 -48.03 78.25 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.037 0.535 . . . . 0.0 111.57 178.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -79.39 -31.39 42.78 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 118.107 0.412 . . . . 0.0 110.721 -178.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.0 mp -61.67 -53.3 57.93 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.547 HD12 ' CB ' ' A' ' 144' ' ' ALA . 85.5 mt -66.07 -56.72 10.13 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 118.621 -0.704 . . . . 0.0 110.389 178.18 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 80.9 p -54.02 -40.57 67.15 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 119.238 0.926 . . . . 0.0 112.229 -174.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -71.04 -47.04 60.82 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 119.465 1.029 . . . . 0.0 110.357 176.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.22 -37.92 72.95 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 118.949 -0.548 . . . . 0.0 111.904 -177.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.419 HG21 ' HB2' ' A' ' 151' ' ' ALA . 0.0 OUTLIER -82.92 -33.93 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 119.058 0.845 . . . . 0.0 111.925 177.041 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.84 -28.22 67.37 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 119.789 -0.764 . . . . 0.0 111.028 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.21 -14.76 45.82 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.466 0.707 . . . . 0.0 111.053 177.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.41 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 32.4 p -74.39 159.57 32.16 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 -171.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.1 t-20 -96.25 174.39 6.91 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 169.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -55.42 -43.58 75.45 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.231 0.923 . . . . 0.0 111.507 -176.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -66.01 -40.78 91.38 Favored 'General case' 0 CA--C 1.527 0.093 0 O-C-N 121.856 -0.528 . . . . 0.0 110.529 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.41 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 40.2 m80 -69.94 -38.77 76.28 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.376 -0.345 . . . . 0.0 110.996 -178.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -39.3 90.14 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 174.295 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -66.06 -38.35 88.1 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.563 -178.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -64.33 -42.79 96.11 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 121.071 -0.251 . . . . 0.0 111.013 175.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.7 mt -67.17 -34.81 71.8 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -66.54 -36.06 81.76 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 122.75 0.42 . . . . 0.0 110.454 176.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.3 ttt -65.56 -42.13 92.16 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 109.668 -0.494 . . . . 0.0 109.668 176.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.41 HD23 ' C ' ' A' ' 127' ' ' LEU . 7.2 tt -58.05 -49.9 75.28 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 176.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.79 -30.29 69.69 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 122.264 -0.273 . . . . 0.0 111.715 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -67.01 -37.83 84.88 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 118.144 0.429 . . . . 0.0 110.058 177.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 95.6 mt -69.13 -39.97 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 176.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 20.0 m0 -63.52 -30.6 71.7 Favored 'General case' 0 CA--C 1.531 0.226 0 O-C-N 122.181 -0.324 . . . . 0.0 110.624 176.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -75.62 -36.07 60.33 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 117.876 0.307 . . . . 0.0 111.11 176.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 93.5 mtt-85 -71.96 -22.79 61.4 Favored 'General case' 0 C--N 1.337 0.065 0 O-C-N 122.165 -0.334 . . . . 0.0 111.076 176.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 23.0 t -61.44 -22.63 65.21 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.131 0.172 . . . . 0.0 111.145 176.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 160.86 152.48 6.61 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.855 -0.498 . . . . 0.0 111.855 177.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -97.47 -3.75 39.37 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.93 0.492 . . . . 0.0 110.308 178.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -143.06 164.69 29.42 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.671 0.788 . . . . 0.0 109.443 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 54.5 -162.61 0.13 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.315 0.646 . . . . 0.0 110.918 -177.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 95.5 mttt 55.05 25.19 6.72 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.616 0.766 . . . . 0.0 112.443 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 50.3 m 58.52 171.82 0.06 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.795 1.238 . . . . 0.0 113.37 -177.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 27.9 p90 -81.02 161.19 24.33 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.112 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.521 ' H ' HD23 ' A' ' 142' ' ' LEU . 1.8 pt? -140.65 15.62 2.34 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 123.418 0.687 . . . . 0.0 111.475 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -62.35 -14.75 43.07 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 -177.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.547 ' CB ' HD12 ' A' ' 109' ' ' LEU . . . 10.47 -76.34 0.0 OUTLIER 'General case' 0 C--N 1.342 0.28 0 C-N-CA 128.401 2.681 . . . . 0.0 115.566 177.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.446 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -65.9 18.39 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 C-N-CA 125.534 1.534 . . . . 0.0 112.588 179.958 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.482 ' H ' ' C ' ' A' ' 144' ' ' ALA . 23.0 mmt85 51.67 25.21 2.72 Favored 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 124.805 1.242 . . . . 0.0 110.903 -171.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 10.8 t 54.24 22.56 3.71 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.806 0.842 . . . . 0.0 113.172 -174.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -85.01 -175.91 5.97 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 122.35 1.071 . . . . 0.0 113.124 -177.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 85.2 m -52.43 -17.12 1.07 Allowed 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.774 1.23 . . . . 0.0 113.997 -173.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -33.06 -68.44 0.1 Allowed 'General case' 0 C--N 1.339 0.125 0 C-N-CA 124.414 1.085 . . . . 0.0 110.377 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . 0.419 ' HB2' HG21 ' A' ' 113' ' ' ILE . . . -112.24 -14.56 13.34 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 118.948 -0.549 . . . . 0.0 111.218 167.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . 0.418 ' N ' ' SD ' ' A' ' 152' ' ' MET . 0.6 OUTLIER -84.49 1.54 45.16 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -175.605 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -56.55 -27.0 56.58 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 119.073 0.851 . . . . 0.0 110.816 173.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 59.4 tp . . . . . 0 C--O 1.252 1.209 0 CA-C-O 117.444 -1.265 . . . . 0.0 109.015 177.203 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 51.8 p90 . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 120.386 0.136 . . . . 0.0 110.684 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 70.6 p -143.82 156.03 59.28 Favored Pre-proline 0 CA--C 1.532 0.278 0 C-N-CA 123.195 0.598 . . . . 0.0 110.567 -179.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_endo -70.31 159.04 54.37 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 123.622 2.881 . . . . 0.0 111.413 179.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 61.4 p -142.51 157.06 45.14 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.453 0.701 . . . . 0.0 110.186 -178.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 160' ' ' PRO . . . . . 0.409 ' HD2' ' N ' ' A' ' 27' ' ' SER . 85.3 Cg_endo -72.28 -175.35 13.58 Favored 'Cis proline' 0 N--CA 1.456 -0.68 0 N-CA-C 109.509 -0.997 . . . . 0.0 109.509 -11.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 67.9 p -72.83 157.29 37.77 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.675 0.274 . . . . 0.0 111.12 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 162' ' ' TYR . . . . . 0.411 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 4.2 t80 -144.25 129.62 18.87 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 123.338 0.655 . . . . 0.0 109.771 178.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 28.8 t -125.65 138.16 31.37 Favored Pre-proline 0 N--CA 1.454 -0.246 0 C-N-CA 123.144 0.577 . . . . 0.0 111.512 -177.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -67.83 -1.59 7.11 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 123.556 2.837 . . . . 0.0 111.44 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 57.2 p -76.13 -12.78 60.17 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.673 -0.68 . . . . 0.0 112.145 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . 0.436 ' HD3' ' HD3' ' A' ' 74' ' ' ARG . 52.2 Cg_endo -62.69 168.17 10.55 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 124.035 3.157 . . . . 0.0 111.792 171.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 40.5 m . . . . . 0 C--O 1.25 1.086 0 CA-C-O 117.712 -1.137 . . . . 0.0 111.413 179.154 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.2 mtp . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 110.476 -0.194 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -143.29 151.57 40.67 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.451 0.701 . . . . 0.0 109.396 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -79.71 162.5 25.16 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 122.514 0.326 . . . . 0.0 111.166 -178.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -86.08 161.33 18.96 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 122.721 0.409 . . . . 0.0 110.181 178.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 52.29 25.16 3.23 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.946 0.899 . . . . 0.0 112.466 -175.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.424 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 27.2 t70 -80.82 -153.57 0.09 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.554 0.742 . . . . 0.0 109.182 176.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.424 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 19.9 t80 -55.79 -14.44 2.34 Favored 'General case' 0 CA--C 1.532 0.28 0 O-C-N 121.721 -0.612 . . . . 0.0 111.484 178.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.8 tp60 -54.25 -40.23 67.57 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.678 0.791 . . . . 0.0 110.877 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -63.42 -39.48 94.6 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 118.779 0.718 . . . . 0.0 110.703 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.1 t80 -64.6 -54.3 34.18 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 118.464 0.575 . . . . 0.0 109.795 179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.6 t -59.57 -55.67 22.32 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.145 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 -178.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.1 -33.17 67.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.507 0.723 . . . . 0.0 112.197 -178.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 60.2 m -70.73 -44.97 65.74 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.705 0.684 . . . . 0.0 110.33 176.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.7 tp -65.36 -33.72 76.63 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.235 0.54 . . . . 0.0 110.071 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -66.34 -46.87 75.31 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.49 0.716 . . . . 0.0 109.757 177.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 61.6 m -63.86 -26.52 68.65 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -69.54 -45.7 68.17 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 177.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 15.7 pttm -77.9 -25.4 48.44 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -177.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -72.15 -16.48 61.98 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.2 mt -141.87 169.04 18.33 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.132 0.573 . . . . 0.0 110.687 -176.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -84.54 154.33 22.72 Favored 'General case' 0 N--CA 1.457 -0.117 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 174.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 47.9 t -152.3 150.87 30.23 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 120.879 0.371 . . . . 0.0 111.088 -178.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -85.72 31.7 3.87 Favored Glycine 0 CA--C 1.529 0.91 0 N-CA-C 110.679 -0.968 . . . . 0.0 110.679 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.5 mm 58.89 37.29 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 124.134 0.973 . . . . 0.0 110.408 -173.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.4 t -57.12 136.21 56.38 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.963 0.411 . . . . 0.0 111.146 -177.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -71.95 -22.18 78.84 Favored Glycine 0 CA--C 1.524 0.643 0 CA-C-O 119.072 -0.849 . . . . 0.0 114.601 -170.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 79.7 p -64.39 -38.7 91.96 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 119.384 1.592 . . . . 0.0 111.635 -174.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.6 mpt_? -65.69 -40.74 92.66 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 42.4 mt -64.89 -36.07 76.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 178.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.3 mmtt -65.35 -39.87 92.89 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.606 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.36 -48.57 77.39 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 118.746 0.703 . . . . 0.0 110.382 174.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.1 mt -59.66 -59.16 5.88 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 122.293 -0.255 . . . . 0.0 110.872 -178.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 59.4 p -55.67 -47.62 76.4 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.8 t -63.9 -43.04 97.2 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.528 -176.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -74.56 -22.78 58.81 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.695 0.68 . . . . 0.0 112.811 -178.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.5 -56.46 9.45 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.895 0.77 . . . . 0.0 109.545 167.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 65.6 mt -69.88 -14.89 62.95 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.931 0.892 . . . . 0.0 113.076 -175.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -55.81 -30.59 61.61 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -178.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.9 t-80 -151.9 -23.61 0.19 Allowed 'General case' 0 C--N 1.34 0.174 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -176.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 41.1 mm 46.18 73.51 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 121.941 0.877 . . . . 0.0 111.446 -178.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -136.63 9.33 3.11 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.272 1.029 . . . . 0.0 109.207 177.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.536 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -142.97 111.77 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 C-N-CA 125.125 1.37 . . . . 0.0 107.692 -177.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.471 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -108.13 -64.05 1.26 Allowed 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.686 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 74.0 p -68.75 -24.15 64.41 Favored 'General case' 0 CA--C 1.521 -0.15 0 C-N-CA 123.096 0.558 . . . . 0.0 111.909 -173.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.617 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -74.82 -53.72 8.61 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.995 0.918 . . . . 0.0 109.143 179.715 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.419 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 10.1 mt -57.22 -47.08 84.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 C-N-CA 123.129 0.572 . . . . 0.0 110.165 175.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.424 HD13 ' HA ' ' A' ' 47' ' ' ILE . 12.7 mm -69.47 -46.95 74.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-O 119.067 -0.492 . . . . 0.0 111.652 -176.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.0 m -61.31 -33.4 73.52 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 119.318 -0.953 . . . . 0.0 109.891 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.6 tp -68.07 -44.97 75.1 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 119.183 -0.437 . . . . 0.0 112.037 -178.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.5 pt -73.51 -35.69 45.86 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-N 119.207 0.912 . . . . 0.0 111.871 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.475 HD13 HG21 ' A' ' 104' ' ' VAL . 96.0 mt -64.29 -49.34 81.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 178.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -58.32 -40.8 83.01 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.777 177.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -57.68 -42.46 83.65 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 175.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.0 t -65.41 -47.05 77.61 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -75.48 -24.74 56.96 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -174.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 53.6 mt -81.53 -15.44 54.85 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 178.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.403 ' HB3' ' CG ' ' A' ' 61' ' ' HIS . 74.4 m -120.78 153.77 57.12 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -171.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -74.23 -169.54 0.6 Allowed 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 125.178 3.919 . . . . 0.0 114.26 -175.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -35.02 -59.99 0.48 Allowed 'General case' 0 C--O 1.236 0.345 0 C-N-CA 128.258 2.623 . . . . 0.0 115.787 -172.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.8 p -59.79 -26.29 65.61 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 122.309 -0.245 . . . . 0.0 110.987 -175.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.403 ' CG ' ' HB3' ' A' ' 57' ' ' CYS . 52.5 m-70 -89.6 -18.87 25.73 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 119.625 -0.226 . . . . 0.0 110.946 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -66.04 -49.1 68.9 Favored 'General case' 0 C--N 1.343 0.322 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 171.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.5 mt -67.27 -44.6 78.91 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.502 178.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.71 -50.88 61.67 Favored Glycine 0 C--N 1.335 0.504 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 9.9 t -65.75 -36.88 84.83 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 118.749 -0.644 . . . . 0.0 110.963 -178.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 66' ' ' LEU . 36.2 mt -60.99 -39.11 88.38 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 119.655 1.116 . . . . 0.0 111.635 176.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -72.21 -31.67 66.07 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.349 0.977 . . . . 0.0 111.094 177.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 64.3 mt -71.91 -47.63 54.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 O-C-N 121.895 -0.503 . . . . 0.0 110.529 177.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.4 mt -59.84 -37.19 70.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.179 0 C-N-CA 124.258 1.023 . . . . 0.0 109.213 176.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -66.19 -47.48 73.79 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 118.987 -0.53 . . . . 0.0 110.868 178.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.8 t -64.52 -53.73 43.4 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 118.615 0.643 . . . . 0.0 111.129 -176.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 57.2 mt -63.27 -34.2 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 179.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.06 -51.35 39.78 Favored Glycine 0 CA--C 1.526 0.734 0 CA-C-O 119.823 -0.432 . . . . 0.0 112.492 -178.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.635 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -71.17 -31.46 67.68 Favored 'General case' 0 C--N 1.338 0.085 0 CA-C-N 117.996 0.898 . . . . 0.0 111.008 -178.894 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.87 -43.84 74.51 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 176.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.0 m-30 -62.38 -45.89 91.12 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 175.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.11 -46.57 87.99 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 123.358 0.411 . . . . 0.0 110.287 -176.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -64.18 -45.17 89.56 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.598 0.237 . . . . 0.0 110.565 178.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -62.75 -39.51 94.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -175.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.6 t -84.33 -28.08 27.31 Favored 'General case' 0 C--O 1.232 0.148 0 O-C-N 122.093 -0.38 . . . . 0.0 111.8 -177.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -78.13 -19.9 53.17 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-N 118.412 0.551 . . . . 0.0 111.523 175.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 73.9 m -69.02 -14.44 63.04 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 117.853 0.297 . . . . 0.0 111.235 174.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -106.26 162.34 13.75 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.131 0.572 . . . . 0.0 110.232 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 48.8 m -67.99 158.8 32.02 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.906 0.483 . . . . 0.0 110.808 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -71.59 148.84 46.23 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 86.1 p -155.06 170.35 21.98 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 123.37 0.668 . . . . 0.0 110.24 -179.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.3 m -136.99 154.71 50.34 Favored 'General case' 0 N--CA 1.458 -0.068 0 C-N-CA 122.826 0.45 . . . . 0.0 110.722 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.4 m -144.61 159.32 42.99 Favored 'General case' 0 N--CA 1.458 -0.051 0 C-N-CA 123.289 0.636 . . . . 0.0 110.15 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 68.2 m-20 -87.68 -9.52 53.91 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 119.579 -0.248 . . . . 0.0 111.417 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -143.32 153.1 58.97 Favored Pre-proline 0 CA--C 1.531 0.229 0 C-N-CA 123.507 0.723 . . . . 0.0 109.99 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -59.74 157.81 31.21 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 123.892 3.061 . . . . 0.0 112.504 176.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 175.48 148.57 6.88 Favored Glycine 0 CA--C 1.528 0.856 0 CA-C-O 121.119 0.288 . . . . 0.0 112.831 176.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.408 ' HA ' ' HB3' ' A' ' 43' ' ' GLU . 0.6 OUTLIER 52.55 -175.82 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 176.782 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.0 p -50.22 -32.85 17.63 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.475 1.51 . . . . 0.0 114.813 -172.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.54 -47.0 87.54 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.225 0.921 . . . . 0.0 109.799 177.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 55.3 m-70 -78.15 -17.37 56.93 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.235 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.75 -44.67 80.87 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 173.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.6 mt -63.61 -44.35 98.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -57.78 -35.28 70.58 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.981 -0.099 . . . . 0.0 111.154 178.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.9 m -74.39 -41.77 60.39 Favored 'General case' 0 C--N 1.339 0.15 0 O-C-N 122.291 -0.256 . . . . 0.0 111.309 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 52.1 mt -60.28 -30.15 69.28 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 174.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.44 -14.63 28.31 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-O 119.08 -0.844 . . . . 0.0 113.641 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -100.81 -4.76 27.32 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.95 1.375 . . . . 0.0 112.075 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.475 HG21 HD13 ' A' ' 51' ' ' ILE . 34.5 m -124.48 -21.8 2.68 Favored 'Isoleucine or valine' 0 C--N 1.338 0.086 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -178.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.414 ' HA ' HD12 ' A' ' 105' ' ' ILE . 11.0 tp -52.83 -26.67 11.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 123.277 0.631 . . . . 0.0 112.294 -175.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.2 pt20 -62.85 -45.2 93.7 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 122.942 0.497 . . . . 0.0 111.255 177.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -74.01 -39.2 63.77 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.091 0.472 . . . . 0.0 110.132 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 68.8 mt -62.05 -50.49 71.77 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.459 -177.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.46 HD12 ' CB ' ' A' ' 144' ' ' ALA . 66.2 mt -65.63 -56.79 10.32 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.286 176.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 87.5 p -50.66 -41.65 55.65 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 119.181 0.9 . . . . 0.0 111.893 -174.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -70.74 -50.79 32.36 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 118.791 0.723 . . . . 0.0 111.148 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.483 ' O ' ' HE3' ' A' ' 115' ' ' LYS . . . -56.24 -32.4 64.42 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.599 0.76 . . . . 0.0 112.855 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.48 HG21 ' HB2' ' A' ' 151' ' ' ALA . 0.0 OUTLIER -84.85 -38.35 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 CA-C-N 119.673 1.124 . . . . 0.0 111.788 174.772 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.25 -26.44 65.68 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 121.956 -0.465 . . . . 0.0 111.186 -179.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.483 ' HE3' ' O ' ' A' ' 112' ' ' ALA . 0.2 OUTLIER -80.73 -21.01 41.54 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.13 0.572 . . . . 0.0 110.075 177.414 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.3 m -80.93 169.86 17.0 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 122.063 0.935 . . . . 0.0 113.494 -173.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -105.78 -176.89 3.21 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 114.124 -1.398 . . . . 0.0 107.262 169.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . 0.42 ' O ' ' HE2' ' A' ' 121' ' ' LYS . 50.4 mm-40 -55.97 -35.91 67.25 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.789 -0.569 . . . . 0.0 112.031 -177.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -71.36 -49.6 40.61 Favored 'General case' 0 N--CA 1.456 -0.173 0 O-C-N 121.932 -0.48 . . . . 0.0 111.475 -177.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 49.4 m-70 -69.39 -34.6 74.75 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 122.191 -0.318 . . . . 0.0 110.679 -179.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.42 ' HE2' ' O ' ' A' ' 118' ' ' GLN . 4.7 ttpt -56.67 -48.35 77.8 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 108.301 -0.999 . . . . 0.0 108.301 171.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -59.56 -39.73 85.0 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.919 -176.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -60.72 -44.37 96.69 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.28 175.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.8 mt -68.35 -34.26 64.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-O 120.757 0.313 . . . . 0.0 110.164 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 69.6 ttt-85 -69.66 -35.33 75.08 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.077 0.551 . . . . 0.0 109.908 178.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 62.8 ttp -68.37 -38.8 81.73 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 176.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.6 tt -58.95 -45.75 89.7 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 81.6 mt -66.31 -34.27 77.61 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 177.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -67.34 -33.41 75.2 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 118.205 0.457 . . . . 0.0 110.446 178.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 97.9 mt -74.8 -34.53 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 25.0 m0 -67.99 -30.8 70.16 Favored 'General case' 0 N--CA 1.456 -0.156 0 O-C-N 121.832 -0.543 . . . . 0.0 110.004 174.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -72.26 -36.42 69.02 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 175.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -63.03 -36.55 83.93 Favored 'General case' 0 C--N 1.342 0.246 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 174.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 49.4 m -75.32 -7.77 54.87 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.495 0.718 . . . . 0.0 111.884 178.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -67.55 164.62 45.1 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.929 -0.468 . . . . 0.0 111.929 -178.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 96.2 mt -134.59 178.54 6.92 Favored 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 124.179 0.992 . . . . 0.0 109.497 -178.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -64.21 -16.85 62.84 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.576 0.351 . . . . 0.0 111.243 178.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -81.38 -3.44 52.77 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.142 0.577 . . . . 0.0 111.2 177.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 59.7 mttp 60.12 166.33 0.07 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.815 1.646 . . . . 0.0 113.673 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 50.4 m -145.94 162.24 38.25 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.822 0.849 . . . . 0.0 109.9 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -88.2 130.33 35.09 Favored 'General case' 0 N--CA 1.457 -0.101 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 179.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 95.5 mt -142.3 3.12 1.52 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.541 0.736 . . . . 0.0 111.258 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 -70.92 -4.24 23.49 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -177.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.46 ' CB ' HD12 ' A' ' 109' ' ' LEU . . . -37.47 -37.94 0.22 Allowed 'General case' 0 C--N 1.34 0.184 0 C-N-CA 126.467 1.907 . . . . 0.0 114.249 -177.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -70.11 25.02 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 122.866 0.466 . . . . 0.0 111.825 175.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.46 ' H ' ' C ' ' A' ' 144' ' ' ALA . 75.8 mtp180 51.94 18.78 0.85 Allowed 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 125.205 1.402 . . . . 0.0 111.287 -171.011 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 11.1 t 51.77 24.83 2.62 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.563 0.745 . . . . 0.0 112.508 -171.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -112.17 -176.54 2.95 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 122.257 1.027 . . . . 0.0 113.505 -174.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . 0.424 ' O ' ' C ' ' A' ' 150' ' ' PHE . 50.0 t -41.25 -38.2 1.1 Allowed 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 126.173 1.789 . . . . 0.0 113.389 -174.014 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . 0.424 ' C ' ' O ' ' A' ' 149' ' ' CYS . 95.4 m-85 -16.65 -74.56 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.782 1.633 . . . . 0.0 111.034 -179.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . 0.48 ' HB2' HG21 ' A' ' 113' ' ' ILE . . . -122.04 -2.58 9.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 118.812 -0.613 . . . . 0.0 111.949 166.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 23.9 mmt -81.89 2.52 30.08 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 119.633 1.106 . . . . 0.0 112.059 178.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -55.39 -17.18 4.49 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.602 0.637 . . . . 0.0 112.457 176.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.429 ' H ' HD23 ' A' ' 154' ' ' LEU . 2.2 pt? . . . . . 0 C--O 1.25 1.093 0 CA-C-O 117.283 -1.341 . . . . 0.0 110.49 178.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 91.8 t80 . . . . . 0 N--CA 1.476 0.835 0 N-CA-C 110.542 -0.17 . . . . 0.0 110.542 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 62.3 m -145.46 149.86 42.18 Favored Pre-proline 0 C--O 1.233 0.191 0 C-N-CA 123.501 0.72 . . . . 0.0 109.665 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -74.23 167.24 27.64 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 123.628 2.885 . . . . 0.0 110.642 177.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 70.2 p -97.21 163.92 12.71 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 122.767 0.427 . . . . 0.0 109.905 178.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -74.64 177.72 37.38 Favored 'Cis proline' 0 N--CA 1.458 -0.579 0 CA-C-N 118.879 0.635 . . . . 0.0 110.494 -5.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 50.1 m -63.74 147.32 51.99 Favored 'General case' 0 C--O 1.231 0.096 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 175.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 162' ' ' TYR . . . . . 0.464 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 17.2 t80 -145.93 131.12 18.42 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 178.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 163' ' ' SER . . . . . 0.404 ' HA ' ' HD3' ' B' ' 164' ' ' PRO . 29.4 t -135.44 135.45 22.37 Favored Pre-proline 0 C--O 1.234 0.265 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.878 176.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 164' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' B' ' 163' ' ' SER . 52.9 Cg_exo -56.58 -17.34 21.89 Favored 'Trans proline' 0 N--CA 1.451 -1.009 0 C-N-CA 123.23 2.62 . . . . 0.0 112.443 175.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 73.3 p -69.95 -6.54 33.77 Favored 'General case' 0 C--N 1.341 0.227 0 N-CA-C 113.196 0.814 . . . . 0.0 113.196 -174.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -57.7 156.88 25.49 Favored 'Trans proline' 0 N--CA 1.453 -0.875 0 C-N-CA 123.409 2.74 . . . . 0.0 111.252 169.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 32.9 m . . . . . 0 C--O 1.251 1.147 0 CA-C-O 117.601 -1.19 . . . . 0.0 111.118 -179.261 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.7 ttm . . . . . 0 N--CA 1.475 0.776 0 CA-C-O 119.822 -0.132 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -82.93 149.08 27.26 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.739 0.304 . . . . 0.0 110.299 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -145.1 10.65 1.32 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.028 0.531 . . . . 0.0 111.067 178.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -85.23 163.2 18.82 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 122.863 0.465 . . . . 0.0 111.217 -177.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -79.94 41.69 0.52 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.062 0.945 . . . . 0.0 111.206 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.437 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 17.3 t70 -76.47 -159.76 0.13 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.939 0.895 . . . . 0.0 109.608 178.214 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.437 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 13.3 t80 -55.62 -14.82 2.36 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.335 0.654 . . . . 0.0 111.036 178.288 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -55.33 -34.56 64.31 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.505 1.122 . . . . 0.0 111.304 176.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 40.8 m-20 -66.38 -44.2 83.79 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 119.2 0.909 . . . . 0.0 109.927 178.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -64.44 -50.23 68.38 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 -178.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 88.1 t -62.53 -57.71 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 -179.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.42 -32.32 64.75 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -177.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 78.9 m -72.43 -44.03 62.99 Favored 'General case' 0 C--N 1.338 0.079 0 O-C-N 121.798 -0.564 . . . . 0.0 110.78 176.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.0 tp -65.62 -31.59 72.71 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -69.73 -43.1 73.01 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 124.001 0.921 . . . . 0.0 109.546 176.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.8 t -60.07 -31.47 70.04 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -36.91 68.63 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.231 0.212 . . . . 0.0 110.592 175.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -68.73 -29.01 67.34 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 123.808 0.843 . . . . 0.0 111.18 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -66.51 -14.24 62.02 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.13 0.572 . . . . 0.0 111.854 178.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.2 mt -108.61 160.08 16.22 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 123.069 0.548 . . . . 0.0 111.097 -178.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -128.82 -1.15 5.36 Favored 'General case' 0 N--CA 1.457 -0.079 0 C-N-CA 123.309 0.644 . . . . 0.0 111.501 178.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 55.2 m -146.19 151.94 38.43 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 123.941 0.897 . . . . 0.0 109.574 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.28 136.45 1.97 Allowed Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 17.4 mm -117.64 56.23 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 C-N-CA 123.952 0.901 . . . . 0.0 108.608 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.4 m -54.21 123.38 12.62 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-O 121.063 0.459 . . . . 0.0 111.481 -175.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -69.77 -14.98 70.82 Favored Glycine 0 CA--C 1.525 0.675 0 CA-C-O 119.13 -0.817 . . . . 0.0 113.288 -177.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.4 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 43.1 t -64.02 -43.63 95.04 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 118.914 1.357 . . . . 0.0 109.816 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 83.6 mtt85 -65.32 -41.42 94.01 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 53.1 mt -59.01 -41.46 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.103 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 176.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.3 tmtt? -60.79 -44.72 96.45 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.772 0.429 . . . . 0.0 111.256 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.4 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.3 OUTLIER -63.66 -40.99 98.23 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 118.72 0.691 . . . . 0.0 110.925 177.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 92.2 mt -63.66 -53.4 51.93 Favored 'General case' 0 C--O 1.233 0.202 0 O-C-N 122.534 -0.104 . . . . 0.0 110.782 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 48.4 p -60.94 -39.65 90.27 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.1 m -55.5 -57.7 10.8 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 122.876 0.47 . . . . 0.0 110.572 178.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -67.95 -35.09 77.81 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 118.908 -1.117 . . . . 0.0 111.942 -175.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.95 -58.3 9.27 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.422 0.556 . . . . 0.0 110.336 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 53.0 mt -72.21 -15.74 61.94 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.847 0.859 . . . . 0.0 112.913 -174.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -61.94 -24.69 67.14 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -150.85 -26.69 0.22 Allowed 'General case' 0 C--N 1.338 0.102 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -175.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 34.9 mm 44.97 73.59 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-O 121.768 0.794 . . . . 0.0 111.283 -178.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -137.53 9.26 2.89 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.114 0.966 . . . . 0.0 110.137 178.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.537 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.5 pt -143.64 119.62 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 C-N-CA 125.205 1.402 . . . . 0.0 107.837 -178.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.409 ' HG2' ' N ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -114.92 -66.89 1.04 Allowed 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -179.192 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.409 ' N ' ' HG2' ' A' ' 43' ' ' GLU . 79.4 p -67.84 -23.19 65.13 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 122.851 0.46 . . . . 0.0 111.774 -173.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.621 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -75.46 -52.63 10.25 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.263 1.025 . . . . 0.0 109.399 179.475 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.433 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 7.4 mt -59.72 -44.33 93.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 C-N-CA 123.02 0.528 . . . . 0.0 110.352 176.207 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.426 HD12 HD11 ' A' ' 101' ' ' LEU . 12.3 mm -71.33 -47.63 58.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 O-C-N 122.258 -0.276 . . . . 0.0 111.681 -177.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.3 t -57.68 -35.02 70.03 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 176.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.4 tp -68.26 -45.67 72.51 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 118.442 -0.789 . . . . 0.0 112.184 -179.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 26.3 pt -73.01 -35.77 49.39 Favored 'Isoleucine or valine' 0 C--N 1.342 0.258 0 CA-C-N 120.03 1.286 . . . . 0.0 112.149 -179.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 95.8 mt -66.15 -50.73 66.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-O 121.431 0.634 . . . . 0.0 109.336 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -60.77 -40.38 92.3 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.317 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -55.67 -43.08 76.0 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 175.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.4 ' HB2' ' HB2' ' A' ' 65' ' ' SER . 11.1 p -62.49 -51.5 67.2 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 119.442 -0.314 . . . . 0.0 110.96 -177.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.42 -20.45 66.37 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 118.585 0.63 . . . . 0.0 112.314 -177.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 69.8 mt -79.27 -14.74 58.84 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 173.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 59.6 m -95.17 163.49 21.67 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -173.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -74.04 -137.81 0.02 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.62 1 C-N-CA 125.606 4.204 . . . . 0.0 109.25 170.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -55.54 -26.89 45.75 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 119.361 0.982 . . . . 0.0 111.966 178.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 25.5 m -58.51 -21.27 51.48 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.962 0.505 . . . . 0.0 110.564 175.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -55.21 -72.36 0.07 Allowed 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 174.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -59.11 -60.37 3.97 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -175.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 35.1 tp -73.58 -47.47 40.26 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 119.619 -0.832 . . . . 0.0 112.203 -170.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.55 -41.78 93.91 Favored Glycine 0 C--N 1.335 0.479 0 N-CA-C 110.586 -1.005 . . . . 0.0 110.586 -175.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.4 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 11.4 t -68.2 -44.03 76.75 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 117.76 0.78 . . . . 0.0 110.4 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 66' ' ' LEU . 49.6 mt -55.48 -42.04 73.83 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 119.704 -0.799 . . . . 0.0 111.178 178.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -71.12 -40.93 71.13 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.327 0.967 . . . . 0.0 112.372 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 89.1 mt -65.56 -45.9 91.19 Favored 'Isoleucine or valine' 0 C--N 1.341 0.228 0 CA-C-N 118.868 0.758 . . . . 0.0 109.847 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.0 mt -59.64 -36.63 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 C-N-CA 123.368 0.667 . . . . 0.0 109.432 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -66.44 -46.52 76.2 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 119.144 -0.455 . . . . 0.0 111.019 -179.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.6 m -67.63 -51.23 52.61 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 118.955 0.798 . . . . 0.0 111.443 -178.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 39.4 mt -66.94 -39.1 82.73 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 C-N-CA 120.56 -0.456 . . . . 0.0 109.999 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.48 -39.73 86.92 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 111.926 -0.47 . . . . 0.0 111.926 -179.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 42.9 ttm-85 -67.75 -42.25 82.1 Favored 'General case' 0 CA--C 1.523 -0.08 0 CA-C-N 117.52 0.66 . . . . 0.0 110.016 178.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.86 -41.47 82.84 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.324 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -63.7 -45.54 89.55 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 175.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 55.8 tp -59.38 -43.64 92.87 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 123.205 0.316 . . . . 0.0 110.184 -177.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -64.26 -46.63 82.89 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 120.776 0.322 . . . . 0.0 110.25 176.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -58.4 -41.84 85.83 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.543 -176.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 15.0 t -87.34 -20.48 26.7 Favored 'General case' 0 CA--C 1.528 0.101 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 51.2 tpt85 -71.06 -30.9 67.17 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 118.503 0.592 . . . . 0.0 110.131 175.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.4 m -72.06 -14.65 61.92 Favored 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 176.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -79.13 142.11 36.69 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 118.413 0.551 . . . . 0.0 109.87 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 43.5 m 50.13 17.39 0.31 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.878 0.871 . . . . 0.0 112.829 -178.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 53.57 10.22 0.22 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.981 1.312 . . . . 0.0 113.337 -176.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 9.3 t -158.04 8.53 0.15 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.151 0.432 . . . . 0.0 111.558 -177.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 19.1 t 60.19 170.75 0.09 Allowed 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.465 1.106 . . . . 0.0 112.026 -172.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 81.0 p -145.15 0.68 0.93 Allowed 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 122.891 0.476 . . . . 0.0 111.755 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 46.6 t30 48.3 37.9 9.35 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.804 0.842 . . . . 0.0 111.875 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.79 153.61 71.04 Favored Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 122.676 0.39 . . . . 0.0 110.937 -179.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -70.08 156.31 62.82 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 123.311 2.674 . . . . 0.0 110.458 177.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 73.01 168.77 13.38 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-O 121.239 0.355 . . . . 0.0 112.252 -178.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 53.3 -167.03 0.07 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.1 1.36 . . . . 0.0 114.36 178.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.5 p -50.65 -31.73 17.03 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.585 1.154 . . . . 0.0 114.114 -173.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.52 -45.36 90.97 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 118.752 0.706 . . . . 0.0 110.006 177.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -68.18 -32.32 72.48 Favored 'General case' 0 CA--C 1.52 -0.204 0 C-N-CA 122.904 0.482 . . . . 0.0 110.215 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.79 -43.99 91.42 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.395 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.71 -42.08 91.81 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 175.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -59.15 -35.0 72.74 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 122.493 -0.129 . . . . 0.0 110.961 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 62.2 m -76.81 -43.05 38.11 Favored 'General case' 0 CA--C 1.524 -0.049 0 CA-C-O 119.689 -0.196 . . . . 0.0 111.413 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.426 HD11 HD12 ' A' ' 47' ' ' ILE . 51.1 mt -60.96 -27.78 68.51 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.553 -0.717 . . . . 0.0 109.137 174.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.1 -15.35 36.2 Favored Glycine 0 CA--C 1.528 0.889 0 CA-C-O 119.228 -0.762 . . . . 0.0 113.458 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -97.82 -5.33 34.97 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.664 1.232 . . . . 0.0 111.652 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.9 m -123.45 -26.81 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.338 0.102 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.429 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.5 tp -55.78 -27.46 22.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 CA-C-N 118.123 0.42 . . . . 0.0 111.588 -178.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.549 ' HA ' ' HB1' ' A' ' 144' ' ' ALA . 22.1 pt20 -60.84 -47.5 86.05 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.262 0.625 . . . . 0.0 110.606 178.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -75.19 -38.71 60.7 Favored 'General case' 0 CA--C 1.522 -0.116 0 C-N-CA 123.022 0.529 . . . . 0.0 110.502 -179.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 89.0 mt -59.41 -49.67 76.9 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.409 -178.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.567 HD12 ' CB ' ' A' ' 144' ' ' ALA . 58.6 mt -67.73 -51.87 44.17 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-O 118.458 -0.782 . . . . 0.0 110.462 177.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 91.2 p -53.52 -49.05 68.4 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 119.227 -0.989 . . . . 0.0 111.313 -176.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -69.65 -35.11 74.88 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 121.882 -0.511 . . . . 0.0 111.467 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.87 -48.26 81.3 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 118.225 0.466 . . . . 0.0 111.17 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -74.88 -33.21 29.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.743 -177.994 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.03 -27.56 65.77 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 119.522 -0.871 . . . . 0.0 110.646 178.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 4.5 ttpt -80.69 -23.81 39.3 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.205 1.002 . . . . 0.0 110.583 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.9 m -78.04 158.72 29.11 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -170.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -100.12 -179.87 4.27 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 170.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -36.59 68.08 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.547 1.067 . . . . 0.0 112.858 -175.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -69.66 -42.78 73.74 Favored 'General case' 0 N--CA 1.456 -0.166 0 O-C-N 121.618 -0.676 . . . . 0.0 110.698 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 60.6 m80 -73.57 -37.67 65.45 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 119.573 -0.251 . . . . 0.0 111.136 -177.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.421 ' HD2' ' C ' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -64.92 -37.2 86.84 Favored 'General case' 0 C--N 1.34 0.184 0 N-CA-C 108.469 -0.938 . . . . 0.0 108.469 176.321 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -62.3 -43.62 98.4 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 178.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -62.35 -38.92 91.38 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 122.119 -0.363 . . . . 0.0 111.424 176.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.6 -43.32 80.46 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 118.526 0.603 . . . . 0.0 111.13 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -70.68 -26.18 63.32 Favored 'General case' 0 C--O 1.225 -0.236 0 O-C-N 121.329 -0.857 . . . . 0.0 110.645 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.1 ttt -68.58 -41.04 80.23 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 174.108 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 33.2 tp -57.19 -49.3 76.42 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.121 0.568 . . . . 0.0 109.609 176.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 85.7 mt -72.92 -31.89 64.94 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -178.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -64.99 -43.92 90.98 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 118.274 0.488 . . . . 0.0 109.813 177.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.8 mt -65.86 -39.68 85.41 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 177.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 91.8 t90 -60.65 -33.14 72.37 Favored 'General case' 0 N--CA 1.454 -0.242 0 O-C-N 122.309 -0.244 . . . . 0.0 110.932 176.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -79.54 -34.26 41.21 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.404 0.282 . . . . 0.0 111.724 178.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 13.3 mmp_? -74.81 -20.3 59.84 Favored 'General case' 0 C--N 1.339 0.144 0 CA-C-N 118.0 0.364 . . . . 0.0 111.217 177.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 69.8 m -59.12 -28.73 66.81 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 117.677 0.217 . . . . 0.0 111.317 176.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 65.08 11.93 53.25 Favored Glycine 0 CA--C 1.529 0.906 0 CA-C-O 119.457 -0.635 . . . . 0.0 113.688 175.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 95.5 mt -74.94 -17.95 60.47 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 118.555 1.178 . . . . 0.0 111.694 -177.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -155.66 147.51 23.23 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 122.707 0.403 . . . . 0.0 110.354 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -161.32 163.5 30.75 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.098 0.559 . . . . 0.0 110.749 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt 59.82 170.98 0.08 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.727 1.211 . . . . 0.0 113.121 178.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 23.3 m 54.81 25.94 7.18 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.552 1.141 . . . . 0.0 113.164 178.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -150.83 155.66 39.66 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.9 0.48 . . . . 0.0 110.33 -178.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 96.8 mt -127.13 136.21 51.79 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 176.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 42.9 t-20 -64.34 125.47 24.71 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 111.622 0.23 . . . . 0.0 111.622 -173.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.567 ' CB ' HD12 ' A' ' 109' ' ' LEU . . . -26.07 -46.64 0.02 OUTLIER 'General case' 0 C--N 1.342 0.257 0 C-N-CA 129.077 2.951 . . . . 0.0 115.133 -178.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.421 ' H ' ' CD1' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -73.55 21.41 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 179.368 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? 52.34 27.63 5.01 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 123.412 0.685 . . . . 0.0 110.216 -170.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 75.7 m 45.71 30.98 0.9 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.514 0.726 . . . . 0.0 112.931 -172.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.635 ' HG3' ' H ' ' A' ' 149' ' ' CYS . 17.9 tptm -98.34 -174.54 2.86 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.881 0.848 . . . . 0.0 113.066 -172.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . 0.635 ' H ' ' HG3' ' A' ' 148' ' ' LYS . 83.4 m -47.91 -20.57 0.33 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 126.246 1.818 . . . . 0.0 114.289 -173.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -34.74 -69.55 0.09 Allowed 'General case' 0 CA--C 1.521 -0.156 0 C-N-CA 124.723 1.209 . . . . 0.0 111.669 177.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -107.46 -14.79 14.77 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 123.568 0.543 . . . . 0.0 111.154 170.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . 0.422 ' SD ' ' N ' ' A' ' 152' ' ' MET . 0.4 OUTLIER -83.24 -10.49 58.53 Favored 'General case' 0 C--N 1.342 0.243 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -174.981 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -66.19 -37.34 85.38 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 119.252 0.933 . . . . 0.0 112.136 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 2.3 tm? . . . . . 0 C--O 1.252 1.198 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 -179.945 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 58.5 t80 . . . . . 0 N--CA 1.477 0.895 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 78.2 p -69.11 152.19 96.83 Favored Pre-proline 0 CA--C 1.532 0.272 0 O-C-N 122.103 -0.373 . . . . 0.0 110.918 -179.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -78.66 5.12 5.82 Favored 'Trans proline' 0 N--CA 1.453 -0.858 0 C-N-CA 124.179 3.253 . . . . 0.0 112.289 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 63.3 p -98.8 155.88 17.14 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.984 0.514 . . . . 0.0 111.128 -177.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -76.51 -176.52 18.75 Favored 'Cis proline' 0 N--CA 1.456 -0.734 0 CA-C-N 119.332 0.797 . . . . 0.0 110.646 -7.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 32.5 t -81.89 164.0 21.86 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 122.521 0.328 . . . . 0.0 110.519 176.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -131.5 127.18 36.76 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.841 0.456 . . . . 0.0 110.713 177.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 163' ' ' SER . . . . . 0.409 ' HA ' ' HD3' ' B' ' 164' ' ' PRO . 21.8 t -104.07 131.14 22.22 Favored Pre-proline 0 N--CA 1.453 -0.295 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 174.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 164' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' B' ' 163' ' ' SER . 50.9 Cg_exo -57.48 -10.45 6.8 Favored 'Trans proline' 0 N--CA 1.448 -1.183 0 C-N-CA 122.854 2.369 . . . . 0.0 112.943 176.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 52.4 p -67.15 -22.29 65.77 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 118.865 0.757 . . . . 0.0 112.21 -177.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -76.5 -14.21 18.07 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.181 2.587 . . . . 0.0 112.378 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 47.7 t . . . . . 0 C--O 1.251 1.179 0 CA-C-O 117.574 -1.203 . . . . 0.0 110.286 -175.939 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.7 tpt . . . . . 0 N--CA 1.475 0.808 0 CA-C-O 119.518 -0.277 . . . . 0.0 111.643 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -95.41 15.27 20.0 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -175.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -133.68 3.8 3.56 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 122.265 -0.272 . . . . 0.0 111.433 -178.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -149.74 172.85 14.43 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 122.045 -0.409 . . . . 0.0 110.424 -178.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -76.27 47.08 0.44 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.417 1.087 . . . . 0.0 112.004 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -75.97 -160.86 0.15 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.542 0.737 . . . . 0.0 109.852 176.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -54.79 -14.35 1.37 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.525 0.73 . . . . 0.0 111.053 177.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -53.63 -34.6 59.12 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.367 0.667 . . . . 0.0 110.506 175.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 34.4 m-20 -64.47 -48.5 75.01 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 118.962 0.801 . . . . 0.0 110.16 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -63.1 -49.06 75.93 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 110.466 -0.198 . . . . 0.0 110.466 -177.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 86.2 t -63.45 -57.75 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.22 -29.54 67.58 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 119.395 -0.336 . . . . 0.0 111.802 -177.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 61.9 m -71.53 -46.04 60.69 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.35 0.523 . . . . 0.0 110.48 176.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.438 HD11 ' CD2' ' A' ' 53' ' ' TYR . 19.5 tp -65.89 -33.84 76.76 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.077 0.465 . . . . 0.0 110.167 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -68.42 -43.27 77.53 Favored 'General case' 0 CA--C 1.522 -0.108 0 C-N-CA 123.93 0.892 . . . . 0.0 109.648 178.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.6 t -62.88 -31.75 72.86 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 174.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.83 -32.86 70.04 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 177.214 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -72.83 -37.73 67.37 Favored 'General case' 0 C--O 1.23 0.06 0 C-N-CA 123.019 0.528 . . . . 0.0 111.655 176.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -73.98 -16.92 61.06 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -175.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 90.0 mt -93.34 159.29 15.33 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.081 0.467 . . . . 0.0 111.465 -178.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -122.84 7.74 9.35 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.104 0.961 . . . . 0.0 109.92 178.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 77.4 p -76.17 -168.98 1.03 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.117 0.967 . . . . 0.0 110.024 178.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -75.94 -145.28 1.53 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 111.551 -0.62 . . . . 0.0 111.551 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 21.3 mm -107.13 76.94 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 C-N-CA 123.322 0.649 . . . . 0.0 110.072 -173.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.7 t -64.24 124.52 21.92 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 120.882 0.372 . . . . 0.0 110.139 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.408 ' C ' ' HD2' ' B' ' 160' ' ' PRO . . . -68.79 -25.79 74.96 Favored Glycine 0 CA--C 1.524 0.604 0 CA-C-O 119.603 -0.554 . . . . 0.0 112.534 -176.132 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 83.1 p -64.22 -33.96 77.0 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 118.549 1.174 . . . . 0.0 111.079 -175.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -69.98 -39.19 76.09 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 54.7 mt -63.98 -38.08 81.47 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.07 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 176.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -60.8 -45.24 95.17 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 118.92 -0.562 . . . . 0.0 110.654 176.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.95 -40.34 97.38 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 119.256 0.934 . . . . 0.0 111.396 178.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 99.4 mt -64.52 -58.56 6.05 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 119.709 -0.186 . . . . 0.0 111.044 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.556 HG21 ' HB2' ' A' ' 71' ' ' SER . 44.2 p -54.18 -41.36 68.47 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-N 118.0 0.363 . . . . 0.0 111.693 175.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.0 m -55.53 -60.18 3.79 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 119.227 -0.416 . . . . 0.0 111.104 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -67.15 -32.69 73.98 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 119.134 -1.026 . . . . 0.0 111.711 -174.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.38 -58.14 9.91 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 122.029 -0.42 . . . . 0.0 110.109 174.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.0 mt -70.45 -17.02 62.99 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.637 0.775 . . . . 0.0 112.47 -175.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -66.9 -21.76 65.98 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -178.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.4 t60 -148.17 -30.03 0.3 Allowed 'General case' 0 C--N 1.34 0.169 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -175.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.514 HG22 HG22 ' A' ' 93' ' ' THR . 33.4 mm 43.86 73.95 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 121.583 0.706 . . . . 0.0 111.436 -178.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -149.49 21.12 0.93 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.705 0.802 . . . . 0.0 109.754 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.595 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.24 36.85 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 C-N-CA 124.539 1.135 . . . . 0.0 109.183 -172.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.49 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -50.95 -56.12 13.92 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -175.899 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 79.2 p -75.29 -25.78 58.22 Favored 'General case' 0 CA--C 1.522 -0.129 0 N-CA-C 112.33 0.492 . . . . 0.0 112.33 -173.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.676 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -83.07 -42.3 17.6 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -179.3 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 21.0 mt -57.61 -52.77 53.21 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.123 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 171.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 13.3 mm -65.81 -47.05 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 CA-C-O 119.494 -0.288 . . . . 0.0 111.514 -176.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.6 t -56.21 -40.1 73.52 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 120.034 -0.667 . . . . 0.0 109.859 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.7 tp -68.3 -41.72 80.53 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 118.834 -0.603 . . . . 0.0 112.543 -176.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.7 pt -74.67 -36.4 40.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 CA-C-N 119.688 1.131 . . . . 0.0 111.946 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.454 HD13 HG21 ' A' ' 104' ' ' VAL . 96.0 mt -63.97 -48.59 85.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 177.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -59.47 -43.72 93.17 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.778 177.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.438 ' CD2' HD11 ' A' ' 14' ' ' LEU . 31.6 t80 -55.73 -40.1 72.02 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 177.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.7 t -65.34 -55.41 18.36 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -69.15 -21.17 64.02 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -173.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 50.2 mt -81.55 -14.8 56.41 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 179.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 78.8 m -125.04 163.73 35.9 Favored Pre-proline 0 CA--C 1.539 0.546 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 -169.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -59.11 174.26 1.0 Allowed 'Trans proline' 0 C--N 1.348 0.549 1 C-N-CA 126.041 4.494 . . . . 0.0 114.645 -179.231 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.567 ' HB3' ' HE2' ' A' ' 115' ' ' LYS . 4.6 p-10 -59.42 -30.18 68.29 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -174.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 25.3 t -63.53 -36.88 85.25 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -78.49 -28.13 46.3 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.034 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -63.05 -45.31 92.83 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-N 119.013 0.824 . . . . 0.0 109.104 173.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.7 tp -63.32 -48.27 78.73 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.76 -41.86 96.14 Favored Glycine 0 C--N 1.336 0.579 0 N-CA-C 111.111 -0.796 . . . . 0.0 111.111 178.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.2 m -63.63 -43.97 95.26 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 117.043 0.422 . . . . 0.0 110.443 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 81.6 mt -62.34 -37.02 84.04 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 118.086 0.403 . . . . 0.0 110.749 179.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -70.81 -33.28 70.54 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.64 0.654 . . . . 0.0 111.344 177.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 69.9 mt -71.3 -41.38 74.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 176.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 66.8 mt -65.25 -33.72 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 123.516 0.726 . . . . 0.0 109.412 177.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -75.18 -42.48 55.74 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 119.606 -0.235 . . . . 0.0 111.361 -178.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.556 ' HB2' HG21 ' A' ' 33' ' ' THR . 10.9 p -68.42 -49.77 57.53 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-N 118.592 0.633 . . . . 0.0 110.731 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 54.8 mt -67.4 -42.67 87.6 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.096 0 CA-C-N 117.725 0.239 . . . . 0.0 110.466 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.22 -39.66 94.54 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 -178.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.0 ttm-85 -70.1 -40.02 75.19 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.181 0.592 . . . . 0.0 110.314 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.92 -40.38 83.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 178.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -62.36 -49.43 75.59 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 175.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.6 tp -57.61 -48.39 79.54 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.017 0.527 . . . . 0.0 110.25 -176.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -64.51 -43.86 92.74 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.808 -0.178 . . . . 0.0 110.811 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -67.9 -39.25 83.65 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 121.127 -0.229 . . . . 0.0 111.506 -175.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.1 t -80.17 -24.28 40.45 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.872 -178.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -82.03 -24.19 35.48 Favored 'General case' 0 C--N 1.341 0.212 0 CA-C-N 118.438 0.563 . . . . 0.0 111.621 172.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.0 t -75.68 -18.1 59.74 Favored 'General case' 0 CA--C 1.528 0.135 0 CA-C-N 117.948 0.34 . . . . 0.0 111.725 177.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -86.76 147.29 25.91 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 49.4 m -140.54 5.02 2.0 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.562 0.745 . . . . 0.0 111.389 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -95.47 163.87 13.05 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.05 0.54 . . . . 0.0 109.938 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 78.9 p -72.35 151.38 42.74 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.984 0.421 . . . . 0.0 110.933 -179.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.9 t -158.33 169.79 23.69 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.091 0.556 . . . . 0.0 109.592 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.6 t -71.25 158.92 35.55 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 120.987 0.422 . . . . 0.0 110.351 178.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -129.61 6.49 5.19 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.271 0.628 . . . . 0.0 111.273 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.411 ' N ' ' HD2' ' A' ' 91' ' ' PRO . 40.8 ttmt -74.46 -45.18 5.8 Favored Pre-proline 0 CA--C 1.532 0.288 0 CA-C-O 118.353 -0.832 . . . . 0.0 112.534 -178.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.411 ' HD2' ' N ' ' A' ' 90' ' ' LYS . 59.4 Cg_endo -80.02 -16.01 11.44 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.259 1.973 . . . . 0.0 111.439 178.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 75.66 -33.69 1.2 Allowed Glycine 0 CA--C 1.529 0.949 0 C-N-CA 124.167 0.889 . . . . 0.0 112.249 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.514 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER 49.39 -158.92 0.07 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.71 1.204 . . . . 0.0 113.767 176.827 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.2 p -53.0 -30.17 33.65 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.034 0.934 . . . . 0.0 113.434 -175.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.74 -46.32 90.13 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 118.97 0.804 . . . . 0.0 109.859 175.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -73.78 -23.04 59.65 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.897 178.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.75 -45.89 84.5 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 175.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.6 mt -64.45 -43.0 96.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 176.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -60.18 -34.12 73.15 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 121.309 -0.156 . . . . 0.0 111.33 178.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.6 m -74.92 -41.29 59.96 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-O 119.517 -0.278 . . . . 0.0 111.342 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.2 mt -61.39 -30.5 70.59 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 174.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.68 -14.92 31.38 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 119.277 -0.735 . . . . 0.0 113.637 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.78 -6.92 24.23 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.701 1.25 . . . . 0.0 111.959 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.454 HG21 HD13 ' A' ' 51' ' ' ILE . 27.3 m -121.18 -20.29 4.36 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -178.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.416 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.5 tp -51.42 -27.66 7.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 C-N-CA 123.027 0.531 . . . . 0.0 112.099 -177.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -64.1 -56.22 16.42 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 122.765 0.426 . . . . 0.0 110.81 177.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -66.31 -40.32 89.9 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 73.5 mt -58.59 -55.68 31.94 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 119.05 -0.5 . . . . 0.0 110.946 -177.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.3 mt -69.45 -51.8 32.78 Favored 'General case' 0 N--CA 1.457 -0.08 0 CA-C-N 118.581 0.628 . . . . 0.0 111.565 -177.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 80.4 p -55.06 -49.82 70.66 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 120.116 -0.634 . . . . 0.0 111.706 -178.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -69.69 -45.76 67.58 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 118.897 0.772 . . . . 0.0 111.513 -178.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -51.91 -55.88 17.51 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 118.11 0.414 . . . . 0.0 110.955 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 25.7 mt -69.19 -37.28 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 O-C-N 122.955 0.159 . . . . 0.0 110.821 -178.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.61 -21.46 61.84 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.143 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.567 ' HE2' ' HB3' ' A' ' 59' ' ' ASP . 0.1 OUTLIER -98.39 -15.17 19.79 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.649 0.38 . . . . 0.0 111.929 -175.736 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 87.8 p -84.34 167.99 16.03 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -174.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . 0.522 HD21 ' CD2' ' A' ' 120' ' ' HIS . 11.6 p30 -86.72 174.42 8.85 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 49.9 mm-40 -55.89 -40.31 72.81 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.558 0.617 . . . . 0.0 112.04 -175.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -71.42 -42.6 68.08 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.514 0.597 . . . . 0.0 111.001 -179.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.522 ' CD2' HD21 ' A' ' 117' ' ' ASN . 11.4 m-70 -71.17 -42.42 69.1 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.149 -0.345 . . . . 0.0 110.543 -178.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.4 ttpt -51.36 -49.88 60.6 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 169.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -61.12 -37.82 84.14 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 120.93 -0.308 . . . . 0.0 111.33 -175.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -63.03 -43.33 98.99 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 122.365 -0.209 . . . . 0.0 111.483 175.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 69.4 mt -69.59 -34.24 60.58 Favored 'Isoleucine or valine' 0 C--N 1.338 0.096 0 C-N-CA 119.869 -0.733 . . . . 0.0 109.05 178.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -35.75 81.95 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 177.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 19.9 ttt -66.27 -43.72 85.6 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 123.132 0.573 . . . . 0.0 110.316 175.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.41 -41.29 84.62 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 176.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 75.9 mt -70.43 -31.23 68.33 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 178.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -67.47 -39.47 85.29 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 117.941 0.337 . . . . 0.0 110.135 178.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.66 -42.28 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 177.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 61.3 t90 -61.83 -36.96 82.71 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.494 0.318 . . . . 0.0 110.868 177.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -75.08 -37.28 61.61 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 122.695 0.398 . . . . 0.0 111.305 178.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -67.3 -40.07 86.0 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 122.203 0.201 . . . . 0.0 111.104 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 64.9 m -73.63 -16.58 61.22 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 111.37 0.137 . . . . 0.0 111.37 178.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -88.15 -4.82 77.42 Favored Glycine 0 CA--C 1.527 0.833 0 CA-C-O 119.667 -0.518 . . . . 0.0 112.036 178.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 73.4 mt 56.44 179.49 0.04 OUTLIER 'General case' 0 C--N 1.343 0.325 0 C-N-CA 124.38 1.072 . . . . 0.0 112.194 -176.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 54.4 -164.17 0.11 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.792 0.837 . . . . 0.0 111.739 -178.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.9 13.83 9.89 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.193 0.597 . . . . 0.0 111.963 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -107.07 146.69 30.9 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.206 0.602 . . . . 0.0 110.213 -178.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 81.6 p -88.21 167.62 13.44 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 122.993 0.517 . . . . 0.0 111.321 -179.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -127.9 10.26 6.46 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.975 0.51 . . . . 0.0 111.405 -179.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.555 ' HG ' ' H ' ' A' ' 144' ' ' ALA . 55.8 tp -148.16 137.54 22.15 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 122.847 0.459 . . . . 0.0 109.977 -178.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -80.93 -14.48 57.95 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -176.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.555 ' H ' ' HG ' ' A' ' 142' ' ' LEU . . . -53.26 -45.22 68.72 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.123 0.969 . . . . 0.0 111.986 -171.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.754 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -103.21 -10.7 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 C-N-CA 122.387 0.275 . . . . 0.0 111.713 174.479 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -58.61 -31.95 68.54 Favored 'General case' 0 C--N 1.339 0.132 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 174.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 47.3 t -69.77 118.63 12.88 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 169.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.472 ' O ' ' HB2' ' A' ' 152' ' ' MET . 99.2 mttt -56.06 -20.66 17.91 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 123.773 0.829 . . . . 0.0 113.102 -172.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 72.1 m -43.57 -29.29 0.46 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.608 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . 0.542 ' CE1' ' HG2' ' A' ' 152' ' ' MET . 6.4 p90 -49.98 -126.67 0.0 OUTLIER 'General case' 0 C--N 1.344 0.353 0 C-N-CA 126.301 1.84 . . . . 0.0 114.279 -176.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . 0.456 ' N ' ' CG ' ' A' ' 150' ' ' PHE . . . -66.96 -0.06 2.86 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 120.408 -1.432 . . . . 0.0 110.851 172.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . 0.542 ' HG2' ' CE1' ' A' ' 150' ' ' PHE . 12.8 mmt -106.14 -13.74 15.35 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 119.59 1.087 . . . . 0.0 111.751 -177.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 28.6 t70 50.81 13.97 0.16 Allowed 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 172.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 54.7 tp . . . . . 0 C--O 1.251 1.146 0 CA-C-O 117.766 -1.111 . . . . 0.0 110.713 -178.678 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 55.0 p90 . . . . . 0 N--CA 1.473 0.708 0 N-CA-C 110.585 -0.154 . . . . 0.0 110.585 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 53.0 m -130.34 156.76 78.98 Favored Pre-proline 0 CA--C 1.531 0.214 0 C-N-CA 123.377 0.671 . . . . 0.0 110.442 -178.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -69.05 164.83 32.31 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 123.754 2.969 . . . . 0.0 111.213 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 82.2 p -136.75 177.57 7.75 Favored 'General case' 0 N--CA 1.457 -0.082 0 C-N-CA 123.324 0.65 . . . . 0.0 110.81 -177.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 160' ' ' PRO . . . . . 0.408 ' HD2' ' C ' ' A' ' 26' ' ' GLY . 44.5 Cg_endo -79.35 13.05 18.83 Favored 'Cis proline' 0 N--CA 1.455 -0.764 0 CA-C-N 118.786 0.602 . . . . 0.0 110.854 -10.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 18.8 t 62.82 171.56 0.14 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.901 1.28 . . . . 0.0 112.108 -171.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -144.52 148.53 34.58 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.753 0.821 . . . . 0.0 110.306 -178.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 16.1 t -124.44 130.51 24.29 Favored Pre-proline 0 N--CA 1.45 -0.43 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.72 -10.8 4.19 Favored 'Trans proline' 0 N--CA 1.452 -0.952 0 C-N-CA 123.292 2.661 . . . . 0.0 113.054 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 67.2 p -72.63 -19.32 61.47 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -177.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -71.21 176.22 8.16 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 123.608 2.872 . . . . 0.0 111.666 178.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 74.1 m . . . . . 0 C--O 1.252 1.199 0 CA-C-O 117.775 -1.107 . . . . 0.0 111.172 176.808 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.836 0 CA-C-O 120.26 0.076 . . . . 0.0 110.934 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -139.03 164.62 29.29 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.029 0.532 . . . . 0.0 110.262 179.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -101.58 155.59 18.0 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 122.863 0.465 . . . . 0.0 110.894 -177.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 60.61 144.59 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.202 1.801 . . . . 0.0 114.297 -178.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -147.95 31.24 0.86 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.173 0.989 . . . . 0.0 109.588 179.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -75.75 -152.69 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.83 0.852 . . . . 0.0 110.282 179.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -54.28 -15.06 1.37 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.928 0.891 . . . . 0.0 111.957 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.4 tp60 -55.64 -41.8 74.1 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.191 0.596 . . . . 0.0 111.13 177.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -65.47 -38.75 90.72 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 118.637 0.653 . . . . 0.0 110.521 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -64.44 -55.13 22.96 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 120.726 0.298 . . . . 0.0 110.235 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 96.6 t -59.16 -54.65 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.52 -32.1 68.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.938 0.495 . . . . 0.0 112.08 -177.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 58.9 m -72.56 -44.44 62.08 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 118.45 0.568 . . . . 0.0 110.707 177.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.9 tp -67.72 -33.38 74.76 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.424 0.631 . . . . 0.0 109.854 -179.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -65.15 -45.45 84.9 Favored 'General case' 0 CA--C 1.521 -0.159 0 C-N-CA 123.842 0.857 . . . . 0.0 109.216 176.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.3 t -61.6 -32.13 72.23 Favored 'General case' 0 N--CA 1.457 -0.079 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 175.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -61.58 -49.92 74.7 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 176.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -67.71 -36.56 80.85 Favored 'General case' 0 C--N 1.339 0.129 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -77.14 -37.38 54.11 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -175.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 34.4 tp -82.75 -17.64 43.53 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 117.672 0.214 . . . . 0.0 111.399 -176.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm 52.72 29.19 7.1 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.412 0.685 . . . . 0.0 112.145 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 69.3 p -74.67 179.59 4.67 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.658 0.783 . . . . 0.0 111.227 -179.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -76.57 -141.53 1.2 Allowed Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.5 mm -106.08 36.43 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 123.073 0.549 . . . . 0.0 110.71 -174.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.6 m -54.95 128.51 33.78 Favored 'General case' 0 C--N 1.339 0.134 0 O-C-N 121.959 -0.463 . . . . 0.0 110.241 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.81 -15.27 62.03 Favored Glycine 0 C--N 1.337 0.584 0 CA-C-O 119.166 -0.796 . . . . 0.0 113.761 -174.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.1 p -62.38 -40.08 95.27 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 119.155 1.478 . . . . 0.0 110.823 -177.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -68.16 -42.72 79.64 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 56.1 mt -63.77 -36.04 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.3 mmtt -66.5 -42.21 87.73 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 118.743 -0.646 . . . . 0.0 110.864 179.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.13 -41.77 94.51 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.213 0.915 . . . . 0.0 111.039 175.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.2 mt -61.81 -57.28 12.47 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 122.563 -0.086 . . . . 0.0 110.929 -179.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.563 HG21 ' HB2' ' A' ' 71' ' ' SER . 41.3 p -55.67 -43.97 76.85 Favored 'General case' 0 CA--C 1.523 -0.071 0 O-C-N 122.152 -0.343 . . . . 0.0 111.641 177.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 m -55.38 -58.8 6.23 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 122.396 0.278 . . . . 0.0 110.799 -178.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -78.59 -14.62 59.24 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -172.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.42 -58.51 3.65 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 166.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.4 mt -65.62 -20.69 66.41 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.901 0.88 . . . . 0.0 112.284 -176.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -72.59 -14.89 61.72 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -133.71 -46.11 0.81 Allowed 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 119.011 0.823 . . . . 0.0 112.964 -176.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.512 HG22 HG22 ' A' ' 93' ' ' THR . 39.8 mm 40.27 66.32 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 122.304 1.05 . . . . 0.0 111.529 -174.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -150.34 21.62 0.84 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.663 1.185 . . . . 0.0 108.655 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.577 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -148.8 35.52 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 C-N-CA 125.069 1.347 . . . . 0.0 109.063 -170.562 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.442 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -51.45 -52.81 43.17 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -175.044 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 83.5 p -76.57 -24.06 53.54 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -173.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.645 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -86.2 -41.76 14.39 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -179.584 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 48.8 mt -56.27 -52.77 47.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 118.259 0.481 . . . . 0.0 109.817 170.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 14.8 mm -67.09 -48.12 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.139 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.582 -177.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 48.4 t -55.76 -37.64 68.8 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 120.001 -0.68 . . . . 0.0 109.722 178.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.4 tp -69.31 -43.12 74.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.551 -0.738 . . . . 0.0 112.613 -177.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 31.3 pt -72.41 -35.53 52.05 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 120.047 1.294 . . . . 0.0 111.781 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.505 HD13 HG21 ' A' ' 104' ' ' VAL . 94.9 mt -64.24 -49.66 80.13 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-O 121.593 0.711 . . . . 0.0 109.257 178.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -57.92 -41.97 83.83 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.474 177.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -56.45 -41.07 75.88 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 176.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.4 t -66.22 -48.42 70.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 112.135 0.421 . . . . 0.0 112.135 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -73.21 -23.97 60.45 Favored 'General case' 0 C--O 1.231 0.081 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -175.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 51.4 mt -80.49 -15.1 57.55 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 178.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.408 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 73.4 m -119.87 157.36 52.74 Favored Pre-proline 0 CA--C 1.536 0.434 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -171.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 90.5 Cg_endo -72.62 -170.79 0.64 Allowed 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 125.045 3.83 . . . . 0.0 113.642 -176.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -50.67 -44.98 57.83 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.42 1.888 . . . . 0.0 114.462 -170.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.0 p -60.12 -31.4 70.03 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.403 ' CG ' ' HB3' ' A' ' 57' ' ' CYS . 65.1 m-70 -86.32 -14.7 42.84 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 118.921 -0.561 . . . . 0.0 111.136 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.411 ' HB2' ' HE2' ' A' ' 115' ' ' LYS . 75.1 mmtt -69.85 -43.47 71.87 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 171.187 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 57.2 tp -66.44 -49.12 67.76 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.3 -38.32 93.15 Favored Glycine 0 C--N 1.336 0.552 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 178.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.1 t -60.94 -51.07 70.82 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 177.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 49.5 mt -58.59 -34.58 71.27 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.736 -0.65 . . . . 0.0 111.605 179.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -72.41 -33.53 67.21 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.389 0.995 . . . . 0.0 111.783 177.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 75.9 mt -75.69 -40.42 40.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 118.607 0.639 . . . . 0.0 110.378 178.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 84.6 mt -63.63 -36.68 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 174.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -67.8 -43.68 79.1 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.998 -0.525 . . . . 0.0 111.057 178.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.563 ' HB2' HG21 ' A' ' 33' ' ' THR . 89.3 p -67.17 -57.13 7.33 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 118.627 0.649 . . . . 0.0 111.289 -177.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 54.1 mt -64.88 -30.5 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 178.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.09 -54.67 19.81 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-O 119.851 -0.416 . . . . 0.0 112.541 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.64 ' HG3' HH11 ' A' ' 74' ' ' ARG . 0.0 OUTLIER -66.49 -34.13 77.24 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 118.162 0.981 . . . . 0.0 110.754 -179.678 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.79 -45.96 76.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 110.318 -0.253 . . . . 0.0 110.318 177.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -63.71 -46.76 83.96 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 177.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 60.5 tp -55.93 -45.38 78.78 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 122.802 0.441 . . . . 0.0 110.507 -177.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -67.41 -46.94 71.7 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 120.775 -0.37 . . . . 0.0 110.811 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -64.68 -24.95 67.74 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -175.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.3 t -99.09 -27.77 13.68 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 118.798 0.726 . . . . 0.0 112.237 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 -84.2 -18.83 35.3 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.948 -0.47 . . . . 0.0 111.882 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 88.3 p -62.1 -18.88 62.16 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 118.223 0.465 . . . . 0.0 111.994 177.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 45.9 t30 52.28 25.02 3.13 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.228 1.011 . . . . 0.0 112.643 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 90.4 p -87.8 -3.11 58.97 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 122.677 0.391 . . . . 0.0 111.788 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -147.87 155.34 41.52 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.2 0.6 . . . . 0.0 109.403 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.0 t -99.56 -5.63 28.8 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.214 0.606 . . . . 0.0 111.173 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.4 t 56.88 -173.75 0.07 Allowed 'General case' 0 C--N 1.341 0.222 0 C-N-CA 124.287 1.035 . . . . 0.0 112.18 -177.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 53.8 m -71.81 163.71 27.32 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.216 0.606 . . . . 0.0 110.913 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -103.4 13.03 34.54 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -174.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.697 ' H ' ' HD2' ' A' ' 91' ' ' PRO . 88.8 tttt -133.22 -52.36 0.03 OUTLIER Pre-proline 0 CA--C 1.533 0.298 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -179.044 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.697 ' HD2' ' H ' ' A' ' 90' ' ' LYS . 95.8 Cg_endo -75.53 159.73 39.12 Favored 'Trans proline' 0 N--CA 1.452 -0.918 0 C-N-CA 122.137 1.891 . . . . 0.0 110.745 178.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.436 ' HA3' ' CG ' ' A' ' 96' ' ' HIS . . . -83.27 -20.79 59.89 Favored Glycine 0 CA--C 1.529 0.93 0 N-CA-C 111.551 -0.619 . . . . 0.0 111.551 178.109 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.512 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER 49.68 -160.67 0.06 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.665 1.186 . . . . 0.0 114.093 177.867 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.6 p -53.58 -28.46 32.14 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.153 0.981 . . . . 0.0 113.549 -174.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.74 -46.16 86.61 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 118.921 0.782 . . . . 0.0 109.952 176.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.436 ' CG ' ' HA3' ' A' ' 92' ' ' GLY . 3.2 m80 -73.96 -22.32 59.68 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.462 178.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.79 -46.57 78.18 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 175.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 94.9 mt -63.05 -41.69 93.8 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 175.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -63.51 -33.87 76.53 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 179.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.6 m -73.12 -39.7 65.55 Favored 'General case' 0 C--O 1.227 -0.126 0 O-C-N 122.342 -0.224 . . . . 0.0 110.654 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.1 mt -62.34 -31.58 72.24 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 173.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.46 -15.4 24.36 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-O 119.0 -0.889 . . . . 0.0 113.463 179.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -100.29 -4.74 28.68 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 119.263 1.531 . . . . 0.0 111.856 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.505 HG21 HD13 ' A' ' 51' ' ' ILE . 28.7 m -124.52 -20.55 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 122.823 0.449 . . . . 0.0 112.024 -179.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.416 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.8 tp -54.4 -23.4 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 C-N-CA 123.358 0.663 . . . . 0.0 112.222 -176.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -59.4 -54.01 51.56 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.623 0.369 . . . . 0.0 111.602 178.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -78.34 -29.16 47.42 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 121.124 -0.23 . . . . 0.0 110.795 -177.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.2 mt -63.16 -52.16 63.54 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 64.3 mt -64.79 -59.81 3.8 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 118.478 -0.773 . . . . 0.0 110.369 176.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 90.7 p -52.77 -42.32 64.89 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 118.97 -1.092 . . . . 0.0 111.857 -172.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -69.44 -47.49 63.88 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 119.16 0.891 . . . . 0.0 111.175 178.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.84 -34.58 65.53 Favored 'General case' 0 N--CA 1.458 -0.068 0 C-N-CA 123.503 0.721 . . . . 0.0 112.323 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -81.92 -39.75 16.92 Favored 'Isoleucine or valine' 0 C--N 1.337 0.041 0 CA-C-N 119.471 1.032 . . . . 0.0 112.048 175.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.64 -25.95 64.17 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.344 -178.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.411 ' HE2' ' HB2' ' A' ' 62' ' ' LYS . 0.1 OUTLIER -81.94 -17.39 47.22 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.256 0.623 . . . . 0.0 110.731 178.406 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 13.3 m -80.88 160.85 24.62 Favored 'General case' 0 N--CA 1.457 -0.079 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -174.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -96.27 -179.2 4.57 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 170.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -55.47 -43.5 75.56 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.931 0.787 . . . . 0.0 111.828 -177.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -68.6 -41.39 79.66 Favored 'General case' 0 N--CA 1.453 -0.285 0 O-C-N 121.555 -0.715 . . . . 0.0 111.05 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -72.15 -38.27 69.24 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 122.158 -0.339 . . . . 0.0 111.176 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.73 -34.94 78.95 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -63.14 -42.51 99.48 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 178.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -61.59 -42.71 99.26 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 110.556 -0.165 . . . . 0.0 110.556 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.0 mt -65.89 -37.74 80.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 39.4 ttt180 -63.35 -33.26 75.13 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 176.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 62.4 ttp -67.79 -41.45 83.19 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 176.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 88.3 mt -58.76 -45.7 89.14 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.197 176.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.3 mt -67.33 -35.25 79.03 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 111.571 0.212 . . . . 0.0 111.571 -179.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -66.01 -37.43 85.91 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 117.999 0.363 . . . . 0.0 110.176 178.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 89.4 mt -70.27 -38.83 75.69 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 177.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 44.4 m0 -66.86 -29.97 70.01 Favored 'General case' 0 C--N 1.338 0.099 0 CA-C-N 117.874 0.307 . . . . 0.0 110.43 177.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -77.27 -34.34 55.73 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 117.757 0.253 . . . . 0.0 110.891 176.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 22.8 tpp180 -70.73 -38.33 73.56 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 122.618 0.367 . . . . 0.0 111.372 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 90.8 p -86.4 -13.53 46.04 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.43 0.292 . . . . 0.0 111.747 179.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 72.58 -174.08 45.93 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 -178.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.503 ' HG ' ' H ' ' A' ' 138' ' ' GLN . 35.2 tp -143.19 150.64 39.64 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 53.2 t80 -82.36 -0.48 46.07 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.075 0.55 . . . . 0.0 110.853 -178.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . 0.503 ' H ' ' HG ' ' A' ' 136' ' ' LEU . 75.8 mt-30 -139.04 168.34 20.06 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.229 1.011 . . . . 0.0 109.063 -178.048 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -134.83 177.02 8.12 Favored 'General case' 0 C--N 1.338 0.087 0 C-N-CA 122.798 0.439 . . . . 0.0 111.484 -174.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 19.9 m 60.41 23.9 13.47 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.295 1.038 . . . . 0.0 113.603 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -125.3 7.81 7.8 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.107 0.563 . . . . 0.0 111.27 178.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 83.4 mt -94.3 -7.53 41.64 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.467 0.544 . . . . 0.0 112.467 -175.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 67.0 m-20 -80.08 -6.18 57.2 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 122.815 0.446 . . . . 0.0 111.403 178.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.449 ' C ' ' H ' ' A' ' 146' ' ' ARG . . . -38.3 -37.38 0.28 Allowed 'General case' 0 C--N 1.343 0.314 0 C-N-CA 127.858 2.463 . . . . 0.0 114.253 -173.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.655 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -67.92 15.93 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-O 119.214 -0.422 . . . . 0.0 112.093 178.207 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.449 ' H ' ' C ' ' A' ' 144' ' ' ALA . 99.6 mtt180 50.66 47.55 24.16 Favored 'General case' 0 C--N 1.34 0.153 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 -173.333 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 12.6 t 69.16 168.65 0.29 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.242 1.017 . . . . 0.0 112.625 -174.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -55.21 -14.62 1.81 Allowed 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 116.369 1.988 . . . . 0.0 116.369 -167.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 44.3 t -49.28 -47.33 46.92 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.101 1.318 . . . . 0.0 111.422 -174.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . 0.408 ' CD1' ' O ' ' A' ' 145' ' ' ILE . 18.7 m-85 -53.83 -85.71 0.01 OUTLIER 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 126.057 1.743 . . . . 0.0 114.398 -172.136 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -82.93 -14.33 54.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 119.402 -0.333 . . . . 0.0 111.835 -178.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 35.9 mtm -111.36 -12.02 14.08 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 114.892 1.441 . . . . 0.0 114.892 -168.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -112.18 -11.83 13.71 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 120.029 1.286 . . . . 0.0 111.881 174.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 95.4 mt . . . . . 0 C--O 1.251 1.158 0 CA-C-O 117.225 -1.369 . . . . 0.0 111.109 -178.499 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 . . . . . 0 N--CA 1.474 0.765 0 CA-C-O 120.313 0.101 . . . . 0.0 111.068 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 60.3 p -148.11 155.25 43.5 Favored Pre-proline 0 CA--C 1.529 0.165 0 C-N-CA 122.739 0.416 . . . . 0.0 110.19 179.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -74.52 164.44 33.88 Favored 'Trans proline' 0 N--CA 1.453 -0.899 0 C-N-CA 123.695 2.93 . . . . 0.0 111.229 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 36.6 p 59.43 151.82 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 126.441 1.897 . . . . 0.0 114.143 -177.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -77.24 -178.74 25.01 Favored 'Cis proline' 0 N--CA 1.456 -0.72 0 CA-C-N 119.061 0.7 . . . . 0.0 110.37 -5.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 36.6 m -76.6 163.71 26.61 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 120.819 0.343 . . . . 0.0 110.898 176.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 162' ' ' TYR . . . . . 0.464 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 7.9 t80 -143.22 138.22 29.51 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.116 0.566 . . . . 0.0 110.307 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 35.9 t -124.88 142.31 40.63 Favored Pre-proline 0 N--CA 1.454 -0.267 0 C-N-CA 122.976 0.51 . . . . 0.0 111.46 177.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -66.87 -5.93 14.54 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 123.388 2.725 . . . . 0.0 111.523 175.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 66.9 p -96.6 25.36 5.19 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.826 0.45 . . . . 0.0 111.642 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -61.41 162.98 18.86 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 121.885 1.723 . . . . 0.0 110.605 170.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 32.0 t . . . . . 0 C--O 1.252 1.209 0 CA-C-O 117.522 -1.228 . . . . 0.0 110.857 -178.34 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.2 ttm . . . . . 0 N--CA 1.477 0.919 0 CA-C-O 119.567 -0.254 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.7 mm100 53.76 22.73 3.33 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 178.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -142.66 164.62 29.63 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 123.466 0.707 . . . . 0.0 110.364 -179.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -137.39 15.5 2.98 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.48 0.712 . . . . 0.0 111.126 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -123.9 34.79 4.98 Favored 'General case' 0 CA--C 1.527 0.095 0 C-N-CA 123.971 0.908 . . . . 0.0 110.503 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.421 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 12.9 t70 -73.79 -158.13 0.06 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.685 0.794 . . . . 0.0 110.385 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.421 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 13.5 t80 -55.58 -14.29 2.03 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.498 0.719 . . . . 0.0 111.142 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -51.4 -43.94 62.08 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.173 0.989 . . . . 0.0 110.609 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 44.7 m-20 -62.05 -44.2 97.2 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 118.042 0.383 . . . . 0.0 110.806 -179.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -64.88 -51.27 62.87 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 117.795 0.271 . . . . 0.0 110.566 -177.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.7 t -62.54 -55.09 26.08 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.05 -31.5 65.25 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.15 0.58 . . . . 0.0 111.802 -178.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 54.4 m -73.49 -43.0 61.14 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 118.387 0.54 . . . . 0.0 110.68 177.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.442 HD11 ' CD2' ' A' ' 53' ' ' TYR . 15.6 tp -66.72 -30.46 70.7 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -70.63 -43.83 68.44 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.167 0.987 . . . . 0.0 109.652 175.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -62.93 -26.77 68.97 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 175.302 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.49 -41.75 62.71 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 174.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -64.93 -28.0 69.23 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 123.087 0.555 . . . . 0.0 111.222 178.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -69.2 -14.59 63.06 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 178.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.1 mt -92.06 166.27 12.76 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 121.188 0.518 . . . . 0.0 111.158 -178.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -133.62 -1.2 3.12 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.216 176.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 34.6 t -157.7 157.57 33.76 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.693 0.797 . . . . 0.0 109.466 177.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.02 138.73 3.29 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.487 -0.645 . . . . 0.0 111.487 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.1 mm -119.07 45.12 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 124.534 1.134 . . . . 0.0 108.293 179.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.3 m -49.89 127.25 15.9 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.401 0.68 . . . . 0.0 112.103 -174.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.56 -15.08 63.47 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-O 119.012 -0.882 . . . . 0.0 113.705 -176.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.41 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 46.5 t -62.46 -42.86 99.77 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 118.966 1.383 . . . . 0.0 110.301 -178.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -66.99 -40.87 87.48 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 46.0 mt -60.98 -37.58 77.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 176.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -60.74 -49.23 78.34 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.042 0.537 . . . . 0.0 110.783 177.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.41 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.5 OUTLIER -61.25 -43.51 98.76 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 118.366 0.53 . . . . 0.0 110.971 179.036 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.67 -61.92 2.09 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 122.356 -0.215 . . . . 0.0 110.635 -179.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 64.1 p -55.94 -46.02 78.65 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.3 t -63.32 -44.06 96.01 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.742 -176.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -68.19 -36.22 79.24 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 118.816 -1.153 . . . . 0.0 111.209 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.42 -56.29 24.08 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 174.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.9 mt -70.32 -17.89 63.08 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.477 0.711 . . . . 0.0 112.586 -175.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -63.76 -24.46 67.77 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -150.24 -26.15 0.24 Allowed 'General case' 0 C--N 1.342 0.253 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -176.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.525 HG22 HG22 ' A' ' 93' ' ' THR . 32.6 mm 45.42 74.68 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 123.307 0.643 . . . . 0.0 111.484 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -148.49 21.63 1.04 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.661 0.784 . . . . 0.0 109.964 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.574 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.13 36.69 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.134 0 C-N-CA 124.439 1.095 . . . . 0.0 109.566 -171.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.457 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -51.11 -55.27 18.58 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 -175.701 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 80.7 p -75.76 -25.76 56.79 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -173.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.664 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -83.03 -44.23 15.44 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.342 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 22.2 mt -56.23 -53.82 35.08 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 CA-C-N 118.178 0.445 . . . . 0.0 109.973 172.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.9 mm -65.33 -48.32 83.72 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.161 0 CA-C-O 119.209 -0.424 . . . . 0.0 111.523 -175.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 44.4 t -56.22 -40.43 74.05 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.167 178.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.2 tp -68.45 -41.46 80.21 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.4 pt -74.52 -35.0 37.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 CA-C-N 119.325 0.966 . . . . 0.0 111.906 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.435 HD13 HG21 ' A' ' 104' ' ' VAL . 97.4 mt -63.77 -50.68 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 177.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -58.14 -43.52 87.35 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.761 178.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.442 ' CD2' HD11 ' A' ' 14' ' ' LEU . 24.0 t80 -56.23 -41.65 76.05 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 176.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.7 t -64.69 -53.84 41.07 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -70.9 -23.7 62.34 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -173.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 51.2 mt -82.92 -15.95 49.34 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 76.3 m -118.55 159.15 45.07 Favored Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 -169.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 57' ' ' CYS . 49.9 Cg_exo -59.16 -171.5 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 1 C-N-CA 126.544 4.83 . . . . 0.0 116.582 -179.375 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -47.37 -58.79 3.75 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 126.719 2.008 . . . . 0.0 114.725 -175.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.2 p -58.81 -22.78 59.33 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.391 0.139 . . . . 0.0 110.668 -177.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 42.0 m-70 -88.84 -27.58 20.97 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 118.72 -0.657 . . . . 0.0 110.985 -178.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -66.52 -46.53 75.86 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 119.568 1.077 . . . . 0.0 108.215 172.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.0 tp -65.67 -48.89 70.55 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.853 0.359 . . . . 0.0 110.126 178.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.01 -40.19 95.2 Favored Glycine 0 C--N 1.336 0.553 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.4 m -65.68 -43.38 89.45 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 117.676 0.738 . . . . 0.0 110.564 178.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 72.1 mt -59.62 -35.46 74.4 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.866 0.757 . . . . 0.0 110.877 177.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -73.73 -35.34 65.06 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.516 0.598 . . . . 0.0 111.345 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 73.7 mt -70.09 -48.01 64.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 O-C-N 121.528 -0.732 . . . . 0.0 109.831 177.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 77.8 mt -59.1 -38.39 73.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 C-N-CA 124.283 1.033 . . . . 0.0 109.18 178.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -66.52 -46.81 74.94 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 118.676 -0.678 . . . . 0.0 111.084 177.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.0 t -62.37 -52.72 62.5 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 118.988 0.813 . . . . 0.0 110.887 -175.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 43.4 mt -63.8 -34.76 70.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.09 -51.24 46.38 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-O 119.739 -0.478 . . . . 0.0 112.665 -178.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.671 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -71.4 -32.34 68.31 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 117.994 0.897 . . . . 0.0 110.228 -178.055 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.66 -45.08 72.71 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 176.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.3 m-30 -61.57 -49.9 74.79 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 176.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.1 tp -60.75 -43.79 97.51 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.783 0.433 . . . . 0.0 110.931 -174.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -67.27 -45.24 77.22 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.471 178.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -64.32 -39.59 94.2 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 111.509 0.189 . . . . 0.0 111.509 -175.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.0 t -80.93 -33.79 33.83 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 118.037 0.38 . . . . 0.0 111.313 -179.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.7 ttt85 -67.03 -29.23 68.98 Favored 'General case' 0 C--N 1.339 0.122 0 CA-C-N 118.406 0.548 . . . . 0.0 110.405 177.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 24.2 t -69.97 -14.25 62.62 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 177.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -134.71 6.08 3.44 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -174.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 31.9 t -144.88 159.63 42.59 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 118.573 0.624 . . . . 0.0 111.051 -178.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -107.68 14.48 25.58 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.748 0.819 . . . . 0.0 111.073 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 33.3 m 54.31 31.94 15.32 Favored 'General case' 0 CA--C 1.527 0.085 0 C-N-CA 123.498 0.719 . . . . 0.0 111.994 -178.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 74.4 p -78.81 5.06 12.25 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.351 0.66 . . . . 0.0 112.176 -179.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 40.3 t -141.97 161.15 38.7 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 123.173 0.589 . . . . 0.0 110.12 178.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -119.65 -10.31 9.61 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.081 0.552 . . . . 0.0 111.386 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.452 ' N ' ' CD ' ' A' ' 91' ' ' PRO . 96.4 mttt -135.78 42.31 0.71 Allowed Pre-proline 0 CA--C 1.533 0.323 0 CA-C-O 118.901 -0.571 . . . . 0.0 112.106 -179.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.452 ' CD ' ' N ' ' A' ' 90' ' ' LYS . 62.2 Cg_endo -76.26 -4.06 14.6 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.856 2.371 . . . . 0.0 111.406 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 82.8 -172.02 51.46 Favored Glycine 0 C--N 1.338 0.661 0 N-CA-C 111.109 -0.796 . . . . 0.0 111.109 -178.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.525 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER 54.23 -158.67 0.18 Allowed 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.466 1.106 . . . . 0.0 113.371 176.813 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 23.3 p -50.88 -30.34 14.33 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -175.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.82 -44.75 88.84 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.597 -0.689 . . . . 0.0 110.046 176.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -68.02 -30.29 69.5 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.931 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.49 -45.8 85.74 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 123.287 0.635 . . . . 0.0 110.143 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.6 mt -64.46 -42.23 94.65 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 175.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 44.6 t-20 -60.99 -33.62 73.52 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 121.255 -0.178 . . . . 0.0 110.725 178.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.8 m -73.54 -40.58 63.87 Favored 'General case' 0 N--CA 1.457 -0.097 0 CA-C-O 119.492 -0.29 . . . . 0.0 110.884 179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.1 mt -62.29 -29.65 70.58 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 173.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.69 -14.92 31.46 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 118.994 -0.892 . . . . 0.0 113.919 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -100.12 -6.24 26.58 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.016 1.408 . . . . 0.0 111.966 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.435 HG21 HD13 ' A' ' 51' ' ' ILE . 27.6 m -122.16 -18.57 4.74 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.163 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -178.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.7 tp -50.89 -28.46 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 CA-C-N 118.426 0.557 . . . . 0.0 111.602 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -59.35 -53.49 57.66 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.67 0.388 . . . . 0.0 110.849 177.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -80.72 -27.91 36.78 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 119.605 -0.236 . . . . 0.0 111.476 -177.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 82.0 mt -65.28 -50.84 64.18 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 178.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.465 ' O ' HG13 ' A' ' 113' ' ' ILE . 83.7 mt -64.37 -64.8 0.79 Allowed 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 175.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.2 t -34.4 -55.44 0.53 Allowed 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 179.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -73.12 -39.29 65.86 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-N 119.359 0.981 . . . . 0.0 112.054 -177.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.418 ' O ' ' HE2' ' A' ' 115' ' ' LYS . . . -57.56 -49.46 76.3 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.847 0.749 . . . . 0.0 110.216 179.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.2 OUTLIER -76.04 -32.57 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -179.119 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.35 -28.76 67.42 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.542 0.61 . . . . 0.0 109.841 179.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.418 ' HE2' ' O ' ' A' ' 112' ' ' ALA . 0.4 OUTLIER -79.21 -23.04 44.06 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.833 0.853 . . . . 0.0 110.374 175.12 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.408 ' HB3' ' HB2' ' A' ' 120' ' ' HIS . 35.5 m -76.87 154.95 33.28 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 113.75 1.018 . . . . 0.0 113.75 -172.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -92.1 -178.35 4.95 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 170.177 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -55.61 -43.82 76.44 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.094 0.407 . . . . 0.0 111.396 -178.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -66.71 -43.02 85.4 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 121.716 -0.615 . . . . 0.0 110.85 -178.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.408 ' HB2' ' HB3' ' A' ' 116' ' ' SER . 55.7 m80 -70.25 -36.08 74.22 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 119.628 -0.225 . . . . 0.0 110.777 -178.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.08 -39.48 92.56 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 174.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -67.41 -38.65 84.95 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.689 -177.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -63.04 -44.47 95.8 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 121.209 -0.196 . . . . 0.0 111.169 175.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 97.5 mt -66.94 -35.92 75.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 80.0 ttt-85 -66.4 -32.19 73.42 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 122.079 -0.388 . . . . 0.0 110.181 176.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 58.3 ttp -67.19 -42.47 84.15 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 175.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 64.7 tp -57.34 -47.81 80.63 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.95 0.405 . . . . 0.0 110.221 176.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 84.1 mt -70.79 -27.79 64.16 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.443 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -69.69 -38.66 77.09 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 175.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 86.7 mt -65.14 -42.59 94.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 176.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 44.3 m0 -59.34 -47.41 85.52 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 117.807 0.276 . . . . 0.0 110.846 177.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -66.6 -39.55 88.44 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -177.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 77.4 mtp180 -73.68 -26.0 60.52 Favored 'General case' 0 C--O 1.231 0.09 0 C-N-CA 122.473 0.309 . . . . 0.0 111.45 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 52.9 m -78.83 -14.33 59.31 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 122.287 0.235 . . . . 0.0 111.126 175.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 76.67 15.9 81.2 Favored Glycine 0 CA--C 1.528 0.898 0 N-CA-C 111.317 -0.713 . . . . 0.0 111.317 -177.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 82.6 mt -105.84 166.0 10.79 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.433 0.693 . . . . 0.0 111.083 -175.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 53.46 25.93 5.1 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 178.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 42.2 mm-40 -73.72 4.26 5.34 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.079 0.552 . . . . 0.0 111.891 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -70.1 164.14 24.74 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.908 0.483 . . . . 0.0 111.091 -179.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 20.1 m 53.77 22.19 3.07 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.733 0.813 . . . . 0.0 112.958 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 63.9 m-85 51.35 25.65 2.68 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 124.055 0.942 . . . . 0.0 112.915 178.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 93.7 mt 53.3 25.92 4.84 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 123.668 0.787 . . . . 0.0 112.483 -177.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . 0.487 ' HA ' ' HB3' ' A' ' 146' ' ' ARG . 52.5 t30 -50.23 -32.87 17.68 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.105 0.562 . . . . 0.0 111.854 -176.427 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -50.24 -36.61 31.81 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.969 1.708 . . . . 0.0 111.985 -172.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.504 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -119.61 -6.8 11.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-O 119.512 -0.28 . . . . 0.0 111.374 170.914 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.487 ' HB3' ' HA ' ' A' ' 143' ' ' ASN . 30.9 ttt85 -54.85 -31.52 59.64 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 176.066 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 29.5 m -63.09 101.98 0.33 Allowed 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 106.433 -1.691 . . . . 0.0 106.433 167.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -55.6 -26.95 46.63 Favored 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 115.62 1.711 . . . . 0.0 115.62 -166.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 86.2 m -50.9 -42.63 59.39 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.329 0.968 . . . . 0.0 110.933 -174.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -53.58 -92.7 0.0 OUTLIER 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.808 1.243 . . . . 0.0 113.814 -171.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -80.07 -11.86 59.73 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 178.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 32.2 mtm -105.61 -8.15 18.13 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -171.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -71.46 -14.77 62.24 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 120.369 1.44 . . . . 0.0 110.916 170.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 87.4 mt . . . . . 0 C--O 1.249 1.054 0 CA-C-O 117.743 -1.122 . . . . 0.0 110.481 -179.229 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 110.784 -0.08 . . . . 0.0 110.784 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 65.9 p -140.4 153.38 68.51 Favored Pre-proline 0 CA--C 1.533 0.289 0 C-N-CA 122.762 0.425 . . . . 0.0 110.111 179.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -80.17 -9.34 14.02 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 123.703 2.935 . . . . 0.0 112.495 -178.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 42.6 p -142.39 145.15 33.54 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.088 0.404 . . . . 0.0 111.285 -176.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 159' ' ' SEP . . . . . 0.401 ' HA ' ' HA ' ' B' ' 160' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 160' ' ' PRO . . . . . 0.401 ' HA ' ' HA ' ' B' ' 159' ' ' SEP . 84.1 Cg_endo -72.29 177.13 36.34 Favored 'Cis proline' 0 N--CA 1.455 -0.759 0 N-CA-C 110.103 -0.768 . . . . 0.0 110.103 -7.085 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 38.1 m -68.4 154.9 40.91 Favored 'General case' 0 N--CA 1.457 -0.109 0 CA-C-O 120.679 0.276 . . . . 0.0 110.616 176.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 162' ' ' TYR . . . . . 0.423 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 3.2 t80 -150.58 138.53 20.04 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.911 0.484 . . . . 0.0 110.671 -179.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.4 t -133.46 134.67 24.07 Favored Pre-proline 0 N--CA 1.455 -0.195 0 C-N-CA 123.26 0.624 . . . . 0.0 111.4 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -58.42 -12.58 14.07 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.531 2.821 . . . . 0.0 112.593 174.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 2.8 m -78.21 -4.0 45.51 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 -173.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -60.3 160.53 22.92 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 123.11 2.54 . . . . 0.0 110.842 168.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 34.0 t . . . . . 0 C--O 1.251 1.136 0 CA-C-O 117.57 -1.205 . . . . 0.0 110.064 -179.521 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.5 ttm . . . . . 0 N--CA 1.476 0.868 0 N-CA-C 110.601 -0.148 . . . . 0.0 110.601 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -149.5 165.07 33.25 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.665 0.386 . . . . 0.0 110.632 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -139.78 161.9 36.44 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.288 0.635 . . . . 0.0 109.981 -179.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -149.25 159.02 44.63 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.992 0.517 . . . . 0.0 109.705 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 50.95 26.23 2.59 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.173 0.989 . . . . 0.0 113.014 -175.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.43 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 18.3 t70 -79.56 -154.78 0.09 Allowed 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 176.057 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.43 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 7.1 t80 -55.92 -13.65 1.99 Allowed 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.724 -0.61 . . . . 0.0 110.772 177.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -53.06 -37.98 62.09 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 124.367 1.067 . . . . 0.0 111.127 175.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -62.91 -45.02 94.46 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 119.217 0.917 . . . . 0.0 110.164 179.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -64.04 -51.34 64.6 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 117.693 0.224 . . . . 0.0 110.613 -178.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.2 t -64.72 -50.82 73.71 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.129 0 C-N-CA 121.002 -0.279 . . . . 0.0 110.773 -177.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.31 -29.47 69.89 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 119.537 -0.268 . . . . 0.0 111.683 -179.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 57.5 m -73.84 -43.55 58.34 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 118.456 0.571 . . . . 0.0 110.389 176.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.501 ' HG ' ' CD2' ' A' ' 53' ' ' TYR . 21.3 tp -66.32 -28.47 68.71 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.163 0.506 . . . . 0.0 109.741 179.228 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -70.64 -46.71 62.78 Favored 'General case' 0 C--N 1.337 0.035 0 C-N-CA 123.773 0.829 . . . . 0.0 109.35 175.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 64.8 m -63.4 -22.77 67.08 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.059 175.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -76.72 -39.56 51.49 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.484 0.314 . . . . 0.0 110.28 175.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.1 ttpp -69.94 -23.96 63.28 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.264 0.625 . . . . 0.0 111.05 175.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -68.92 -14.45 63.04 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.685 0.394 . . . . 0.0 111.564 176.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.7 mt -79.56 161.49 25.93 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 120.934 0.397 . . . . 0.0 110.724 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 65.6 tttm -129.72 -20.23 3.23 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.094 0.558 . . . . 0.0 110.471 178.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 38.9 t -156.9 147.56 21.55 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 123.376 0.67 . . . . 0.0 109.56 177.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.13 146.63 8.47 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-O 121.77 0.65 . . . . 0.0 112.907 175.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 29.9 mt -104.03 152.24 6.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 124.921 1.289 . . . . 0.0 107.968 174.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.0 t -140.06 125.1 18.56 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 175.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -61.39 -31.22 76.56 Favored Glycine 0 CA--C 1.524 0.615 0 CA-C-O 119.26 -0.744 . . . . 0.0 112.805 -175.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 88.8 p -63.47 -35.5 80.64 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 118.795 1.298 . . . . 0.0 110.879 -174.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.0 mmt-85 -68.39 -45.5 72.51 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 177.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 41.4 mt -62.59 -35.15 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.1 mmtt -71.22 -37.85 72.02 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 118.998 -0.525 . . . . 0.0 111.25 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.58 -42.73 91.4 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.065 0.848 . . . . 0.0 110.183 175.062 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.8 mt -64.15 -59.68 4.14 Favored 'General case' 0 N--CA 1.456 -0.156 0 O-C-N 122.611 -0.056 . . . . 0.0 111.149 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 56.3 p -56.26 -46.38 79.67 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 178.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 t -63.47 -44.69 93.69 Favored 'General case' 0 CA--C 1.521 -0.142 0 C-N-CA 119.814 -0.754 . . . . 0.0 111.295 -177.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -67.34 -35.95 80.43 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 118.928 -1.109 . . . . 0.0 111.12 -178.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.92 -57.56 12.51 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.743 0.306 . . . . 0.0 110.434 174.092 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 63.9 mt -70.51 -16.59 62.91 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.927 0.891 . . . . 0.0 113.045 -174.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -61.92 -29.56 70.3 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -178.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.5 p80 -152.62 -17.01 0.16 Allowed 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 115.243 1.572 . . . . 0.0 115.243 -177.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.565 HG22 HG22 ' A' ' 93' ' ' THR . 27.5 mm 44.82 77.07 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 121.662 0.744 . . . . 0.0 112.084 178.05 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -147.32 21.13 1.21 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.406 0.682 . . . . 0.0 110.367 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.546 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -147.41 37.62 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 C-N-CA 124.407 1.083 . . . . 0.0 109.362 -171.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.47 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -51.11 -57.6 8.29 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -175.47 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 85.2 p -74.38 -25.85 59.75 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -173.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.664 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.04 -45.07 15.79 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 18.9 mt -55.58 -50.87 63.73 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 172.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.436 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 14.9 mm -67.99 -48.04 76.44 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -176.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.2 t -55.47 -42.81 74.86 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 119.96 -0.696 . . . . 0.0 109.96 179.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 73.9 mt -61.27 -62.02 2.14 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.021 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.5 pt -58.77 -35.49 56.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 119.621 1.1 . . . . 0.0 112.144 -174.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.48 HD13 HG21 ' A' ' 104' ' ' VAL . 76.2 mt -60.83 -59.18 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 178.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -63.98 -31.88 73.22 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.769 -178.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.501 ' CD2' ' HG ' ' A' ' 14' ' ' LEU . 3.7 m-85 -66.16 -34.23 77.56 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 122.092 -0.38 . . . . 0.0 110.162 178.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 29.5 t -68.89 -46.76 67.54 Favored 'General case' 0 C--O 1.231 0.087 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 173.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.6 tpp180 -56.14 -37.76 69.91 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 124.959 1.303 . . . . 0.0 112.519 -177.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 69.6 mt -78.35 -14.28 59.48 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 115.068 1.507 . . . . 0.0 115.068 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.463 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 82.4 m -115.18 160.08 35.42 Favored Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -169.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.463 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 93.9 Cg_endo -70.89 179.79 4.03 Favored 'Trans proline' 0 C--N 1.348 0.531 1 C-N-CA 125.344 4.029 . . . . 0.0 113.028 -179.234 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.549 ' HB3' ' HE3' ' A' ' 115' ' ' LYS . 5.0 p-10 -55.53 -34.51 64.74 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 114.53 1.308 . . . . 0.0 114.53 -171.152 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.2 t -63.77 -35.3 80.13 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.902 0.774 . . . . 0.0 109.452 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 62.8 t-80 -83.99 -31.1 25.68 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.078 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -58.71 -44.97 90.52 Favored 'General case' 0 C--N 1.341 0.219 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 53.5 tp -66.92 -52.05 47.83 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 122.757 0.423 . . . . 0.0 111.187 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.83 -39.63 97.75 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 -179.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.0 t -70.51 -33.52 71.29 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 117.322 0.561 . . . . 0.0 110.061 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.4 mt -64.82 -33.65 76.5 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.511 173.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -66.42 -39.15 88.78 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 119.331 0.969 . . . . 0.0 109.697 174.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 83.9 mt -64.12 -50.29 77.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 O-C-N 122.146 -0.346 . . . . 0.0 111.116 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 60.1 mt -62.1 -34.95 66.07 Favored 'Isoleucine or valine' 0 C--O 1.231 0.115 0 C-N-CA 123.712 0.805 . . . . 0.0 109.681 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -67.76 -42.76 81.27 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.985 -0.531 . . . . 0.0 110.442 177.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.42 ' HA ' ' NH1' ' A' ' 74' ' ' ARG . 8.0 t -66.93 -50.65 61.7 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 119.25 -0.98 . . . . 0.0 111.338 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 47.0 mt -64.89 -35.74 76.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.201 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.0 -54.31 25.31 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.966 -0.454 . . . . 0.0 111.966 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.42 ' NH1' ' HA ' ' A' ' 71' ' ' SER . 4.0 mtp-105 -61.74 -37.53 84.57 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-N 117.294 0.547 . . . . 0.0 110.817 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.02 -44.44 72.73 Favored 'General case' 0 N--CA 1.451 -0.375 0 O-C-N 122.46 -0.15 . . . . 0.0 111.004 179.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.2 m-30 -61.8 -45.57 93.27 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 176.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.6 tt -58.83 -52.95 63.53 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -177.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -58.21 -44.97 88.4 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 121.154 -0.218 . . . . 0.0 110.556 179.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -63.61 -43.02 98.08 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -174.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.453 HG23 HH11 ' A' ' 81' ' ' ARG . 14.6 t -82.16 -26.36 33.52 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -176.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.453 HH11 HG23 ' A' ' 80' ' ' THR . 9.5 mpt_? -73.32 -32.94 64.89 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 118.694 0.679 . . . . 0.0 110.206 175.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 75.3 m -71.72 -13.96 61.88 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-N 117.587 0.176 . . . . 0.0 111.219 174.039 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -105.48 24.48 12.1 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.84 0.856 . . . . 0.0 110.876 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 33.1 t -140.93 160.83 39.23 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.104 0.562 . . . . 0.0 110.716 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -138.05 7.43 2.68 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.602 0.761 . . . . 0.0 110.491 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 86.8 p -127.23 10.26 6.82 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.5 0.72 . . . . 0.0 111.073 -179.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 54.1 p 54.92 11.65 0.51 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.667 1.587 . . . . 0.0 113.817 -176.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.1 t -84.13 160.22 20.93 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.099 0.56 . . . . 0.0 110.841 -179.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 22.4 t30 -98.7 145.4 26.93 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.2 0.6 . . . . 0.0 109.756 -178.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -82.95 150.89 62.77 Favored Pre-proline 0 CA--C 1.532 0.283 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 -177.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -77.53 3.97 6.37 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 124.337 3.358 . . . . 0.0 113.651 -176.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -154.25 -176.18 26.29 Favored Glycine 0 C--N 1.337 0.629 0 CA-C-N 118.568 0.622 . . . . 0.0 112.123 -177.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.565 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER 52.84 -152.74 0.26 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.198 0.999 . . . . 0.0 112.861 177.017 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.0 p -51.13 -27.26 8.07 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -177.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.3 -39.07 82.17 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.253 -0.904 . . . . 0.0 110.126 176.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 -68.55 -34.48 75.91 Favored 'General case' 0 CA--C 1.519 -0.227 0 C-N-CA 122.981 0.512 . . . . 0.0 109.801 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.436 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -63.74 -43.75 95.57 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.349 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.5 -42.89 94.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 175.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -59.98 -33.98 72.68 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 121.393 -0.123 . . . . 0.0 111.022 179.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.7 m -76.0 -41.47 51.03 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-O 119.535 -0.269 . . . . 0.0 111.346 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 62.6 mt -61.7 -29.74 70.29 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 119.782 -0.767 . . . . 0.0 108.985 173.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.88 -14.87 39.67 Favored Glycine 0 CA--C 1.529 0.948 0 CA-C-O 119.171 -0.794 . . . . 0.0 113.672 179.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.67 -6.16 25.54 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.591 1.196 . . . . 0.0 111.562 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.48 HG21 HD13 ' A' ' 51' ' ' ILE . 32.2 m -124.02 -18.12 4.05 Favored 'Isoleucine or valine' 0 C--N 1.338 0.094 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.14 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.449 HD12 ' HA ' ' A' ' 105' ' ' ILE . 11.1 tp -53.15 -31.1 17.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 CA-C-N 118.751 0.705 . . . . 0.0 111.28 -177.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -60.83 -55.08 37.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.884 0.474 . . . . 0.0 110.829 178.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -75.94 -31.56 59.15 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.684 0.394 . . . . 0.0 111.773 -177.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 58.6 mt -64.81 -50.53 66.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.428 ' HB3' ' CG2' ' A' ' 145' ' ' ILE . 97.4 mt -70.29 -50.41 39.67 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.643 -178.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.55 ' HB2' ' CZ ' ' A' ' 150' ' ' PHE . 88.9 p -52.21 -50.19 62.44 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 118.545 0.611 . . . . 0.0 111.852 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -68.29 -46.38 70.48 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 118.662 0.664 . . . . 0.0 111.167 -178.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -54.11 -54.12 43.9 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.844 0.458 . . . . 0.0 110.499 -179.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 10.8 mt -65.47 -46.0 91.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 CA-C-N 118.005 0.366 . . . . 0.0 110.801 -178.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.01 -21.47 66.4 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 119.74 -0.171 . . . . 0.0 111.292 -176.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.549 ' HE3' ' HB3' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -94.88 -13.68 25.25 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 117.69 0.223 . . . . 0.0 111.432 179.831 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.441 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 50.1 p -90.11 165.9 13.72 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -172.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -83.55 174.08 10.88 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.137 0.975 . . . . 0.0 109.894 179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.7 tt0 -55.55 -44.39 76.73 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.906 0.482 . . . . 0.0 111.851 -178.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -68.44 -37.46 80.26 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 121.964 -0.46 . . . . 0.0 110.606 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.441 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 56.4 m80 -71.51 -52.54 17.78 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 119.001 -0.523 . . . . 0.0 110.969 -177.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -36.99 65.74 Favored 'General case' 0 C--N 1.342 0.258 0 CA-C-N 119.238 0.927 . . . . 0.0 110.922 173.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.69 -43.57 98.47 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.566 178.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -64.7 -36.16 83.39 Favored 'General case' 0 C--O 1.227 -0.109 0 CA-C-O 119.549 -0.262 . . . . 0.0 111.685 177.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.4 mt -68.58 -40.5 81.96 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 178.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 15.4 ttp180 -60.55 -47.04 87.95 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.701 0.401 . . . . 0.0 110.766 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.72 -30.69 64.39 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.278 -178.139 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.415 ' C ' HD23 ' A' ' 127' ' ' LEU . 7.6 tt -60.98 -47.67 85.36 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.621 0.646 . . . . 0.0 109.481 175.388 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 87.9 mt -70.09 -32.08 69.97 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.772 -0.194 . . . . 0.0 111.062 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -66.07 -38.58 88.65 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 110.391 -0.225 . . . . 0.0 110.391 177.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 87.3 mt -69.72 -41.9 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 177.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 15.5 t90 -64.12 -30.33 71.4 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 122.586 -0.071 . . . . 0.0 111.067 179.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -83.08 -37.76 23.4 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 122.032 -0.418 . . . . 0.0 111.536 176.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 29.9 tpt180 -73.35 -24.07 60.3 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 122.815 0.446 . . . . 0.0 111.956 -176.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 99.8 p -65.11 -14.48 60.63 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 71.26 18.09 76.44 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 111.591 -0.603 . . . . 0.0 111.591 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 31.1 tp -71.71 -17.46 62.22 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 117.533 0.667 . . . . 0.0 111.786 -177.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -80.64 164.16 23.07 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.615 0.366 . . . . 0.0 110.442 176.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -133.38 -12.9 2.71 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 15.3 ptmm? -160.56 163.89 32.41 Favored 'General case' 0 N--CA 1.457 -0.086 0 C-N-CA 123.001 0.52 . . . . 0.0 110.683 178.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 18.8 m 55.03 -173.88 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.228 1.011 . . . . 0.0 113.243 177.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -138.58 161.21 37.65 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.614 0.765 . . . . 0.0 110.111 179.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 53.2 tp -87.26 91.76 8.83 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.692 0.397 . . . . 0.0 109.938 -177.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -71.18 -15.44 62.48 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -179.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -49.81 -42.58 47.36 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.329 1.052 . . . . 0.0 112.159 -172.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.538 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -110.36 -25.21 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.07 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 176.33 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -66.04 -20.41 66.17 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 122.944 0.497 . . . . 0.0 110.78 -176.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 80.6 p -61.39 -40.67 95.19 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 118.47 -0.776 . . . . 0.0 113.06 -178.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -160.32 -161.89 0.92 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 115.568 1.692 . . . . 0.0 115.568 -178.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . 0.419 ' O ' ' C ' ' A' ' 150' ' ' PHE . 31.7 t -48.35 -24.82 1.34 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.298 1.839 . . . . 0.0 113.792 -171.32 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . 0.55 ' CZ ' ' HB2' ' A' ' 110' ' ' SER . 20.9 m-85 -24.22 -85.26 0.0 OUTLIER 'General case' 0 C--N 1.344 0.35 0 C-N-CA 125.058 1.343 . . . . 0.0 110.188 177.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -101.88 -6.04 24.02 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 118.372 -0.823 . . . . 0.0 111.655 167.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 35.4 mmt -70.69 -4.02 21.46 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-N 120.335 1.425 . . . . 0.0 111.643 175.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -54.64 -20.5 8.25 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.034 0.933 . . . . 0.0 112.342 174.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 42.9 tp . . . . . 0 C--O 1.248 1.01 0 CA-C-O 117.401 -1.285 . . . . 0.0 110.811 -179.473 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 110.578 -0.156 . . . . 0.0 110.578 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 37.7 p -146.18 153.37 48.71 Favored Pre-proline 0 CA--C 1.53 0.188 0 C-N-CA 122.917 0.487 . . . . 0.0 110.243 178.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -75.9 -10.93 19.9 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.593 2.862 . . . . 0.0 112.123 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 3.7 m 54.19 26.46 6.72 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.5 0.72 . . . . 0.0 111.708 -176.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 160' ' ' PRO . . . . . 0.467 ' HG2' ' H ' ' B' ' 161' ' ' SER . 61.1 Cg_endo -68.37 -66.57 0.03 OUTLIER 'Cis proline' 0 N--CA 1.457 -0.62 0 CA-C-N 119.493 0.855 . . . . 0.0 111.23 -5.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . 0.467 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 68.2 p -169.0 156.18 7.14 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 124.115 0.966 . . . . 0.0 109.377 176.037 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -158.33 139.43 13.19 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.63 0.252 . . . . 0.0 111.618 173.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 27.0 t -140.44 142.66 30.09 Favored Pre-proline 0 N--CA 1.454 -0.26 0 C-N-CA 123.749 0.82 . . . . 0.0 110.78 178.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.85 -7.71 2.55 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 123.776 2.984 . . . . 0.0 112.975 173.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 38.0 m -64.46 -34.03 77.25 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 122.967 0.507 . . . . 0.0 110.977 -179.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -73.45 176.42 9.3 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.818 3.012 . . . . 0.0 111.286 175.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 55.3 m . . . . . 0 C--O 1.251 1.148 0 CA-C-O 117.616 -1.183 . . . . 0.0 111.087 177.546 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.4 mmm . . . . . 0 N--CA 1.476 0.841 0 CA-C-O 119.746 -0.169 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -146.42 150.59 35.93 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.875 0.47 . . . . 0.0 109.936 -179.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -134.9 0.78 2.95 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.861 0.464 . . . . 0.0 111.497 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -71.75 -3.69 23.43 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.143 0.577 . . . . 0.0 111.521 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -125.64 10.84 7.85 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.093 0.957 . . . . 0.0 111.347 178.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -88.57 -134.62 0.09 Allowed 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 177.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -55.64 -16.55 4.25 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 118.438 0.563 . . . . 0.0 111.077 175.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.7 tp60 -55.32 -40.1 70.77 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 123.106 0.563 . . . . 0.0 110.81 176.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -60.96 -40.59 93.93 Favored 'General case' 0 N--CA 1.458 -0.072 0 CA-C-N 118.516 0.598 . . . . 0.0 110.781 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -64.57 -55.73 18.56 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 57.6 t -59.09 -53.97 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.123 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -178.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.03 -33.07 70.33 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.165 0.586 . . . . 0.0 111.95 -177.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 56.3 m -70.26 -44.95 67.41 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 118.784 0.72 . . . . 0.0 110.047 177.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.6 tp -65.72 -34.51 78.35 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.385 0.612 . . . . 0.0 109.983 -179.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -67.57 -42.89 81.83 Favored 'General case' 0 CA--C 1.52 -0.2 0 C-N-CA 123.866 0.866 . . . . 0.0 109.763 178.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.0 m -63.94 -30.19 71.3 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 175.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.29 -36.27 76.88 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 176.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.9 tttm -74.4 -33.08 62.93 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 177.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -82.86 -30.0 28.96 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -175.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 98.7 mt -141.97 147.22 36.61 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 123.197 0.599 . . . . 0.0 110.328 -178.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.01 155.02 36.12 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.866 0.466 . . . . 0.0 111.44 179.357 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 77.6 p -150.61 -15.04 0.23 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.434 0.694 . . . . 0.0 110.557 176.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 177.21 -147.27 8.2 Favored Glycine 0 C--N 1.337 0.593 0 N-CA-C 108.058 -2.017 . . . . 0.0 108.058 178.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.1 mm -115.34 44.7 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 178.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.3 m -50.53 127.94 18.98 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.836 0.454 . . . . 0.0 111.735 -175.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.22 -14.59 64.21 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-O 119.043 -0.865 . . . . 0.0 113.548 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 66.3 p -64.42 -42.25 96.14 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 119.272 1.536 . . . . 0.0 111.082 -177.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -64.3 -40.63 96.33 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 177.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 55.5 mt -64.03 -37.37 79.65 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -60.39 -47.44 86.07 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 122.722 0.409 . . . . 0.0 110.231 178.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.01 -46.53 88.79 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 118.025 0.375 . . . . 0.0 111.02 177.271 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 99.4 mt -61.6 -59.4 5.26 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 122.196 -0.315 . . . . 0.0 110.806 -177.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 67.3 p -56.36 -46.41 80.03 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.3 t -64.14 -44.28 92.65 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.182 -176.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -75.25 -18.56 60.07 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 120.205 -0.598 . . . . 0.0 112.349 -179.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.37 -59.25 3.56 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.699 0.681 . . . . 0.0 109.288 167.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.5 mp -70.92 -13.42 62.01 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -176.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -55.41 -26.64 42.92 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -153.08 -24.04 0.15 Allowed 'General case' 0 C--N 1.339 0.143 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -178.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.529 HG22 HG22 ' A' ' 93' ' ' THR . 35.8 mm 45.44 72.45 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-O 121.837 0.827 . . . . 0.0 111.446 -177.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -146.6 21.69 1.31 Allowed 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.48 1.112 . . . . 0.0 109.229 179.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.573 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.57 33.24 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.231 0 C-N-CA 124.574 1.15 . . . . 0.0 109.209 -170.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.513 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.2 OUTLIER -49.12 -55.67 11.54 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -177.062 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 80.4 p -74.66 -27.15 60.3 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -173.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.653 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -82.48 -43.17 17.54 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 -179.306 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 39.2 mt -55.75 -51.77 55.7 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.414 HD13 ' HA ' ' A' ' 47' ' ' ILE . 14.9 mm -67.43 -49.3 72.68 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -176.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 72.2 m -57.53 -35.33 70.16 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 119.277 -0.969 . . . . 0.0 110.404 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.5 tp -70.0 -43.87 70.52 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 118.909 -0.567 . . . . 0.0 112.261 -178.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 36.8 pt -73.37 -33.21 39.89 Favored 'Isoleucine or valine' 0 C--N 1.34 0.187 0 CA-C-N 119.304 0.956 . . . . 0.0 111.809 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.485 HD13 HG21 ' A' ' 104' ' ' VAL . 97.3 mt -65.66 -52.59 48.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -63.06 -29.09 70.54 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.356 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 33.3 t80 -62.75 -47.71 82.34 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 174.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.9 t -62.23 -33.07 73.89 Favored 'General case' 0 C--N 1.338 0.087 0 CA-C-O 120.581 0.229 . . . . 0.0 110.567 176.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -69.23 -40.91 77.64 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.866 0.866 . . . . 0.0 112.597 -177.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.2 mt -91.92 -14.81 28.98 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -174.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.406 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 78.7 m -100.72 159.45 29.56 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -170.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 57' ' ' CYS . 50.7 Cg_exo -57.94 -178.66 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.367 1 C-N-CA 126.153 4.569 . . . . 0.0 115.406 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -62.84 -46.3 88.55 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.459 1.104 . . . . 0.0 112.766 -177.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 50.6 m -62.54 -30.53 71.37 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 20.6 m80 -79.17 -20.58 48.1 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 119.026 -0.512 . . . . 0.0 110.756 176.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.7 tppt? -67.63 -45.86 74.13 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 173.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.4 tp -63.91 -44.48 92.83 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.404 176.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.63 -40.96 95.38 Favored Glycine 0 C--N 1.339 0.712 0 N-CA-C 110.353 -1.099 . . . . 0.0 110.353 177.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 71.0 m -60.74 -44.15 97.05 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.93 -0.557 . . . . 0.0 109.792 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 20.8 mt -57.87 -42.29 84.22 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.586 0.63 . . . . 0.0 111.477 178.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -68.6 -34.99 76.73 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.026 0.83 . . . . 0.0 111.328 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 71.3 mt -69.98 -50.96 44.1 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 O-C-N 122.026 -0.421 . . . . 0.0 110.385 178.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 74.9 mt -60.11 -35.16 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.105 0 C-N-CA 124.211 1.004 . . . . 0.0 109.546 178.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -68.2 -45.99 71.85 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.848 -0.596 . . . . 0.0 110.871 178.18 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.5 t -64.57 -53.39 48.52 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 118.569 0.622 . . . . 0.0 110.955 -178.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 47.3 mt -63.68 -34.32 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.32 -52.79 37.18 Favored Glycine 0 CA--C 1.524 0.64 0 CA-C-O 119.927 -0.374 . . . . 0.0 112.43 -178.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.651 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -70.27 -33.79 72.01 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 117.961 0.88 . . . . 0.0 111.001 -178.857 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.42 -48.17 70.89 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 177.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 -60.02 -45.68 91.99 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 176.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -57.05 -46.19 82.64 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 119.363 -0.351 . . . . 0.0 110.601 -176.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -68.84 -41.7 78.15 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 119.732 -0.787 . . . . 0.0 111.005 178.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -65.77 -23.71 66.78 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -176.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.9 t -99.94 -21.71 15.56 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 118.583 0.629 . . . . 0.0 111.231 175.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -71.8 -29.07 64.05 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 117.908 0.322 . . . . 0.0 110.64 175.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 89.7 p -70.19 -14.36 62.59 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 177.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 47.2 t-20 -82.73 154.95 24.55 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.739 0.415 . . . . 0.0 110.25 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 51.0 m -134.36 15.51 3.76 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.545 0.738 . . . . 0.0 111.099 -178.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -130.73 164.98 23.88 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.06 0.544 . . . . 0.0 110.455 -178.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 54.2 m -139.11 164.49 29.64 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 123.391 0.676 . . . . 0.0 110.339 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.7 m -139.45 160.93 38.69 Favored 'General case' 0 C--O 1.232 0.144 0 C-N-CA 123.217 0.607 . . . . 0.0 110.695 -178.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 80.6 p -138.53 9.25 2.66 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.238 0.615 . . . . 0.0 111.645 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -134.22 28.92 3.72 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.508 0.723 . . . . 0.0 110.174 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -138.81 141.41 30.45 Favored Pre-proline 0 CA--C 1.531 0.226 0 C-N-CA 123.687 0.795 . . . . 0.0 109.616 -178.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -57.48 162.76 9.62 Favored 'Trans proline' 0 N--CA 1.452 -0.921 0 C-N-CA 123.662 2.908 . . . . 0.0 112.23 173.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -69.53 169.95 43.48 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 111.362 -0.695 . . . . 0.0 111.362 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.529 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -151.99 -152.27 0.42 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.455 1.102 . . . . 0.0 109.334 179.902 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.3 p -49.91 -30.09 9.5 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.194 0.906 . . . . 0.0 113.28 -177.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.56 -45.62 82.61 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.397 -0.814 . . . . 0.0 110.193 175.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -65.45 -31.61 72.78 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 123.579 0.752 . . . . 0.0 110.179 177.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.25 -45.29 81.07 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.617 0.767 . . . . 0.0 110.572 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.4 mt -64.31 -41.74 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 174.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -61.55 -33.48 73.92 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 120.476 0.179 . . . . 0.0 110.873 179.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.3 m -74.14 -41.75 61.07 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 122.085 -0.384 . . . . 0.0 110.928 179.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 61.2 mt -61.42 -30.89 70.85 Favored 'General case' 0 C--O 1.228 -0.074 0 CA-C-N 118.859 0.754 . . . . 0.0 109.014 173.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.93 -14.39 23.52 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-O 119.018 -0.879 . . . . 0.0 113.424 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -100.43 -3.94 29.94 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 118.961 1.38 . . . . 0.0 111.785 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.485 HG21 HD13 ' A' ' 51' ' ' ILE . 33.1 m -127.14 -19.98 2.24 Favored 'Isoleucine or valine' 0 C--N 1.339 0.15 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.1 tp -54.78 -28.39 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 C-N-CA 123.157 0.583 . . . . 0.0 111.891 -175.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -58.85 -58.23 9.56 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 120.739 0.304 . . . . 0.0 111.095 -179.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -78.05 -26.03 48.08 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 122.401 0.281 . . . . 0.0 111.219 -178.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.0 tt -66.45 -50.3 63.83 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.425 ' HB3' ' CG2' ' A' ' 145' ' ' ILE . 75.7 mt -69.7 -52.63 23.87 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.995 -0.526 . . . . 0.0 109.901 176.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.4 t -40.28 -49.39 2.73 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.073 0.397 . . . . 0.0 112.056 175.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -72.06 -48.48 43.97 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-N 118.222 0.465 . . . . 0.0 111.596 -178.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.04 -29.98 61.24 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 123.314 0.646 . . . . 0.0 112.277 179.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.517 HD11 HG22 ' A' ' 145' ' ' ILE . 2.5 mt -85.59 -41.18 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 118.855 0.752 . . . . 0.0 111.272 173.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.13 -25.93 67.21 Favored 'General case' 0 N--CA 1.454 -0.235 0 O-C-N 121.903 -0.498 . . . . 0.0 111.075 -177.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.21 -19.4 43.34 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.119 0.968 . . . . 0.0 110.93 177.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.48 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 24.4 p -83.44 163.13 20.72 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -172.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -94.62 175.45 6.66 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.676 1.191 . . . . 0.0 108.444 173.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -55.86 -38.96 70.8 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.831 0.741 . . . . 0.0 112.603 -176.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -73.29 -37.47 66.21 Favored 'General case' 0 C--O 1.232 0.132 0 O-C-N 121.526 -0.734 . . . . 0.0 110.514 -179.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.48 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 43.3 m170 -72.24 -44.12 63.34 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.856 -0.592 . . . . 0.0 110.857 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.401 ' C ' ' HD2' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -58.25 -38.66 77.33 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 119.573 1.079 . . . . 0.0 109.535 175.199 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -61.21 -44.11 97.81 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.129 177.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -64.17 -35.78 81.91 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 177.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 94.2 mt -74.59 -37.7 44.17 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.067 0 CA-C-N 118.359 0.527 . . . . 0.0 110.108 -178.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -63.68 -39.73 95.05 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 176.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 58.4 ttp -66.34 -42.43 88.14 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.369 0.268 . . . . 0.0 110.289 175.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.2 tt -59.93 -44.7 94.19 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 -178.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -69.36 -37.31 77.54 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 119.151 -0.452 . . . . 0.0 111.319 178.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -60.25 -41.6 93.54 Favored 'General case' 0 N--CA 1.457 -0.102 0 CA-C-N 118.431 0.559 . . . . 0.0 110.119 177.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.7 mt -71.4 -42.54 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 122.43 0.292 . . . . 0.0 110.585 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 10.8 t90 -67.29 -25.71 66.18 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 122.174 -0.329 . . . . 0.0 111.15 -177.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -86.0 -36.75 19.58 Favored 'General case' 0 N--CA 1.455 -0.178 0 O-C-N 121.841 -0.537 . . . . 0.0 110.959 175.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 56.8 ttm-85 -67.27 -43.12 82.61 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.967 0.507 . . . . 0.0 111.284 -179.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 61.0 m -78.97 -16.38 57.01 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 122.609 0.364 . . . . 0.0 111.563 179.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -82.98 -18.57 64.87 Favored Glycine 0 CA--C 1.528 0.847 0 CA-C-O 119.45 -0.639 . . . . 0.0 111.816 179.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 37.9 tp 60.46 140.08 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.717 1.607 . . . . 0.0 112.755 -175.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 53.4 -174.95 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.984 0.913 . . . . 0.0 112.14 -175.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -77.22 157.68 30.73 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.074 -0.391 . . . . 0.0 109.992 177.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -115.31 10.29 15.87 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.832 0.453 . . . . 0.0 111.935 -178.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 8.4 t 58.92 12.84 2.5 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 16.5 p90 -138.35 10.15 2.74 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.218 0.463 . . . . 0.0 111.712 174.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 38.7 tp -64.45 -16.62 62.75 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.716 0.407 . . . . 0.0 111.65 -177.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -55.94 -23.85 34.54 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.952 -0.468 . . . . 0.0 111.38 177.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -53.9 -29.29 41.29 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.215 1.406 . . . . 0.0 112.485 -173.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.517 HG22 HD11 ' A' ' 113' ' ' ILE . 0.1 OUTLIER -128.08 -14.45 2.98 Favored 'Isoleucine or valine' 0 C--N 1.339 0.111 0 N-CA-C 112.303 0.482 . . . . 0.0 112.303 169.408 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 31.3 tpt180 -67.96 -21.91 65.06 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 118.004 0.365 . . . . 0.0 110.623 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . 0.507 ' HB3' ' CE2' ' A' ' 150' ' ' PHE . 21.9 t -61.93 158.5 16.06 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 172.172 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -55.18 -76.22 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -169.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 8.4 p -46.69 -62.77 1.23 Allowed 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 -169.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . 0.507 ' CE2' ' HB3' ' A' ' 147' ' ' SER . 12.9 m-30 -22.67 -94.56 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 126.671 1.988 . . . . 0.0 113.557 -173.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -101.87 -5.1 25.18 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 172.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 19.6 mmt -99.72 -2.04 36.29 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 119.653 1.115 . . . . 0.0 112.928 -174.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -56.09 -28.18 56.65 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 119.311 0.96 . . . . 0.0 111.085 174.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 65.6 tp . . . . . 0 C--O 1.254 1.306 0 CA-C-O 117.205 -1.378 . . . . 0.0 108.637 177.411 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 . . . . . 0 N--CA 1.473 0.705 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 38.0 t -150.38 142.72 15.84 Favored Pre-proline 0 CA--C 1.529 0.157 0 C-N-CA 122.864 0.466 . . . . 0.0 109.874 -178.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -72.72 156.25 53.39 Favored 'Trans proline' 0 N--CA 1.452 -0.962 0 C-N-CA 123.716 2.944 . . . . 0.0 111.058 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 46.3 p -145.28 149.6 35.15 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 123.438 0.695 . . . . 0.0 110.197 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -74.22 177.75 36.77 Favored 'Cis proline' 0 N--CA 1.454 -0.852 0 N-CA-C 110.359 -0.67 . . . . 0.0 110.359 -6.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 73.5 p -71.31 160.38 32.91 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 122.447 0.299 . . . . 0.0 111.229 178.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 162' ' ' TYR . . . . . 0.43 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 16.0 t80 -146.06 138.78 25.6 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.451 0.3 . . . . 0.0 111.477 -179.112 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.9 t -130.72 139.44 35.62 Favored Pre-proline 0 CA--C 1.53 0.197 0 C-N-CA 123.411 0.684 . . . . 0.0 110.619 176.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -58.77 -11.25 11.35 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.293 2.662 . . . . 0.0 112.318 173.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.48 14.9 6.04 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.706 0.802 . . . . 0.0 111.872 -175.206 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -59.54 163.66 12.56 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.693 2.262 . . . . 0.0 110.882 170.005 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 41.8 m . . . . . 0 C--O 1.252 1.229 0 CA-C-O 117.006 -1.473 . . . . 0.0 111.818 -178.883 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.2 mtm . . . . . 0 N--CA 1.478 0.952 0 N-CA-C 110.454 -0.202 . . . . 0.0 110.454 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 52.7 mm-40 -138.51 171.73 13.94 Favored 'General case' 0 N--CA 1.458 -0.073 0 C-N-CA 123.564 0.746 . . . . 0.0 110.269 -179.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -132.3 147.65 52.41 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.394 0.677 . . . . 0.0 109.488 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -135.06 8.01 3.45 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.616 0.367 . . . . 0.0 111.378 -177.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -118.35 22.16 12.28 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 122.942 0.497 . . . . 0.0 111.387 -179.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.408 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 22.5 t70 -85.9 -138.53 0.08 Allowed 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 178.004 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.408 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 18.1 t80 -55.11 -14.65 1.7 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.227 1.011 . . . . 0.0 111.254 176.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.6 tp60 -54.59 -40.53 68.93 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.315 0.646 . . . . 0.0 111.15 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -58.1 -46.62 85.22 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 118.924 0.784 . . . . 0.0 110.811 177.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -63.96 -50.48 68.44 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 117.964 0.347 . . . . 0.0 110.803 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 62.1 t -62.69 -54.46 33.63 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 -178.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.12 -29.79 67.64 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.288 0.635 . . . . 0.0 111.819 -177.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 72.6 m -75.12 -41.36 58.68 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.255 0.479 . . . . 0.0 110.534 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.4 tp -65.85 -33.52 76.03 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -67.42 -42.91 82.43 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.915 0.886 . . . . 0.0 109.819 175.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.7 t -60.69 -31.16 70.42 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 174.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.456 ' CE2' HD11 ' A' ' 68' ' ' ILE . 0.1 OUTLIER -70.88 -38.04 73.05 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 176.479 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -73.26 -24.3 60.44 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.501 0.32 . . . . 0.0 111.565 177.147 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -68.22 -23.58 64.83 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 122.971 0.508 . . . . 0.0 112.254 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.6 pp -97.18 166.35 11.61 Favored 'General case' 0 C--N 1.339 0.131 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 177.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.7 mtmm -128.08 -1.51 5.82 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -176.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.4 p -154.36 151.71 29.37 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 118.135 0.425 . . . . 0.0 110.641 178.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.32 139.34 1.13 Allowed Glycine 0 CA--C 1.524 0.648 0 C-N-CA 123.644 0.64 . . . . 0.0 112.272 178.035 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 20.8 mm -94.2 139.62 18.11 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 173.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.1 t -124.66 127.56 47.5 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 117.902 0.319 . . . . 0.0 110.203 -176.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.73 -32.44 78.09 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-O 119.497 -0.613 . . . . 0.0 112.468 -175.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 80.0 p -62.23 -39.28 92.29 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.404 1.102 . . . . 0.0 110.703 -175.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.4 mpt_? -68.71 -44.66 73.44 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.147 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 77.0 mt -59.91 -41.7 86.82 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.098 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -67.59 -36.97 81.89 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 118.9 -0.571 . . . . 0.0 111.569 -179.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.62 -41.41 88.39 Favored 'General case' 0 C--N 1.338 0.097 0 CA-C-N 119.534 1.061 . . . . 0.0 110.495 175.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.3 mt -62.14 -52.07 65.31 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 122.395 -0.191 . . . . 0.0 110.568 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 44.0 p -60.87 -42.01 97.08 Favored 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 122.087 -0.383 . . . . 0.0 110.753 179.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.9 m -55.41 -57.52 11.51 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 122.965 0.506 . . . . 0.0 111.101 179.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 63.9 m-85 -76.16 -18.65 59.01 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -173.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.43 -57.76 4.86 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 118.859 0.754 . . . . 0.0 109.141 168.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.5 mt -70.44 -15.2 62.8 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.851 0.86 . . . . 0.0 112.949 -175.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -55.6 -31.41 62.22 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -178.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.2 t-80 -152.74 -20.81 0.16 Allowed 'General case' 0 C--N 1.34 0.171 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.481 HG22 HG22 ' A' ' 93' ' ' THR . 35.9 mm 46.8 73.78 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-O 121.82 0.819 . . . . 0.0 111.514 -178.067 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -143.97 22.65 1.74 Allowed 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.053 1.341 . . . . 0.0 108.656 178.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.557 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.8 pt -147.17 33.42 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 C-N-CA 124.679 1.192 . . . . 0.0 109.778 -170.117 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.455 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -50.45 -54.41 22.27 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 -176.313 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 32.6 t -74.23 -32.6 63.06 Favored 'General case' 0 C--O 1.225 -0.193 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -174.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.707 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -76.77 -45.6 28.34 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -178.617 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 9.6 mm -56.44 -51.73 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 173.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 15.4 mm -66.84 -50.83 61.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -176.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.8 m -59.06 -33.54 70.91 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 119.635 -0.826 . . . . 0.0 110.762 179.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.1 tp -70.02 -43.29 71.63 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 33.1 pt -73.58 -35.13 43.91 Favored 'Isoleucine or valine' 0 C--N 1.341 0.226 0 CA-C-N 119.427 1.012 . . . . 0.0 111.481 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.46 HD13 HG21 ' A' ' 104' ' ' VAL . 97.6 mt -64.2 -52.53 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.213 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.424 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 38.8 t70 -63.44 -31.65 72.87 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.068 179.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -60.18 -46.13 90.77 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 175.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -64.64 -37.07 86.33 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-O 120.796 0.331 . . . . 0.0 110.578 177.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.424 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 52.3 tpt85 -67.15 -34.75 78.24 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 124.207 1.003 . . . . 0.0 112.834 -176.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 71.7 mt -92.25 -14.67 28.56 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -176.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 66.6 m -110.65 150.84 42.31 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -170.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -74.76 -170.67 0.8 Allowed 'Trans proline' 0 CA--C 1.536 0.617 1 C-N-CA 125.65 4.234 . . . . 0.0 114.303 -177.273 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -34.72 -64.38 0.26 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 128.122 2.569 . . . . 0.0 115.027 -175.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 37.5 m -58.09 -28.18 64.36 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 122.505 0.322 . . . . 0.0 110.896 -174.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -90.32 -16.73 28.66 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 118.522 -0.751 . . . . 0.0 111.923 -179.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -70.95 -42.32 69.95 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 169.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 59.9 tp -66.93 -47.49 71.53 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 176.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.64 -46.04 93.86 Favored Glycine 0 C--N 1.338 0.662 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 178.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 92.2 p -63.07 -41.45 99.44 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 117.574 0.687 . . . . 0.0 110.163 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 31.4 mt -61.68 -40.25 94.3 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 119.06 0.845 . . . . 0.0 111.487 177.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -67.84 -34.47 76.77 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 119.721 1.146 . . . . 0.0 111.147 177.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.456 HD11 ' CE2' ' A' ' 17' ' ' PHE . 69.3 mt -68.3 -49.05 70.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 O-C-N 121.72 -0.613 . . . . 0.0 110.497 177.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.25 -34.6 64.79 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.077 0 C-N-CA 124.13 0.972 . . . . 0.0 109.39 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -67.95 -44.17 77.41 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.162 0.585 . . . . 0.0 110.505 177.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 14.3 m -67.64 -49.88 60.71 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 119.725 -0.79 . . . . 0.0 111.038 -177.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 67.5 mt -67.11 -38.13 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 179.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.15 -46.7 78.2 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 -178.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.408 HH22 ' C ' ' B' ' 166' ' ' SEP . 9.4 mtp-105 -69.22 -36.72 77.52 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 117.257 0.528 . . . . 0.0 110.773 178.384 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.16 -40.08 86.59 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 177.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.4 m-30 -64.99 -48.2 74.82 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 175.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.3 tp -56.9 -43.42 81.35 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 123.367 0.417 . . . . 0.0 109.968 -177.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -67.3 -42.43 83.75 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 122.523 -0.111 . . . . 0.0 110.874 178.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -62.8 -40.9 98.8 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 111.444 0.164 . . . . 0.0 111.444 -176.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.5 t -84.02 -26.99 28.68 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 13.7 tpp180 -75.07 -24.13 58.13 Favored 'General case' 0 C--N 1.34 0.193 0 CA-C-N 118.26 0.482 . . . . 0.0 110.807 175.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.4 t -68.21 -15.05 63.42 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 122.646 0.378 . . . . 0.0 111.055 176.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -101.82 158.84 15.83 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.48 0.712 . . . . 0.0 110.146 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 22.8 t -76.86 159.5 30.0 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.921 0.488 . . . . 0.0 110.78 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -76.77 157.72 31.42 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.039 0.447 . . . . 0.0 110.578 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 82.9 p -151.35 163.74 38.24 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.956 0.502 . . . . 0.0 110.419 179.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 79.6 p -144.13 5.25 1.29 Allowed 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.006 0.522 . . . . 0.0 111.75 179.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 80.1 p -91.8 -1.96 57.12 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 122.92 0.488 . . . . 0.0 111.974 -178.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -148.13 160.2 43.15 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.878 0.471 . . . . 0.0 110.159 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 25.8 pttm -95.51 154.67 39.23 Favored Pre-proline 0 C--O 1.233 0.228 0 C-N-CA 123.631 0.772 . . . . 0.0 110.678 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.47 157.67 60.1 Favored 'Trans proline' 0 N--CA 1.453 -0.867 0 C-N-CA 123.394 2.729 . . . . 0.0 110.976 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -173.94 23.14 0.07 OUTLIER Glycine 0 CA--C 1.529 0.948 0 CA-C-O 119.785 -0.453 . . . . 0.0 112.236 -178.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.481 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -145.67 -151.12 0.36 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.371 0.668 . . . . 0.0 109.883 -176.848 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 23.0 p -48.61 -30.62 5.57 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.107 0.867 . . . . 0.0 113.248 -178.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.64 -46.62 81.77 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.313 -0.867 . . . . 0.0 109.922 175.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 41.0 t60 -65.81 -32.05 73.36 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.949 -0.568 . . . . 0.0 109.955 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.27 -45.35 88.43 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 123.686 0.794 . . . . 0.0 110.597 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.4 mt -63.01 -42.72 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.171 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 174.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -59.83 -35.31 74.48 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 121.232 -0.187 . . . . 0.0 111.156 179.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.6 m -72.49 -41.33 66.1 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-O 119.588 -0.244 . . . . 0.0 111.235 178.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 55.3 mt -60.97 -29.62 69.77 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 119.459 -0.896 . . . . 0.0 108.955 174.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.8 -14.45 16.02 Favored Glycine 0 CA--C 1.533 1.159 0 CA-C-O 118.928 -0.929 . . . . 0.0 113.923 178.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -104.64 -3.73 23.39 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.261 1.531 . . . . 0.0 112.135 -178.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.46 HG21 HD13 ' A' ' 51' ' ' ILE . 35.5 m -123.61 -17.06 4.66 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.149 0 C-N-CA 122.784 0.433 . . . . 0.0 111.949 -178.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -48.3 -28.64 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -58.73 -59.05 6.03 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 117.917 0.326 . . . . 0.0 111.497 -178.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -70.97 -30.71 67.06 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 117.841 0.291 . . . . 0.0 110.711 -177.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.1 mp -63.02 -55.14 28.24 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.497 -0.287 . . . . 0.0 110.44 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.417 ' HB3' ' CG2' ' A' ' 145' ' ' ILE . 62.3 mt -71.36 -49.18 44.9 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 118.137 0.426 . . . . 0.0 110.965 -178.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.534 ' HB2' ' CE1' ' A' ' 150' ' ' PHE . 66.0 p -49.94 -52.04 36.5 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 119.003 -0.522 . . . . 0.0 112.327 178.297 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -72.53 -41.99 65.24 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 119.187 0.903 . . . . 0.0 111.709 -177.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.69 -41.76 82.29 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.575 0.625 . . . . 0.0 111.221 -178.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 10.5 mt -78.55 -35.14 18.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 118.822 0.737 . . . . 0.0 111.12 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.01 -30.14 70.63 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 120.316 -0.554 . . . . 0.0 111.119 -178.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.42 -19.89 48.89 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.141 0.576 . . . . 0.0 110.303 176.353 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 40.3 m -78.16 156.14 30.05 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -173.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.1 t-20 -88.75 176.48 7.06 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 169.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -55.65 -38.47 69.61 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.916 0.78 . . . . 0.0 111.433 -178.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -66.62 -43.51 84.57 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.662 -0.649 . . . . 0.0 111.01 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -72.74 -35.01 67.43 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 119.493 -0.289 . . . . 0.0 110.683 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -41.57 87.98 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 118.828 0.74 . . . . 0.0 109.139 172.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -66.45 -39.21 88.74 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.222 -178.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -61.81 -39.95 93.53 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 119.372 -0.347 . . . . 0.0 111.196 175.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.2 mt -73.36 -34.97 44.93 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.11 0 CA-C-N 118.437 0.562 . . . . 0.0 109.709 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -66.65 -39.32 88.17 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 122.224 -0.298 . . . . 0.0 110.52 177.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 25.6 ttt -64.19 -46.28 84.63 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 176.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.5 tt -55.88 -47.45 77.34 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.942 0.497 . . . . 0.0 110.663 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.1 mt -75.51 -30.9 59.96 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -177.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -65.71 -41.99 91.66 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 177.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 95.3 mt -69.61 -38.73 77.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 177.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 44.2 t90 -60.04 -34.99 74.14 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 117.674 0.215 . . . . 0.0 110.666 177.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -72.85 -42.59 63.58 Favored 'General case' 0 N--CA 1.456 -0.13 0 O-C-N 122.37 -0.206 . . . . 0.0 110.663 177.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 57.4 mmm-85 -75.57 -14.15 60.38 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 60.2 p -59.78 -17.72 37.86 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -179.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 148.23 1.58 0.47 Allowed Glycine 0 CA--C 1.532 1.141 0 CA-C-O 119.558 -0.579 . . . . 0.0 113.217 178.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 74.9 mt -72.8 164.06 27.16 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.139 0.969 . . . . 0.0 110.546 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -71.17 164.23 26.05 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.842 0.457 . . . . 0.0 110.88 -177.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -74.09 -6.02 45.1 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.054 0.541 . . . . 0.0 112.229 -176.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -138.94 156.9 46.89 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 123.133 0.573 . . . . 0.0 109.964 178.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 94.0 p -151.95 170.2 20.43 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 123.038 0.535 . . . . 0.0 110.354 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -111.73 9.16 20.88 Favored 'General case' 0 CA--C 1.528 0.096 0 C-N-CA 123.233 0.613 . . . . 0.0 111.634 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 84.9 mt -81.23 146.19 30.58 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 122.412 0.285 . . . . 0.0 110.678 -179.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . 0.464 ' HA ' ' HB3' ' A' ' 146' ' ' ARG . 53.5 t30 -114.81 -2.9 12.84 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.384 0.673 . . . . 0.0 111.215 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -47.49 -39.73 16.7 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 126.295 1.838 . . . . 0.0 113.223 -167.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.524 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -122.75 -9.24 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.152 0 CA-C-N 117.725 0.239 . . . . 0.0 111.497 170.579 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.464 ' HB3' ' HA ' ' A' ' 143' ' ' ASN . 49.1 tpt85 -65.27 -26.13 67.95 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-O 119.332 -0.366 . . . . 0.0 110.567 -177.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . 0.59 ' HB3' ' CE2' ' A' ' 150' ' ' PHE . 28.7 t -65.05 135.94 56.17 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 170.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 66.4 tttp -55.92 -50.6 70.26 Favored 'General case' 0 C--O 1.23 0.061 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -168.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 83.7 m -42.14 -57.92 2.32 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.143 0.429 . . . . 0.0 112.059 -169.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . 0.59 ' CE2' ' HB3' ' A' ' 147' ' ' SER . 14.5 m-85 -35.78 -102.46 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 127.748 2.419 . . . . 0.0 114.038 -174.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -85.93 -7.12 58.89 Favored 'General case' 0 C--N 1.331 -0.203 0 O-C-N 121.457 -0.777 . . . . 0.0 113.068 175.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 18.5 mmt -104.62 -3.64 23.53 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -172.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -62.47 -23.9 67.16 Favored 'General case' 0 C--N 1.345 0.383 0 CA-C-N 120.154 1.343 . . . . 0.0 111.344 173.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 63.1 tp . . . . . 0 C--O 1.251 1.143 0 CA-C-O 117.658 -1.163 . . . . 0.0 109.676 179.682 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 52.7 p90 . . . . . 0 N--CA 1.474 0.732 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 156' ' ' SER . . . . . 0.632 ' H ' ' CD ' ' B' ' 157' ' ' PRO . 88.1 p -132.24 -23.48 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.464 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 -178.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . 0.632 ' CD ' ' H ' ' B' ' 156' ' ' SER . 82.2 Cg_endo -77.15 170.83 18.94 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 CA-C-N 122.022 1.758 . . . . 0.0 110.958 179.18 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 81.1 p -124.46 179.1 5.07 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.485 0.714 . . . . 0.0 110.144 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -71.25 169.94 66.79 Favored 'Cis proline' 0 N--CA 1.454 -0.819 0 N-CA-C 110.251 -0.711 . . . . 0.0 110.251 -5.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 31.9 t -66.57 137.96 57.14 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -146.5 141.22 26.84 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 122.813 0.445 . . . . 0.0 111.44 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 16.4 t -133.8 145.69 57.08 Favored Pre-proline 0 C--O 1.233 0.213 0 C-N-CA 123.617 0.767 . . . . 0.0 111.093 -175.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.32 1.98 2.17 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 123.476 2.784 . . . . 0.0 111.341 177.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 24.2 p -72.08 -28.13 63.12 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 118.711 -0.661 . . . . 0.0 112.011 176.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 166' ' ' SEP . . . . . 0.408 ' C ' HH22 ' A' ' 74' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -69.6 175.94 7.31 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 123.921 3.08 . . . . 0.0 111.916 174.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 69.5 m . . . . . 0 C--O 1.25 1.094 0 CA-C-O 117.745 -1.121 . . . . 0.0 110.528 178.709 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.5 ptp . . . . . 0 N--CA 1.478 0.937 0 CA-C-O 120.445 0.164 . . . . 0.0 110.676 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -137.41 153.71 50.1 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 123.291 0.636 . . . . 0.0 109.871 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 65.9 tt0 -129.96 142.74 50.6 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.489 0.716 . . . . 0.0 109.134 177.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 27.8 t70 60.25 155.87 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.868 1.267 . . . . 0.0 112.885 -174.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -140.73 19.46 2.34 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 122.801 0.441 . . . . 0.0 111.723 -177.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -81.79 -141.68 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -55.77 -13.05 1.51 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.546 0.739 . . . . 0.0 111.557 177.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -52.93 -44.53 67.11 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.512 0.725 . . . . 0.0 110.94 177.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -58.13 -41.74 84.33 Favored 'General case' 0 C--O 1.227 -0.095 0 CA-C-N 118.542 0.61 . . . . 0.0 111.523 177.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -64.86 -53.17 50.95 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 118.166 0.439 . . . . 0.0 110.302 -178.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.1 t -61.69 -53.73 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -178.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.51 -32.31 68.71 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 123.236 0.614 . . . . 0.0 111.916 -178.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 55.7 m -72.59 -44.95 61.34 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 118.403 0.547 . . . . 0.0 110.444 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.9 tp -65.47 -32.45 74.08 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.115 0.416 . . . . 0.0 109.975 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -67.81 -45.64 74.17 Favored 'General case' 0 N--CA 1.458 -0.058 0 C-N-CA 123.876 0.871 . . . . 0.0 109.777 176.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.0 t -63.43 -27.9 69.6 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.225 176.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.25 -43.57 70.28 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 175.646 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -70.72 -26.63 63.48 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.014 0.926 . . . . 0.0 112.359 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -56.41 -31.83 64.27 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -175.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.8 tp -159.5 155.72 26.95 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 118.32 0.509 . . . . 0.0 110.085 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -71.3 141.91 50.48 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 176.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 59.0 m -142.83 168.43 19.72 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 121.071 0.463 . . . . 0.0 111.341 -175.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -75.99 25.08 1.55 Allowed Glycine 0 CA--C 1.529 0.95 0 C-N-CA 124.212 0.91 . . . . 0.0 112.431 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.8 mm 57.65 49.08 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 124.074 0.95 . . . . 0.0 111.082 -178.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.3 t -57.98 132.74 54.35 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.785 0.434 . . . . 0.0 111.01 -178.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.89 -27.62 71.5 Favored Glycine 0 C--N 1.339 0.697 0 C-N-CA 123.582 0.61 . . . . 0.0 113.177 -175.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.431 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 39.6 t -59.08 -43.84 91.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 117.901 0.851 . . . . 0.0 111.515 -174.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -65.5 -42.32 92.27 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -179.199 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 52.9 mt -62.53 -41.34 91.64 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.2 mmtt -64.59 -35.68 81.76 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 119.327 -0.368 . . . . 0.0 111.383 -179.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.431 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -65.93 -46.25 78.91 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 118.712 0.687 . . . . 0.0 110.115 174.025 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.22 -56.28 23.53 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 121.237 -0.185 . . . . 0.0 110.627 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.433 HG21 ' OG ' ' A' ' 71' ' ' SER . 77.3 p -58.13 -48.29 80.69 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 t -63.02 -44.0 97.16 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 120.084 -0.646 . . . . 0.0 111.389 -176.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -73.57 -22.48 60.05 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.652 0.66 . . . . 0.0 112.418 -178.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.82 -56.45 9.1 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 118.991 0.814 . . . . 0.0 109.172 168.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 55.7 mt -68.89 -15.84 63.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.157 0.983 . . . . 0.0 112.666 -175.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -59.81 -25.81 65.26 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.6 t-160 -150.23 -27.81 0.24 Allowed 'General case' 0 C--N 1.34 0.16 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -176.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.489 HG22 HG22 ' A' ' 93' ' ' THR . 42.2 mm 45.21 74.18 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-O 121.815 0.817 . . . . 0.0 111.899 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -149.41 22.84 0.92 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.435 1.094 . . . . 0.0 109.61 179.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.541 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -147.7 39.54 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 124.69 1.196 . . . . 0.0 109.131 -170.413 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.427 ' HB3' ' HA ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -52.33 -54.87 26.08 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -174.002 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.405 ' N ' ' HG2' ' A' ' 43' ' ' GLU . 78.9 p -75.77 -27.06 57.9 Favored 'General case' 0 CA--C 1.521 -0.166 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -172.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.699 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -81.49 -43.83 18.26 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.146 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 36.7 mt -55.91 -53.5 37.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 171.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' A' ' 47' ' ' ILE . 16.0 mm -66.58 -47.87 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 CA-C-O 119.078 -0.487 . . . . 0.0 112.027 -176.084 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 73.6 m -59.15 -35.5 73.62 Favored 'General case' 0 C--O 1.23 0.054 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.153 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.3 tp -68.53 -43.49 76.62 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 119.17 -0.443 . . . . 0.0 112.055 -178.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 33.2 pt -74.03 -33.33 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 119.217 0.917 . . . . 0.0 112.265 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.482 HD13 HG21 ' A' ' 104' ' ' VAL . 97.1 mt -66.3 -50.32 68.99 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 177.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -57.86 -42.1 83.81 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.266 178.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -58.39 -41.09 84.08 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 175.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.5 t -63.31 -46.22 87.73 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -178.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -80.47 -23.14 40.39 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -175.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.3 mt -84.87 -19.51 32.25 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 179.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.4 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 72.9 m -104.2 156.22 36.07 Favored Pre-proline 0 CA--C 1.534 0.339 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -170.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 57' ' ' CYS . 85.4 Cg_exo -50.74 176.36 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.537 1 C-N-CA 126.498 4.798 . . . . 0.0 115.997 175.067 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.454 ' HB2' ' HE3' ' A' ' 115' ' ' LYS . 10.4 p-10 -56.18 -49.61 73.53 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 125.905 1.682 . . . . 0.0 114.069 -174.019 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 52.8 m -62.75 -27.55 69.36 Favored 'General case' 0 CA--C 1.522 -0.101 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -81.95 -18.68 42.7 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 118.688 -0.673 . . . . 0.0 111.057 178.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -74.72 -40.2 61.44 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 119.381 0.991 . . . . 0.0 108.525 171.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 61.5 tp -64.35 -51.49 63.08 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 174.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.5 -36.82 90.81 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.765 -0.934 . . . . 0.0 110.765 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.7 t -60.58 -48.4 81.94 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.976 0.388 . . . . 0.0 110.137 177.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 31.1 mt -59.88 -35.55 75.06 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 118.55 0.614 . . . . 0.0 111.357 178.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -67.68 -37.23 82.04 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.117 0.872 . . . . 0.0 110.789 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 66.8 mt -70.31 -47.97 63.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 O-C-N 121.683 -0.635 . . . . 0.0 110.219 178.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 85.6 mt -59.98 -38.85 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 C-N-CA 123.993 0.917 . . . . 0.0 109.279 178.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -65.99 -42.97 89.12 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 118.787 -0.625 . . . . 0.0 110.555 178.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.433 ' OG ' HG21 ' A' ' 33' ' ' THR . 6.6 t -65.66 -54.6 25.37 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.621 0.646 . . . . 0.0 111.74 -177.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 55.8 mt -62.82 -33.48 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.18 -50.99 41.53 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-O 119.612 -0.549 . . . . 0.0 112.451 -179.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.634 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -70.82 -33.6 70.85 Favored 'General case' 0 CA--C 1.523 -0.07 0 CA-C-N 118.184 0.992 . . . . 0.0 110.72 -178.475 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.79 -44.49 77.26 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 177.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -62.83 -47.02 85.23 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 176.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.5 tp -57.42 -46.57 83.37 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 123.38 0.425 . . . . 0.0 110.379 -176.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -68.61 -44.45 74.27 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.094 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -68.9 -21.65 64.22 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -176.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 6.9 t -96.55 -28.01 14.58 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-N 118.675 0.67 . . . . 0.0 111.978 178.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 -80.72 -21.47 41.14 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 118.657 0.662 . . . . 0.0 111.58 176.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 95.2 p -68.55 -14.1 62.78 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 175.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -100.52 163.63 12.27 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.347 0.659 . . . . 0.0 110.186 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 53.7 m -133.8 158.82 42.4 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.15 0.58 . . . . 0.0 110.547 -179.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 50.0 t-20 -81.35 141.39 34.05 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.7 0.4 . . . . 0.0 110.573 -179.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.6 t -153.59 -13.33 0.14 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.935 0.494 . . . . 0.0 111.417 178.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 77.8 p -158.31 163.46 37.33 Favored 'General case' 0 CA--C 1.527 0.081 0 C-N-CA 123.085 0.554 . . . . 0.0 110.236 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 51.0 m -71.25 148.31 47.33 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.735 0.302 . . . . 0.0 110.54 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -152.17 159.21 43.65 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.869 0.467 . . . . 0.0 109.949 -178.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -80.55 154.15 73.73 Favored Pre-proline 0 CA--C 1.532 0.281 0 C-N-CA 123.02 0.528 . . . . 0.0 110.628 179.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -69.43 155.88 65.79 Favored 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 123.393 2.729 . . . . 0.0 110.816 178.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.547 ' H ' ' CD2' ' A' ' 96' ' ' HIS . . . 134.92 -160.88 24.45 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 111.833 -0.507 . . . . 0.0 111.833 179.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.489 HG22 HG22 ' A' ' 40' ' ' ILE . 0.6 OUTLIER 54.07 -173.37 0.04 OUTLIER 'General case' 0 C--O 1.227 -0.094 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -179.816 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 23.1 p -50.29 -32.03 15.89 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.058 1.343 . . . . 0.0 113.758 -172.266 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.14 -48.04 81.87 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.648 0.658 . . . . 0.0 109.973 176.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.547 ' CD2' ' H ' ' A' ' 92' ' ' GLY . 18.4 m-70 -75.34 -21.42 58.39 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.586 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.0 -44.88 83.49 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.2 mt -64.26 -43.7 97.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 174.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -58.97 -33.74 70.99 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.48 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.8 m -73.75 -42.6 60.88 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-O 119.301 -0.381 . . . . 0.0 110.887 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 56.8 mt -60.83 -29.55 69.56 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-N 119.053 0.842 . . . . 0.0 109.233 174.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.21 -14.31 25.17 Favored Glycine 0 CA--C 1.531 1.038 0 CA-C-O 119.104 -0.831 . . . . 0.0 113.635 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.8 -4.58 27.72 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.873 1.337 . . . . 0.0 112.044 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.482 HG21 HD13 ' A' ' 51' ' ' ILE . 27.0 m -126.18 -18.44 2.97 Favored 'Isoleucine or valine' 0 C--N 1.337 0.056 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -178.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.0 tp -49.62 -27.84 3.33 Favored 'Isoleucine or valine' 0 C--N 1.339 0.15 0 C-N-CA 123.753 0.821 . . . . 0.0 112.293 -175.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.9 pt20 -61.97 -49.69 75.1 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 117.764 0.256 . . . . 0.0 110.709 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -70.12 -36.51 74.86 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 -177.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.5 mt -63.81 -53.41 51.26 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.612 -177.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.432 ' O ' HG13 ' A' ' 113' ' ' ILE . 65.2 mt -66.05 -64.41 0.86 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.536 -0.745 . . . . 0.0 109.358 177.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.489 ' HB2' ' CE1' ' A' ' 150' ' ' PHE . 84.6 p -39.91 -49.69 2.44 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.666 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -71.66 -44.41 64.33 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 119.496 1.044 . . . . 0.0 111.404 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.13 -43.02 82.0 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.717 0.689 . . . . 0.0 110.874 -178.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.1 OUTLIER -76.88 -32.92 20.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 CA-C-N 119.01 0.823 . . . . 0.0 111.953 178.661 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.95 -30.05 68.41 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.34 0.518 . . . . 0.0 110.902 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.454 ' HE3' ' HB2' ' A' ' 59' ' ' ASP . 0.8 OUTLIER -77.62 -19.46 55.47 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.328 0.651 . . . . 0.0 110.227 175.577 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 56.0 m -81.29 153.96 26.81 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -173.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -92.35 177.61 6.09 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 170.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -55.36 -36.33 66.21 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.001 0.819 . . . . 0.0 111.608 -177.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -67.27 -47.13 71.58 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.779 -0.576 . . . . 0.0 110.382 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -70.11 -33.48 71.9 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 119.474 -0.298 . . . . 0.0 110.519 -179.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -42.25 93.21 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 118.591 0.632 . . . . 0.0 109.325 173.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -66.44 -40.25 89.37 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.149 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp -61.74 -43.83 98.08 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 119.661 -0.209 . . . . 0.0 110.996 176.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 95.6 mt -69.81 -38.38 75.77 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -63.95 -40.89 97.48 Favored 'General case' 0 CA--C 1.523 -0.091 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 60.9 ttp -63.27 -43.92 96.58 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 177.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 8.2 tt -58.76 -45.01 90.73 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 97.1 mt -73.19 -32.9 65.09 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -66.28 -38.76 88.54 Favored 'General case' 0 N--CA 1.458 -0.051 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 177.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 90.9 mt -73.17 -35.03 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.179 0 C-N-CA 122.54 0.336 . . . . 0.0 110.16 178.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 87.2 t90 -64.66 -38.17 90.08 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 117.942 0.337 . . . . 0.0 110.187 177.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -73.53 -36.77 65.74 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.206 0.202 . . . . 0.0 110.549 177.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 49.1 ttm-85 -67.66 -30.31 69.82 Favored 'General case' 0 CA--C 1.527 0.06 0 C-N-CA 123.255 0.622 . . . . 0.0 110.879 178.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 51.0 m -82.58 -8.2 59.61 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.357 0.663 . . . . 0.0 111.719 177.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -66.87 163.08 44.88 Favored Glycine 0 CA--C 1.528 0.851 0 N-CA-C 112.142 -0.383 . . . . 0.0 112.142 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 37.8 tp -88.79 -8.58 54.14 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.025 0.53 . . . . 0.0 111.081 -178.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -138.84 163.88 31.11 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.181 0.592 . . . . 0.0 110.166 -178.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -84.89 160.45 20.14 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.821 0.449 . . . . 0.0 111.532 -179.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 95.8 mttt 58.9 163.51 0.04 OUTLIER 'General case' 0 C--N 1.341 0.218 0 C-N-CA 125.651 1.581 . . . . 0.0 113.334 -178.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 96.9 p -90.26 168.4 11.95 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.024 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -138.92 15.45 2.67 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.185 0.594 . . . . 0.0 111.335 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 85.9 mt -124.2 142.36 51.3 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.162 0.585 . . . . 0.0 110.425 -177.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . 0.415 ' HA ' ' HB3' ' A' ' 146' ' ' ARG . 51.3 p-10 -82.5 -13.36 56.81 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.349 0.659 . . . . 0.0 111.812 178.487 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -47.2 -38.3 11.76 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 126.062 1.745 . . . . 0.0 113.898 -167.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.527 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -125.35 -14.35 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 CA-C-N 117.914 0.325 . . . . 0.0 110.506 170.193 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.547 ' C ' ' H ' ' A' ' 148' ' ' LYS . 28.0 ttt180 -63.13 -14.65 51.15 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 123.408 0.683 . . . . 0.0 110.86 -178.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 9.3 t -68.99 18.62 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 120.769 0.318 . . . . 0.0 111.632 169.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.547 ' H ' ' C ' ' A' ' 146' ' ' ARG . 67.6 mttm 55.63 -74.25 0.01 OUTLIER 'General case' 0 C--N 1.34 0.193 0 C-N-CA 128.347 2.659 . . . . 0.0 116.534 175.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 26.7 p -37.81 -32.23 0.06 Allowed 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -168.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . 0.489 ' CE1' ' HB2' ' A' ' 110' ' ' SER . 31.2 m-85 -48.06 -91.07 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.192 1.397 . . . . 0.0 113.568 178.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -77.05 -14.65 59.79 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.747 176.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 20.3 mmt -88.05 -20.8 25.27 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -172.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -74.79 -14.38 60.69 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.432 1.014 . . . . 0.0 112.122 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 98.1 mt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 117.242 -1.361 . . . . 0.0 110.599 -178.124 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 . . . . . 0 N--CA 1.475 0.815 0 CA-C-O 119.805 -0.141 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 54.6 m -112.0 151.54 43.63 Favored Pre-proline 0 C--O 1.233 0.211 0 C-N-CA 122.566 0.346 . . . . 0.0 111.035 -177.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -75.01 -179.16 4.72 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 124.214 3.276 . . . . 0.0 110.892 177.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 30.9 p -65.44 161.31 20.18 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 122.956 0.502 . . . . 0.0 110.998 177.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 160' ' ' PRO . . . . . 0.442 ' HG2' ' H ' ' B' ' 161' ' ' SER . 59.4 Cg_endo -67.75 -60.43 0.08 OUTLIER 'Cis proline' 0 N--CA 1.453 -0.902 0 CA-C-N 118.947 0.66 . . . . 0.0 110.868 -5.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . 0.442 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 34.2 t -175.53 168.3 3.21 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 125.14 1.376 . . . . 0.0 108.079 178.369 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 162' ' ' TYR . . . . . 0.415 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 48.4 t80 -152.02 132.92 14.17 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.187 -0.321 . . . . 0.0 111.804 171.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.1 t -135.29 140.98 36.07 Favored Pre-proline 0 N--CA 1.455 -0.224 0 C-N-CA 123.181 0.592 . . . . 0.0 110.791 177.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -65.71 -6.56 14.22 Favored 'Trans proline' 0 N--CA 1.45 -1.052 0 C-N-CA 122.734 2.29 . . . . 0.0 111.302 177.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 71.1 p -92.02 11.88 23.77 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 113.345 0.868 . . . . 0.0 113.345 -177.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -57.28 148.92 67.83 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 122.543 2.162 . . . . 0.0 110.096 169.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 51.1 m . . . . . 0 C--O 1.25 1.079 0 CA-C-O 117.281 -1.342 . . . . 0.0 111.043 -178.862 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.5 tpt . . . . . 0 N--CA 1.476 0.838 0 N-CA-C 110.847 -0.057 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -132.28 4.64 4.05 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.503 0.721 . . . . 0.0 110.004 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.56 153.03 35.04 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.477 1.111 . . . . 0.0 109.79 -177.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 32.9 t0 53.16 27.41 5.89 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.794 0.838 . . . . 0.0 112.987 177.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -84.68 38.08 0.68 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.424 0.69 . . . . 0.0 110.907 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.436 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 14.1 t70 -77.18 -154.37 0.06 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.783 0.833 . . . . 0.0 110.297 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.436 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 10.6 t80 -55.59 -14.49 2.15 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.863 0.865 . . . . 0.0 111.297 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -55.27 -35.25 64.83 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.908 0.883 . . . . 0.0 111.485 176.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.6 m-20 -61.82 -45.46 93.72 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.359 0.981 . . . . 0.0 109.292 178.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -66.18 -48.39 70.87 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 110.557 -0.164 . . . . 0.0 110.557 -177.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.6 t -65.92 -54.67 24.82 Favored 'Isoleucine or valine' 0 C--N 1.339 0.118 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 -178.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.59 -31.76 69.76 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.828 0.451 . . . . 0.0 111.737 -178.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 69.5 m -73.63 -40.35 63.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 120.214 -0.595 . . . . 0.0 110.336 176.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.9 tp -66.28 -31.86 72.93 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.009 0.433 . . . . 0.0 109.852 179.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -69.74 -44.19 70.78 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.787 0.835 . . . . 0.0 109.683 175.155 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.2 t -63.26 -26.06 68.61 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 175.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.506 ' CE2' HD11 ' A' ' 68' ' ' ILE . 0.2 OUTLIER -71.19 -45.81 62.61 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 174.992 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -60.91 -31.64 71.14 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.865 0.466 . . . . 0.0 110.783 177.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -69.28 -14.12 62.77 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 94.3 mt -69.22 -46.26 67.81 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 118.844 0.747 . . . . 0.0 111.174 -177.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 94.0 mttt 47.64 24.54 0.55 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.367 1.067 . . . . 0.0 113.707 -179.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 96.1 p -143.75 -16.9 0.61 Allowed 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 113.952 1.093 . . . . 0.0 113.952 -176.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 173.6 -133.21 2.51 Favored Glycine 0 CA--C 1.523 0.585 0 CA-C-N 119.407 1.003 . . . . 0.0 111.9 179.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.8 mt -131.71 150.61 34.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 124.503 1.121 . . . . 0.0 109.33 -173.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.5 m -139.3 123.88 18.38 Favored 'General case' 0 CA--C 1.523 -0.093 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 176.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.14 -26.96 73.35 Favored Glycine 0 CA--C 1.525 0.714 0 CA-C-O 119.489 -0.617 . . . . 0.0 112.682 -174.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.425 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 83.4 p -65.28 -35.22 80.34 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 118.398 1.099 . . . . 0.0 109.87 -179.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.6 mmt-85 -68.08 -46.0 72.23 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 73.0 mt -60.87 -36.38 71.29 Favored 'Isoleucine or valine' 0 C--O 1.231 0.1 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.104 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.9 mmtt -69.26 -40.86 77.58 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 119.009 -0.52 . . . . 0.0 111.504 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.39 -38.48 87.61 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.188 0.904 . . . . 0.0 110.953 176.153 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.7 mt -63.32 -57.84 9.06 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 122.161 0.184 . . . . 0.0 110.797 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.417 HG21 ' HB2' ' A' ' 71' ' ' SER . 33.4 p -56.27 -42.12 76.95 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 118.074 0.397 . . . . 0.0 111.272 177.028 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.0 m -55.65 -55.08 36.38 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 119.01 -0.519 . . . . 0.0 110.913 -179.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -67.86 -37.18 81.5 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.326 -0.949 . . . . 0.0 111.584 -176.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.09 -58.66 7.22 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 118.063 0.392 . . . . 0.0 110.978 177.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.45 HD21 ' HB1' ' A' ' 75' ' ' ALA . 8.2 mp -67.95 -25.09 65.28 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -178.034 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -71.71 -19.15 62.1 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 117.857 0.299 . . . . 0.0 111.091 176.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -146.74 52.83 1.1 Allowed 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.36 0.264 . . . . 0.0 111.456 -175.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.534 HG22 HG22 ' A' ' 93' ' ' THR . 33.3 mm -65.06 76.18 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-O 121.757 0.789 . . . . 0.0 109.908 171.133 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -144.13 10.96 1.53 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.597 1.559 . . . . 0.0 109.063 174.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.464 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -146.15 95.26 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 C-N-CA 125.68 1.592 . . . . 0.0 107.935 -176.572 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.561 ' CD ' ' H ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -91.76 -79.27 0.38 Allowed 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -177.18 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.561 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 46.1 m -57.72 -21.31 40.14 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 123.554 0.741 . . . . 0.0 112.96 -174.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.558 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -76.02 -54.07 7.41 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.349 0.659 . . . . 0.0 110.346 178.632 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 6.2 mt -56.36 -44.25 79.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 173.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.5 mm -67.14 -47.38 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.166 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.082 -179.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 42.7 t -58.95 -34.49 71.83 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-N 118.406 0.548 . . . . 0.0 109.968 178.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.9 tp -68.71 -45.42 71.64 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.811 -179.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.9 pt -72.3 -34.93 50.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 119.415 1.007 . . . . 0.0 112.183 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.494 HD13 HG21 ' A' ' 104' ' ' VAL . 96.3 mt -64.55 -51.71 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 178.655 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -64.91 -27.92 69.18 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.078 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -61.94 -46.81 87.68 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 175.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.7 t -61.86 -38.8 89.63 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.39 175.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -61.24 -42.77 99.19 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.621 0.769 . . . . 0.0 112.602 -176.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 83.7 mt -86.23 -14.76 42.9 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 -175.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.421 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 76.0 m -105.21 155.74 37.31 Favored Pre-proline 0 CA--C 1.533 0.309 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -170.569 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.421 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 92.3 Cg_endo -69.17 -176.44 1.32 Allowed 'Trans proline' 0 N--CA 1.459 -0.532 1 C-N-CA 125.431 4.088 . . . . 0.0 113.142 -178.882 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -54.82 -44.32 73.75 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.382 1.473 . . . . 0.0 113.98 -171.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.0 m -58.03 -29.32 65.25 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -92.86 -14.48 27.63 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 118.892 -0.575 . . . . 0.0 111.672 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -65.85 -49.0 69.73 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 169.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 44.5 tp -67.74 -48.21 67.1 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.346 179.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -56.84 -43.64 92.27 Favored Glycine 0 C--N 1.337 0.598 0 N-CA-C 110.73 -0.948 . . . . 0.0 110.73 179.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.2 t -67.5 -35.46 79.18 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.699 -0.667 . . . . 0.0 110.91 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 35.9 mt -60.9 -34.58 74.87 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 119.649 1.113 . . . . 0.0 110.66 173.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -71.67 -32.47 67.91 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.887 0.767 . . . . 0.0 111.347 175.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.506 HD11 ' CE2' ' A' ' 17' ' ' PHE . 92.6 mt -70.7 -44.07 76.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 CA-C-N 118.798 0.726 . . . . 0.0 110.413 176.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.1 mt -63.65 -35.41 72.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 177.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -70.07 -39.49 75.6 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 119.057 -0.496 . . . . 0.0 111.252 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.417 ' HB2' HG21 ' A' ' 33' ' ' THR . 95.8 p -69.72 -55.33 10.23 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 118.907 0.776 . . . . 0.0 110.5 -176.418 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 39.3 mt -64.75 -33.42 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.42 -52.21 45.59 Favored Glycine 0 CA--C 1.524 0.622 0 CA-C-O 119.846 -0.419 . . . . 0.0 112.239 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.651 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -72.06 -31.24 65.94 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 118.061 0.931 . . . . 0.0 111.115 -178.703 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.45 ' HB1' HD21 ' A' ' 37' ' ' LEU . . . -70.49 -41.89 72.08 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 177.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -62.84 -48.49 78.82 Favored 'General case' 0 CA--C 1.519 -0.22 0 O-C-N 122.153 -0.342 . . . . 0.0 110.094 175.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 55.1 tp -58.04 -44.03 87.18 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 123.312 0.383 . . . . 0.0 110.277 -176.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -66.12 -46.02 79.06 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 110.598 -0.149 . . . . 0.0 110.598 179.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -64.39 -34.8 79.0 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -176.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.4 t -85.93 -23.7 26.86 Favored 'General case' 0 CA--C 1.527 0.082 0 CA-C-N 118.147 0.43 . . . . 0.0 112.022 -178.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.5 tpp180 -83.18 -30.73 27.56 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 118.328 0.513 . . . . 0.0 112.003 176.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 74.1 m -77.78 -14.25 59.64 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 122.459 0.303 . . . . 0.0 111.785 178.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 61.0 m-20 -105.53 161.12 14.63 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 122.911 0.485 . . . . 0.0 110.308 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 21.8 t 58.92 173.25 0.07 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.109 0.964 . . . . 0.0 112.759 -177.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -129.93 5.49 4.99 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.045 0.938 . . . . 0.0 109.804 176.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 81.3 p -143.42 19.08 1.88 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.836 0.854 . . . . 0.0 110.945 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 30.4 m 57.83 25.39 11.93 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.74 0.816 . . . . 0.0 112.317 -176.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 42.4 m 59.09 169.38 0.06 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.968 1.307 . . . . 0.0 113.217 -177.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -95.46 137.51 34.42 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.803 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm 59.06 151.41 0.08 OUTLIER Pre-proline 0 CA--C 1.534 0.356 0 C-N-CA 125.697 1.599 . . . . 0.0 113.001 -174.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -74.16 157.06 46.63 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 123.226 2.618 . . . . 0.0 110.888 177.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 162.44 174.8 32.77 Favored Glycine 0 CA--C 1.529 0.907 0 N-CA-C 111.394 -0.682 . . . . 0.0 111.394 178.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.534 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER 50.0 -154.31 0.13 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.76 0.824 . . . . 0.0 112.913 175.501 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 21.6 p -52.53 -29.08 23.41 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -175.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.65 -44.57 85.97 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 118.842 0.746 . . . . 0.0 109.802 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -67.58 -30.44 70.05 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 120.99 0.424 . . . . 0.0 110.041 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.5 -43.63 80.42 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.344 -178.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.0 mt -63.66 -43.06 97.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 108.741 -0.836 . . . . 0.0 108.741 173.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -60.71 -32.76 71.99 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-O 120.572 0.225 . . . . 0.0 110.774 178.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.9 m -74.18 -40.25 62.65 Favored 'General case' 0 C--N 1.338 0.087 0 O-C-N 121.851 -0.531 . . . . 0.0 110.837 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 44.2 mt -61.56 -30.67 70.81 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 119.637 -0.825 . . . . 0.0 108.884 172.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.12 -14.6 18.7 Favored Glycine 0 CA--C 1.531 1.065 0 CA-C-O 119.027 -0.874 . . . . 0.0 114.019 178.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -102.48 -3.87 26.24 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 118.921 1.36 . . . . 0.0 112.307 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.494 HG21 HD13 ' A' ' 51' ' ' ILE . 27.8 m -123.9 -18.98 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.508 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.2 tp -49.99 -27.46 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 123.846 0.859 . . . . 0.0 112.796 -178.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.413 ' HA ' ' HB1' ' A' ' 144' ' ' ALA . 21.4 pt20 -63.38 -46.54 86.02 Favored 'General case' 0 N--CA 1.453 -0.289 0 O-C-N 122.008 -0.433 . . . . 0.0 110.988 178.097 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -74.26 -39.04 63.27 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -178.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 97.1 mt -62.4 -51.02 69.22 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.419 -177.209 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.424 ' O ' HG13 ' A' ' 113' ' ' ILE . 78.5 mt -66.3 -59.15 3.99 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.391 -0.814 . . . . 0.0 109.806 177.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.1 p -48.5 -46.04 37.85 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.526 1.057 . . . . 0.0 112.361 -175.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 -70.97 -45.57 63.85 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 119.192 0.906 . . . . 0.0 111.0 179.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.93 -37.83 74.8 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 119.02 -0.514 . . . . 0.0 112.035 -178.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -82.51 -32.29 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.154 0 C-N-CA 119.312 -0.955 . . . . 0.0 111.888 176.901 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.9 -29.45 66.64 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.469 -179.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.9 -16.56 53.26 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 122.853 0.461 . . . . 0.0 110.754 176.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 15.7 m -77.52 157.91 30.17 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -172.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -95.02 178.7 5.47 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 169.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -55.66 -39.58 71.1 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.64 -0.663 . . . . 0.0 111.949 -177.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -69.84 -37.25 76.12 Favored 'General case' 0 N--CA 1.456 -0.154 0 O-C-N 121.792 -0.567 . . . . 0.0 110.842 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -77.0 -39.15 51.44 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.169 -0.444 . . . . 0.0 111.322 -176.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.66 -34.35 78.0 Favored 'General case' 0 CA--C 1.522 -0.118 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 174.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -63.42 -45.06 92.72 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.478 176.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -61.95 -41.25 97.76 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.994 0.361 . . . . 0.0 111.436 177.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 95.6 mt -68.04 -40.58 83.37 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.117 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.6 tmm_? -62.51 -43.2 99.39 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 178.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -61.61 -45.68 93.04 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.387 0.675 . . . . 0.0 110.681 179.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.0 tt -60.49 -46.23 90.89 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.462 0.305 . . . . 0.0 110.458 177.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 98.1 mt -69.19 -29.98 68.07 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 119.796 -0.145 . . . . 0.0 111.363 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -66.75 -42.25 86.51 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 177.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.5 mt -64.99 -40.74 90.1 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 176.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -65.2 -29.81 70.65 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.323 0.249 . . . . 0.0 111.232 179.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -77.4 -40.84 42.2 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 122.076 -0.39 . . . . 0.0 110.947 177.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -74.05 -27.42 60.91 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -178.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 97.0 p -76.86 -16.86 59.29 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 118.387 0.54 . . . . 0.0 111.446 177.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 72.82 161.21 5.88 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 123.62 0.628 . . . . 0.0 112.21 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 7.4 mp -112.19 4.34 17.78 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.215 0.606 . . . . 0.0 110.588 178.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 54.81 18.41 2.14 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.835 0.854 . . . . 0.0 112.369 -175.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 33.1 tp60 -152.72 153.52 33.39 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.603 1.161 . . . . 0.0 108.204 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -63.91 139.73 58.8 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 120.803 0.335 . . . . 0.0 110.83 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 93.1 p -161.46 171.8 17.54 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.333 0.653 . . . . 0.0 110.404 -178.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -140.11 -1.26 1.57 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.599 0.36 . . . . 0.0 111.417 176.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 73.2 mt 49.31 35.55 7.92 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.435 0.694 . . . . 0.0 111.649 -178.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -54.16 -20.77 7.29 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.491 0.716 . . . . 0.0 111.941 -175.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.413 ' HB1' ' HA ' ' A' ' 106' ' ' GLN . . . -41.93 -41.73 2.56 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 125.765 1.626 . . . . 0.0 112.036 -176.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 1.9 pp -127.93 -13.92 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 173.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 58.5 mmm-85 -63.64 -15.49 58.41 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.685 0.675 . . . . 0.0 109.777 174.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 35.6 t -71.11 -24.8 62.36 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 176.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.452 ' HG3' ' H ' ' A' ' 149' ' ' CYS . 4.0 tppt? -149.52 170.92 17.51 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 -173.016 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . 0.452 ' H ' ' HG3' ' A' ' 148' ' ' LYS . 71.4 m -55.39 -13.39 1.41 Allowed 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 125.101 1.361 . . . . 0.0 112.854 -178.061 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . 0.432 ' CD2' ' HB3' ' A' ' 148' ' ' LYS . 24.4 m-85 -29.36 -66.55 0.09 Allowed 'General case' 0 C--N 1.341 0.215 0 C-N-CA 124.945 1.298 . . . . 0.0 109.954 177.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -114.96 -10.79 12.24 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.701 166.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 33.9 mmt -72.96 -0.95 15.14 Favored 'General case' 0 C--N 1.345 0.407 0 CA-C-N 119.561 1.073 . . . . 0.0 112.868 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -55.91 -16.01 4.13 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.459 0.572 . . . . 0.0 111.823 174.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 95.9 mt . . . . . 0 C--O 1.251 1.139 0 CA-C-O 117.603 -1.189 . . . . 0.0 109.642 177.905 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 . . . . . 0 N--CA 1.471 0.613 0 N-CA-C 110.747 -0.094 . . . . 0.0 110.747 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 63.6 m -75.0 151.61 86.3 Favored Pre-proline 0 C--O 1.233 0.214 0 CA-C-O 119.626 -0.226 . . . . 0.0 111.217 -178.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -61.12 167.64 8.8 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.554 2.836 . . . . 0.0 113.066 177.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 10.9 m 62.16 118.69 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.466 1.506 . . . . 0.0 112.975 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 160' ' ' PRO . . . . . 0.425 ' HD2' ' N ' ' A' ' 27' ' ' SER . 67.1 Cg_endo -67.5 173.09 36.86 Favored 'Cis proline' 0 N--CA 1.455 -0.785 0 N-CA-C 109.167 -1.128 . . . . 0.0 109.167 -10.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 79.5 p -63.46 152.78 37.41 Favored 'General case' 0 N--CA 1.455 -0.186 0 O-C-N 121.983 -0.448 . . . . 0.0 110.451 179.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 162' ' ' TYR . . . . . 0.469 ' C ' ' CD1' ' B' ' 162' ' ' TYR . 10.1 t80 -141.78 136.99 31.25 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.41 0.284 . . . . 0.0 111.439 -178.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 31.3 t -133.15 143.96 50.62 Favored Pre-proline 0 N--CA 1.455 -0.214 0 C-N-CA 123.262 0.625 . . . . 0.0 110.815 178.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -58.6 -11.29 11.07 Favored 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 123.251 2.634 . . . . 0.0 112.653 173.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 69.9 p -89.61 21.08 3.62 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -58.05 155.94 31.55 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 122.646 2.231 . . . . 0.0 110.779 171.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 78.2 p . . . . . 0 C--O 1.252 1.23 0 CA-C-O 116.94 -1.505 . . . . 0.0 111.151 -176.547 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.4 ttp . . . . . 0 N--CA 1.476 0.875 0 CA-C-O 119.96 -0.067 . . . . 0.0 111.053 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -146.01 167.36 23.52 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 123.15 0.58 . . . . 0.0 110.473 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -147.64 146.47 29.35 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.82 0.448 . . . . 0.0 110.165 -178.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -131.88 0.04 3.86 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.603 0.761 . . . . 0.0 110.875 177.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -90.78 33.61 0.93 Allowed 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.005 0.922 . . . . 0.0 110.808 177.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.445 ' CG ' ' H ' ' A' ' 7' ' ' PHE . 17.5 t70 -74.82 -157.04 0.06 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.853 0.861 . . . . 0.0 109.932 179.07 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.445 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 10.9 t80 -55.34 -15.1 2.22 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 121.712 -0.618 . . . . 0.0 111.386 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -55.27 -36.39 66.06 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 123.392 0.677 . . . . 0.0 110.681 175.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 42.9 m-20 -66.55 -44.86 81.21 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 118.952 0.796 . . . . 0.0 109.999 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -65.95 -47.85 73.3 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 117.903 0.32 . . . . 0.0 110.719 -176.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 98.6 t -65.27 -55.57 19.66 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -179.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.64 -31.07 65.91 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -178.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 62.3 m -74.6 -42.01 59.42 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 118.11 0.414 . . . . 0.0 111.051 177.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.7 tp -67.62 -31.08 70.86 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -68.76 -42.34 77.63 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.852 0.861 . . . . 0.0 109.653 174.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.0 t -62.84 -29.36 70.68 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 174.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.471 ' CD2' HD11 ' A' ' 68' ' ' ILE . 0.1 OUTLIER -72.75 -36.61 67.74 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.182 0.193 . . . . 0.0 110.538 176.232 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -67.19 -34.23 77.07 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 122.435 0.294 . . . . 0.0 110.217 175.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -74.78 -18.93 60.4 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.722 0.409 . . . . 0.0 111.696 178.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.5 tp -78.01 146.43 35.37 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -147.81 -12.38 0.38 Allowed 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 78.1 p -77.66 -20.25 54.03 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 117.907 0.321 . . . . 0.0 111.775 -178.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 164.73 -143.81 8.83 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 109.953 -1.259 . . . . 0.0 109.953 177.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.2 mm -117.62 145.1 23.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 C-N-CA 125.607 1.563 . . . . 0.0 107.615 -179.21 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.8 m -136.84 138.07 40.4 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.806 0.336 . . . . 0.0 110.588 179.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.76 -21.55 65.35 Favored Glycine 0 CA--C 1.523 0.538 0 CA-C-O 119.11 -0.828 . . . . 0.0 112.751 -178.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.417 ' N ' ' HD2' ' B' ' 160' ' ' PRO . 59.6 p -66.19 -45.67 80.0 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.838 1.319 . . . . 0.0 110.907 -175.32 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.43 ' HB3' ' CD2' ' A' ' 17' ' ' PHE . 8.4 mpt_? -68.06 -41.47 81.95 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 74.3 mt -61.68 -39.49 83.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.2 mmtt -63.57 -45.55 89.92 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.556 0.742 . . . . 0.0 110.759 179.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.59 -39.09 91.21 Favored 'General case' 0 C--N 1.339 0.125 0 CA-C-N 118.226 0.466 . . . . 0.0 111.715 179.325 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 93.0 mt -65.79 -53.86 34.71 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 119.408 -0.33 . . . . 0.0 111.249 -179.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.427 HG21 ' HB2' ' A' ' 71' ' ' SER . 41.1 p -57.81 -41.25 81.79 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 118.491 0.587 . . . . 0.0 110.959 177.056 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.1 m -55.85 -57.78 10.63 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.307 179.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -68.67 -31.29 70.3 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 118.993 -1.083 . . . . 0.0 111.777 -175.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.84 -59.2 5.59 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.304 0.502 . . . . 0.0 109.739 174.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.469 HD21 ' HB1' ' A' ' 75' ' ' ALA . 8.7 mp -72.06 -14.35 61.84 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -177.152 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -57.76 -26.73 62.27 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -179.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -151.97 -24.4 0.18 Allowed 'General case' 0 C--N 1.339 0.135 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -177.288 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.542 HG22 HG22 ' A' ' 93' ' ' THR . 25.8 mm 44.2 73.06 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-O 121.708 0.766 . . . . 0.0 111.186 -177.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -147.89 22.19 1.11 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.936 0.894 . . . . 0.0 109.556 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.549 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.3 pt -148.51 35.46 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 C-N-CA 124.562 1.145 . . . . 0.0 109.354 -170.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.425 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -50.99 -55.5 17.05 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 123.887 0.875 . . . . 0.0 113.262 -176.015 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 57.5 p -75.61 -28.32 58.82 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -173.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.673 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -79.51 -45.82 18.59 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -179.833 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 14.8 mt -55.69 -50.26 68.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 118.019 0.372 . . . . 0.0 110.169 172.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.443 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 12.9 mm -66.74 -50.2 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.225 0 CA-C-O 119.341 -0.361 . . . . 0.0 111.894 -176.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.4 m -57.07 -34.28 68.12 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 118.962 0.801 . . . . 0.0 110.491 178.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.3 tp -70.06 -45.02 67.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -179.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 38.2 pt -72.01 -32.57 44.37 Favored 'Isoleucine or valine' 0 C--N 1.341 0.202 0 CA-C-N 119.472 1.033 . . . . 0.0 111.848 -179.512 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.481 HD13 HG21 ' A' ' 104' ' ' VAL . 92.7 mt -66.53 -48.46 80.42 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.329 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -63.8 -25.81 68.34 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.876 177.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -66.37 -43.57 85.6 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 173.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.5 m -59.36 -38.07 79.48 Favored 'General case' 0 C--N 1.341 0.229 0 O-C-N 122.15 -0.344 . . . . 0.0 110.645 174.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -68.17 -43.17 78.79 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.35 1.06 . . . . 0.0 112.859 -177.109 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 73.4 mt -89.55 -15.26 33.3 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -173.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 86.2 m -104.11 159.13 30.33 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -171.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -57.11 177.45 0.19 Allowed 'Trans proline' 0 N--CA 1.46 -0.468 1 C-N-CA 125.524 4.149 . . . . 0.0 115.071 179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.446 ' HB3' ' HE3' ' A' ' 115' ' ' LYS . 72.3 m-20 -58.06 -47.26 83.68 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.19 1.396 . . . . 0.0 112.873 -178.024 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.9 m -60.06 -25.14 65.13 Favored 'General case' 0 N--CA 1.457 -0.096 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 6.2 m80 -86.92 -14.8 40.81 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.707 -0.663 . . . . 0.0 111.172 178.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -72.87 -43.53 62.45 Favored 'General case' 0 C--N 1.342 0.245 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 170.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.2 tp -65.61 -45.4 83.28 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.869 174.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.93 -42.37 98.22 Favored Glycine 0 C--N 1.336 0.534 0 N-CA-C 111.294 -0.723 . . . . 0.0 111.294 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 89.3 p -67.18 -35.55 79.88 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 117.623 0.712 . . . . 0.0 110.292 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 33.7 mt -60.65 -39.01 86.75 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 119.267 -0.973 . . . . 0.0 110.285 173.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -67.31 -35.72 80.01 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.476 1.035 . . . . 0.0 111.772 176.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.471 HD11 ' CD2' ' A' ' 17' ' ' PHE . 87.2 mt -69.03 -45.68 79.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 O-C-N 121.705 -0.622 . . . . 0.0 111.144 176.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 72.9 mt -63.24 -32.94 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 C-N-CA 123.619 0.768 . . . . 0.0 109.263 177.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -71.42 -40.43 70.46 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.188 0.595 . . . . 0.0 110.44 177.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.427 ' HB2' HG21 ' A' ' 33' ' ' THR . 98.6 p -69.45 -54.37 14.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 119.165 0.893 . . . . 0.0 110.523 -177.336 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 39.7 mt -65.07 -33.83 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 117.76 0.255 . . . . 0.0 110.555 176.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.57 -53.01 38.01 Favored Glycine 0 C--N 1.337 0.626 0 N-CA-C 111.909 -0.476 . . . . 0.0 111.909 -179.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.435 ' NH2' ' C ' ' B' ' 166' ' ' SEP . 6.3 mtp-105 -66.49 -36.13 81.98 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 117.308 0.554 . . . . 0.0 110.445 178.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.469 ' HB1' HD21 ' A' ' 37' ' ' LEU . . . -65.45 -45.95 81.79 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 178.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.8 m-30 -62.94 -44.87 94.89 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 175.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.1 tp -55.96 -44.89 78.92 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 -177.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -69.64 -39.98 76.8 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.806 178.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -70.26 -15.02 62.85 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -178.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.6 t -107.48 -19.09 13.68 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.876 0.762 . . . . 0.0 111.928 173.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 -84.1 -41.83 16.71 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 123.026 0.53 . . . . 0.0 111.697 177.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 37.4 m -110.05 -6.06 15.24 Favored 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -173.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -140.65 165.95 26.08 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.673 0.389 . . . . 0.0 110.31 -177.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 49.3 m -145.54 160.14 42.08 Favored 'General case' 0 CA--C 1.528 0.135 0 C-N-CA 123.279 0.631 . . . . 0.0 110.222 -179.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -150.99 158.87 44.69 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 13.7 t 58.47 178.18 0.07 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.42 1.088 . . . . 0.0 113.023 -178.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 78.1 p -119.05 6.5 11.31 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 124.128 0.971 . . . . 0.0 110.963 179.251 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 54.0 m -137.41 163.08 31.91 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.901 0.88 . . . . 0.0 109.408 178.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -134.51 9.09 3.67 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 122.336 0.254 . . . . 0.0 111.517 -177.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.431 ' N ' ' CD ' ' A' ' 91' ' ' PRO . 65.1 tttp -72.7 -40.15 6.3 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-O 118.432 -0.794 . . . . 0.0 112.842 -178.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 90' ' ' LYS . 31.5 Cg_exo -62.84 -21.92 73.47 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 122.402 2.068 . . . . 0.0 112.976 178.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 75.28 152.92 3.61 Favored Glycine 0 CA--C 1.53 0.98 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 -176.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.542 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -156.62 -154.92 0.5 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.356 0.662 . . . . 0.0 110.226 -179.424 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.8 p -50.49 -29.49 10.59 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -176.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.22 -45.73 86.95 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.851 0.75 . . . . 0.0 109.872 175.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 27.8 m80 -68.4 -28.6 67.24 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.311 177.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.443 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -65.25 -46.26 81.26 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 178.187 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 95.0 mt -63.32 -42.73 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.077 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 175.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -61.81 -33.0 73.35 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 122.359 -0.213 . . . . 0.0 111.261 179.115 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.8 m -74.35 -41.09 61.63 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.552 -0.261 . . . . 0.0 110.96 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 45.5 mt -60.87 -31.05 70.52 Favored 'General case' 0 C--O 1.226 -0.158 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 173.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.8 -14.4 9.89 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-O 119.021 -0.877 . . . . 0.0 113.813 178.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -103.41 -4.93 23.44 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.177 1.488 . . . . 0.0 112.371 -179.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.481 HG21 HD13 ' A' ' 51' ' ' ILE . 32.4 m -123.18 -18.18 4.43 Favored 'Isoleucine or valine' 0 C--N 1.339 0.141 0 C-N-CA 122.824 0.45 . . . . 0.0 111.964 -179.168 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.8 tp -50.94 -25.2 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 C-N-CA 123.984 0.913 . . . . 0.0 112.601 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.436 ' HA ' ' HB1' ' A' ' 144' ' ' ALA . 22.8 pt20 -64.86 -49.15 71.67 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 118.079 0.399 . . . . 0.0 111.52 178.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -69.6 -39.85 77.0 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 -177.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 10.7 mp -66.33 -50.91 61.98 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.189 -176.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 65.8 mt -63.99 -60.75 2.87 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 118.767 -0.635 . . . . 0.0 109.78 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 89.4 p -54.88 -41.91 71.45 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 118.622 -1.231 . . . . 0.0 112.318 -172.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -69.79 -40.68 75.86 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-N 119.413 1.006 . . . . 0.0 111.385 178.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.34 -42.62 96.06 Favored 'General case' 0 N--CA 1.457 -0.102 0 CA-C-N 118.531 0.605 . . . . 0.0 110.618 -179.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -38.57 53.53 Favored 'Isoleucine or valine' 0 C--N 1.338 0.093 0 C-N-CA 120.003 -0.679 . . . . 0.0 111.636 178.58 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.99 -25.36 66.27 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 119.607 -0.837 . . . . 0.0 110.094 178.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.446 ' HE3' ' HB3' ' A' ' 59' ' ' ASP . 7.8 tmtt? -75.32 -23.12 57.25 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 125.018 1.327 . . . . 0.0 111.144 175.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.401 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 55.7 p -86.14 159.68 19.46 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -170.151 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.7 p30 -102.33 -175.02 2.71 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 170.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -55.75 -39.01 70.57 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.996 0.816 . . . . 0.0 112.445 -177.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -70.73 -46.4 63.1 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 121.54 -0.725 . . . . 0.0 110.45 -178.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.401 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 35.9 m170 -72.37 -32.49 66.48 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 119.106 -0.474 . . . . 0.0 111.257 -178.085 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -37.65 82.79 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 176.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -62.67 -41.94 99.35 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 110.248 -0.279 . . . . 0.0 110.248 177.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -61.79 -41.5 97.81 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 117.827 0.285 . . . . 0.0 111.072 176.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.5 mt -69.51 -39.02 78.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 CA-C-N 118.004 0.366 . . . . 0.0 110.196 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 37.9 ttt180 -63.86 -40.74 97.27 Favored 'General case' 0 C--O 1.23 0.068 0 C-N-CA 122.56 0.344 . . . . 0.0 110.47 178.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 16.0 tmm? -68.01 -41.97 81.38 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 122.701 0.4 . . . . 0.0 110.253 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.1 tt -60.34 -43.62 96.27 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 176.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 86.2 mt -70.8 -30.27 66.68 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 119.524 -0.274 . . . . 0.0 111.468 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -66.8 -40.76 88.22 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.334 0.515 . . . . 0.0 109.96 177.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.2 mt -69.43 -36.92 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 176.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 57.3 t90 -63.68 -35.64 81.2 Favored 'General case' 0 N--CA 1.455 -0.204 0 O-C-N 122.358 -0.214 . . . . 0.0 110.436 178.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -72.38 -38.57 68.46 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 176.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 22.9 tpp180 -67.2 -27.64 67.42 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 122.345 0.258 . . . . 0.0 111.211 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 63.5 m -74.18 -13.96 60.88 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 123.193 0.597 . . . . 0.0 111.979 178.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 76.05 -179.35 47.78 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 -177.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.49 ' HG ' ' H ' ' A' ' 138' ' ' GLN . 40.1 tp -150.12 148.95 29.59 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 122.406 -0.467 . . . . 0.0 109.914 -179.033 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -132.78 15.89 4.32 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.414 0.686 . . . . 0.0 111.107 -178.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . 0.49 ' H ' ' HG ' ' A' ' 136' ' ' LEU . 24.0 mp0 -127.75 163.85 23.43 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 124.392 1.077 . . . . 0.0 108.844 178.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -69.32 -54.17 15.95 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-O 119.241 -0.409 . . . . 0.0 111.405 -176.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 30.7 m 41.57 -151.64 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.246 1.018 . . . . 0.0 112.6 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -140.19 148.76 42.05 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 174.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.653 ' H ' HD23 ' A' ' 142' ' ' LEU . 1.9 pt? -109.47 -7.43 15.17 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 122.781 0.432 . . . . 0.0 111.856 179.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 52.9 p-10 -101.41 7.62 42.53 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.779 0.832 . . . . 0.0 111.399 178.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.436 ' HB1' ' HA ' ' A' ' 106' ' ' GLN . . . -45.65 -33.78 3.09 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 126.258 1.823 . . . . 0.0 113.068 -173.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.655 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -69.67 18.52 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 C-N-CA 123.119 0.567 . . . . 0.0 111.802 176.123 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.435 ' H ' ' C ' ' A' ' 144' ' ' ALA . 82.5 mtp180 48.5 51.28 15.61 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 123.397 0.679 . . . . 0.0 109.719 -172.412 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 14.2 t 69.45 161.0 0.2 Allowed 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.669 1.188 . . . . 0.0 112.769 -174.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -55.63 -15.23 2.74 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 115.781 1.771 . . . . 0.0 115.781 -168.514 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 76.6 m -49.3 -43.45 43.32 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 119.791 1.178 . . . . 0.0 111.164 -175.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -53.24 -87.37 0.0 OUTLIER 'General case' 0 C--O 1.228 -0.034 0 C-N-CA 126.399 1.88 . . . . 0.0 113.646 -173.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -82.4 -14.56 55.0 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -178.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 34.8 mtm -110.03 -11.48 14.62 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 -168.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -110.18 -14.65 14.15 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 120.18 1.355 . . . . 0.0 112.273 174.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 83.9 mt . . . . . 0 C--O 1.252 1.217 0 CA-C-O 117.511 -1.233 . . . . 0.0 110.738 179.159 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 . . . . . 0 N--CA 1.478 0.929 0 N-CA-C 110.656 -0.127 . . . . 0.0 110.656 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 156' ' ' SER . . . . . 0.454 ' N ' ' HD2' ' B' ' 157' ' ' PRO . 30.5 m -93.7 -45.21 0.3 Allowed Pre-proline 0 CA--C 1.533 0.317 0 CA-C-O 118.601 -0.714 . . . . 0.0 112.31 177.491 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . 0.454 ' HD2' ' N ' ' B' ' 156' ' ' SER . 96.3 Cg_endo -76.49 178.69 7.23 Favored 'Trans proline' 0 N--CA 1.454 -0.849 0 C-N-CA 122.441 2.094 . . . . 0.0 110.119 175.474 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 5.2 m 56.86 42.57 26.28 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.873 0.469 . . . . 0.0 110.718 -177.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 160' ' ' PRO . . . . . 0.417 ' HD2' ' N ' ' A' ' 27' ' ' SER . 58.6 Cg_endo -67.89 -58.5 0.14 OUTLIER 'Cis proline' 0 N--CA 1.456 -0.687 0 N-CA-C 110.452 -0.634 . . . . 0.0 110.452 -4.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . 0.406 ' H ' ' HG2' ' B' ' 160' ' ' PRO . 36.8 t -171.55 141.13 1.46 Allowed 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.695 1.198 . . . . 0.0 108.415 174.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -156.54 133.31 10.26 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 118.362 0.528 . . . . 0.0 112.12 174.117 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 25.8 t -134.67 144.63 51.53 Favored Pre-proline 0 N--CA 1.454 -0.228 0 C-N-CA 123.765 0.826 . . . . 0.0 110.76 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -66.65 -1.62 6.12 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.257 2.638 . . . . 0.0 111.638 177.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 34.9 p -72.19 -23.53 61.27 Favored 'General case' 0 C--N 1.338 0.093 0 O-C-N 121.845 -0.534 . . . . 0.0 112.042 177.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 166' ' ' SEP . . . . . 0.435 ' C ' ' NH2' ' A' ' 74' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -69.21 166.35 27.2 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 123.869 3.046 . . . . 0.0 112.243 177.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 43.9 m . . . . . 0 C--O 1.251 1.176 0 CA-C-O 117.172 -1.394 . . . . 0.0 112.035 -179.388 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.3 tpp . . . . . 0 N--CA 1.475 0.798 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -149.05 148.85 30.19 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 123.013 0.525 . . . . 0.0 109.915 179.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -141.18 169.37 17.73 Favored 'General case' 0 CA--C 1.527 0.089 0 C-N-CA 123.434 0.694 . . . . 0.0 109.726 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -139.56 161.24 37.98 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.089 0.556 . . . . 0.0 110.219 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -140.34 12.08 2.36 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.611 0.764 . . . . 0.0 111.251 -175.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -91.25 -123.12 0.07 Allowed 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -57.11 -17.81 12.21 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.109 0.413 . . . . 0.0 111.196 176.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.4 tp60 -56.61 -45.31 81.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.218 -0.42 . . . . 0.0 110.31 175.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -57.51 -39.98 77.71 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.306 176.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -64.35 -54.04 39.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.888 0.767 . . . . 0.0 110.766 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 59.4 t -63.5 -50.44 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.179 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 -178.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.72 -32.26 69.03 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 123.268 0.627 . . . . 0.0 111.432 -179.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 52.3 m -72.27 -43.91 63.6 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 122.025 -0.422 . . . . 0.0 110.145 176.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 21.0 tp -64.73 -29.33 70.31 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 120.426 -0.51 . . . . 0.0 109.999 179.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -70.44 -41.81 72.35 Favored 'General case' 0 C--N 1.338 0.074 0 C-N-CA 123.667 0.787 . . . . 0.0 110.57 175.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.9 p -63.96 -29.0 70.2 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.067 174.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -33.41 63.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.316 0.647 . . . . 0.0 110.241 174.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -67.67 -38.19 83.39 Favored 'General case' 0 C--N 1.339 0.123 0 C-N-CA 123.384 0.674 . . . . 0.0 110.514 178.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -77.3 -7.58 56.24 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 122.379 0.272 . . . . 0.0 110.643 175.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 18.2 tp 53.25 49.4 19.93 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 124.467 1.107 . . . . 0.0 111.427 179.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -69.0 -6.28 26.91 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 89.0 p -149.78 162.8 39.55 Favored 'General case' 0 CA--C 1.528 0.126 0 O-C-N 122.061 -0.4 . . . . 0.0 111.0 -179.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.86 66.06 3.92 Favored Glycine 0 C--N 1.337 0.614 0 N-CA-C 111.211 -0.756 . . . . 0.0 111.211 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.4 mm 56.66 37.49 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 C-N-CA 123.452 0.701 . . . . 0.0 110.699 -177.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.0 t -59.5 137.73 57.92 Favored 'General case' 0 C--O 1.23 0.073 0 CA-C-O 120.968 0.413 . . . . 0.0 111.719 -175.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.95 -23.1 67.3 Favored Glycine 0 CA--C 1.526 0.721 0 CA-C-O 119.27 -0.739 . . . . 0.0 113.715 -173.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.465 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 38.5 t -59.01 -40.82 86.12 Favored 'General case' 0 N--CA 1.458 -0.065 0 CA-C-N 118.658 1.229 . . . . 0.0 110.633 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -69.45 -39.05 78.01 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -178.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 69.4 mt -65.61 -36.19 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -69.17 -36.06 76.97 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 119.459 -0.305 . . . . 0.0 111.369 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.465 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -65.85 -44.48 85.37 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 118.332 0.514 . . . . 0.0 110.342 174.626 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.7 mt -62.56 -52.33 63.86 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 122.291 -0.256 . . . . 0.0 110.957 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.431 HG21 ' HB2' ' A' ' 71' ' ' SER . 27.3 p -59.77 -50.72 72.7 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 118.413 0.552 . . . . 0.0 111.936 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.3 t -61.26 -45.13 95.76 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 120.092 -0.643 . . . . 0.0 111.623 -174.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -75.63 -21.46 57.7 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -178.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.06 -57.12 8.45 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 119.172 0.897 . . . . 0.0 109.031 167.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.3 mp -69.05 -14.75 63.21 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -177.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -64.94 -16.83 63.78 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.991 0.814 . . . . 0.0 113.065 178.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -140.4 -41.63 0.42 Allowed 'General case' 0 C--N 1.34 0.185 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -178.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.541 HG22 HG22 ' A' ' 93' ' ' THR . 44.8 mm 43.06 67.0 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-O 122.352 1.072 . . . . 0.0 111.07 -172.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -147.34 20.65 1.21 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 114.709 -1.132 . . . . 0.0 108.865 179.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.603 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.1 pt -148.38 33.85 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 C-N-CA 125.157 1.383 . . . . 0.0 109.456 -171.471 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.519 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.3 OUTLIER -49.57 -55.64 12.77 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -177.131 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 83.6 p -75.38 -24.73 57.28 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -173.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.638 ' H ' ' HD3' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -84.95 -42.72 14.68 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 -179.511 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 30.8 mt -56.21 -52.82 46.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 118.277 0.489 . . . . 0.0 109.752 171.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.439 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 15.4 mm -66.17 -48.94 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 CA-C-O 119.335 -0.364 . . . . 0.0 111.643 -177.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.0 t -56.53 -37.15 70.08 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 119.891 -0.724 . . . . 0.0 110.101 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.3 tp -70.55 -40.19 73.51 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 118.624 -0.703 . . . . 0.0 112.782 -177.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.8 pt -73.67 -37.52 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 119.775 1.17 . . . . 0.0 111.965 178.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.432 HD13 HG21 ' A' ' 104' ' ' VAL . 93.9 mt -63.4 -49.2 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.099 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -59.41 -41.43 89.48 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.855 177.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -55.73 -40.12 72.04 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 176.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.6 t -68.0 -53.63 24.53 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 179.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -68.63 -24.6 64.58 Favored 'General case' 0 C--O 1.228 -0.074 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -172.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 47.1 mt -80.56 -15.89 55.54 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 83.1 m -121.74 164.26 26.07 Favored Pre-proline 0 CA--C 1.536 0.426 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -169.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_exo -55.57 -177.83 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.407 1 C-N-CA 126.001 4.467 . . . . 0.0 116.072 -179.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -56.19 -40.44 73.97 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 125.611 1.565 . . . . 0.0 113.427 -176.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 74.9 m -61.5 -23.1 65.67 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 19.3 m80 -87.59 -23.63 24.24 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 118.906 -0.568 . . . . 0.0 110.928 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -67.18 -42.21 84.61 Favored 'General case' 0 C--N 1.343 0.321 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 169.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.7 tp -66.84 -51.99 48.92 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 120.915 0.388 . . . . 0.0 110.365 177.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.43 -39.65 90.91 Favored Glycine 0 C--N 1.336 0.574 0 N-CA-C 110.246 -1.142 . . . . 0.0 110.246 178.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 40.1 t -63.24 -45.65 90.6 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 117.483 0.641 . . . . 0.0 110.767 178.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 33.9 mt -57.93 -38.2 75.5 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 118.854 0.752 . . . . 0.0 111.403 178.146 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -74.45 -31.51 62.29 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 119.492 -0.883 . . . . 0.0 112.16 178.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 81.0 mt -73.47 -41.65 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 118.92 0.782 . . . . 0.0 110.669 176.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.8 mt -62.71 -40.06 87.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 176.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -66.8 -42.77 85.42 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 119.278 -0.391 . . . . 0.0 110.959 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.431 ' HB2' HG21 ' A' ' 33' ' ' THR . 84.1 p -66.93 -56.52 9.88 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 118.338 0.517 . . . . 0.0 111.148 -174.789 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 38.3 mt -65.19 -31.17 52.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 176.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.89 -52.92 37.64 Favored Glycine 0 CA--C 1.522 0.489 0 CA-C-O 119.751 -0.471 . . . . 0.0 112.191 -179.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.661 HH11 ' CG ' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -72.28 -31.1 65.44 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 117.992 0.896 . . . . 0.0 110.824 -179.242 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.74 -46.61 74.87 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 176.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -62.32 -45.23 94.15 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 175.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -57.34 -43.08 83.12 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -178.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -67.16 -41.17 86.45 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 121.38 -0.128 . . . . 0.0 110.902 178.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -64.58 -40.41 95.48 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 119.51 -0.281 . . . . 0.0 111.227 -178.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.3 t -82.78 -18.85 39.14 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 118.192 0.451 . . . . 0.0 111.496 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 56.6 ttp180 -76.23 -31.25 58.29 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 122.078 -0.389 . . . . 0.0 110.417 171.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.5 t -76.92 -33.72 57.72 Favored 'General case' 0 C--O 1.231 0.129 0 C-N-CA 122.764 0.426 . . . . 0.0 111.94 -179.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -153.73 154.12 33.47 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 80.2 p -116.06 160.42 20.33 Favored 'General case' 0 C--O 1.231 0.091 0 C-N-CA 122.981 0.512 . . . . 0.0 111.586 -177.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 -140.4 172.4 12.78 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.714 0.805 . . . . 0.0 109.772 -178.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.8 m -126.34 159.36 33.39 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 122.825 0.45 . . . . 0.0 110.746 -178.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 31.9 m -81.52 12.3 3.87 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.417 0.687 . . . . 0.0 111.929 -178.422 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.8 p -86.11 -1.66 57.6 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.249 0.62 . . . . 0.0 112.239 -179.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -132.19 -15.24 2.93 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.594 0.357 . . . . 0.0 111.572 178.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -146.99 153.72 45.93 Favored Pre-proline 0 C--N 1.342 0.249 0 C-N-CA 123.685 0.794 . . . . 0.0 109.722 179.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -72.48 -13.23 27.6 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.959 2.439 . . . . 0.0 111.138 176.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 163.98 172.4 31.42 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 109.744 -1.342 . . . . 0.0 109.744 178.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.541 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -153.68 -156.97 0.74 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 117.155 0.478 . . . . 0.0 110.528 178.247 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 26.7 p -47.91 -32.64 6.57 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 -176.204 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.76 -46.9 80.2 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.582 -0.699 . . . . 0.0 110.137 176.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 67.2 m80 -67.24 -28.78 68.33 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.299 0.639 . . . . 0.0 110.202 177.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.439 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -66.22 -45.45 80.64 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 122.434 0.294 . . . . 0.0 110.546 177.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 93.3 mt -62.89 -42.41 96.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 175.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -61.48 -33.69 74.2 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.779 -0.191 . . . . 0.0 111.389 178.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.3 m -73.21 -42.29 62.81 Favored 'General case' 0 C--O 1.227 -0.084 0 C-N-CA 122.332 0.253 . . . . 0.0 111.185 179.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 44.9 mt -60.85 -30.78 70.32 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 173.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.17 -14.65 19.22 Favored Glycine 0 CA--C 1.534 1.237 0 CA-C-O 118.826 -0.986 . . . . 0.0 113.81 178.095 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -100.59 -6.92 24.6 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 119.061 1.431 . . . . 0.0 111.805 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.432 HG21 HD13 ' A' ' 51' ' ' ILE . 35.3 m -121.15 -18.31 5.35 Favored 'Isoleucine or valine' 0 C--N 1.338 0.108 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.422 ' HA ' HD12 ' A' ' 105' ' ' ILE . 10.7 tp -53.69 -26.03 12.74 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 C-N-CA 122.92 0.488 . . . . 0.0 111.817 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.422 ' HA ' ' HB1' ' A' ' 144' ' ' ALA . 16.4 pt20 -59.49 -61.42 2.64 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 122.77 0.428 . . . . 0.0 110.614 176.199 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -71.13 -28.27 64.17 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.929 -0.482 . . . . 0.0 111.332 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.51 -55.67 25.25 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.38 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 59.9 mt -62.95 -58.14 8.36 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 118.44 -0.791 . . . . 0.0 110.428 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 91.1 p -55.27 -43.13 74.43 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 118.857 -1.137 . . . . 0.0 112.133 -172.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -70.69 -41.67 71.7 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 119.237 0.926 . . . . 0.0 111.077 177.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.17 -37.25 71.82 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 119.157 -0.449 . . . . 0.0 111.359 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.429 HG21 ' HB2' ' A' ' 151' ' ' ALA . 0.0 OUTLIER -80.91 -35.31 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.101 0 C-N-CA 119.572 -0.851 . . . . 0.0 112.135 175.583 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.09 -25.4 65.31 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 119.813 -0.755 . . . . 0.0 111.125 -178.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.52 -14.3 38.08 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.293 0.637 . . . . 0.0 111.225 177.008 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.435 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 46.3 p -71.42 156.49 39.41 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -170.462 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 68.4 m-20 -96.36 177.89 5.55 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 106.908 -1.515 . . . . 0.0 106.908 168.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -56.26 -45.1 80.19 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.738 0.699 . . . . 0.0 111.149 -177.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -64.99 -41.13 95.68 Favored 'General case' 0 CA--C 1.53 0.173 0 O-C-N 121.974 -0.454 . . . . 0.0 110.481 -179.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.435 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 31.6 m170 -69.42 -37.35 77.41 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 119.295 -0.383 . . . . 0.0 110.882 -178.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -41.16 96.83 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 174.551 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -64.4 -39.54 94.06 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.568 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -64.21 -41.08 97.21 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 121.15 -0.22 . . . . 0.0 111.19 176.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.9 mt -69.8 -37.39 73.34 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.087 0 CA-C-N 118.281 0.492 . . . . 0.0 109.719 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 80.5 ttt-85 -64.8 -38.1 89.84 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 177.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 65.6 ttp -66.05 -40.76 91.23 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 55.1 tp -60.4 -44.62 95.51 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 110.53 -0.174 . . . . 0.0 110.53 178.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.9 mt -68.06 -35.59 78.47 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 122.094 0.158 . . . . 0.0 111.028 179.039 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -65.72 -36.01 82.38 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 110.332 -0.248 . . . . 0.0 110.332 178.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 88.2 mt -69.81 -42.61 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 176.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 48.9 m0 -64.39 -29.77 70.82 Favored 'General case' 0 C--O 1.226 -0.169 0 O-C-N 122.303 -0.248 . . . . 0.0 110.88 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -78.81 -34.52 45.27 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 122.102 -0.374 . . . . 0.0 110.784 176.202 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 8.4 tpm_? -73.54 -25.92 60.62 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 122.942 0.497 . . . . 0.0 111.598 -179.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 83.1 p -58.83 -23.71 60.94 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 64.43 -170.22 22.43 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 123.599 0.618 . . . . 0.0 112.599 177.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.424 HD22 ' N ' ' A' ' 136' ' ' LEU . 3.2 mm? 55.9 -176.4 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.773 1.229 . . . . 0.0 112.177 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 53.71 -166.94 0.07 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.257 1.023 . . . . 0.0 112.809 178.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -62.22 156.28 22.38 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.656 0.783 . . . . 0.0 110.115 178.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -134.6 167.59 20.52 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 123.156 0.582 . . . . 0.0 110.61 -177.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 25.2 m 56.5 19.28 4.03 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.131 0.973 . . . . 0.0 113.59 -179.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -93.98 1.47 56.26 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.804 0.441 . . . . 0.0 111.128 178.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.414 HD22 ' N ' ' A' ' 142' ' ' LEU . 3.4 mm? -76.94 5.76 7.41 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.327 0.651 . . . . 0.0 111.447 -176.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -58.23 -10.58 2.06 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.68 0.792 . . . . 0.0 112.623 179.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.455 ' C ' ' H ' ' A' ' 146' ' ' ARG . . . -39.76 -32.83 0.16 Allowed 'General case' 0 C--N 1.342 0.267 0 C-N-CA 126.989 2.116 . . . . 0.0 113.099 177.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.414 ' O ' ' CD1' ' A' ' 150' ' ' PHE . 0.2 OUTLIER -67.84 16.81 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-N 118.035 0.379 . . . . 0.0 111.809 177.269 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.455 ' H ' ' C ' ' A' ' 144' ' ' ALA . 83.8 mtp180 51.59 49.9 19.91 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.29 0.636 . . . . 0.0 109.611 -173.428 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 16.1 t 69.95 147.85 0.07 Allowed 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.741 1.216 . . . . 0.0 112.887 -174.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -41.38 -36.81 0.9 Allowed 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 -166.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 69.3 m -43.57 -29.07 0.44 Allowed 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 -168.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . 0.414 ' CD1' ' O ' ' A' ' 145' ' ' ILE . 14.0 m-85 -49.76 -82.29 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.982 1.713 . . . . 0.0 113.317 179.405 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . 0.429 ' HB2' HG21 ' A' ' 113' ' ' ILE . . . -82.74 -13.41 56.38 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 122.213 -0.305 . . . . 0.0 111.534 178.081 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 18.6 mmt -97.07 -21.41 17.39 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 -169.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -77.86 -18.84 55.79 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 119.807 1.185 . . . . 0.0 113.149 -175.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 2.1 pt? . . . . . 0 C--O 1.25 1.096 0 CA-C-O 117.592 -1.194 . . . . 0.0 111.335 -177.979 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 . . . . . 0 N--CA 1.472 0.638 0 N-CA-C 110.67 -0.122 . . . . 0.0 110.67 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 156' ' ' SER . . . . . 0.675 ' H ' ' CD ' ' B' ' 157' ' ' PRO . 42.8 m -133.46 -27.68 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.471 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -179.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . 0.675 ' CD ' ' H ' ' B' ' 156' ' ' SER . 65.9 Cg_endo -78.9 173.48 13.5 Favored 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 122.033 1.822 . . . . 0.0 111.217 179.586 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 64.2 p -127.36 147.54 50.26 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 123.187 0.595 . . . . 0.0 110.304 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -72.44 176.77 38.24 Favored 'Cis proline' 0 N--CA 1.454 -0.84 0 N-CA-C 109.806 -0.882 . . . . 0.0 109.806 -5.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 47.5 m -68.01 155.18 40.07 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 174.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 162' ' ' TYR . . . . . 0.416 ' CD1' ' C ' ' B' ' 162' ' ' TYR . 15.8 t80 -139.95 127.42 21.5 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 120.574 0.225 . . . . 0.0 110.938 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 30.9 t -124.17 124.54 25.88 Favored Pre-proline 0 C--O 1.234 0.276 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.543 177.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.18 -12.66 35.8 Favored 'Trans proline' 0 N--CA 1.449 -1.143 0 C-N-CA 122.386 2.057 . . . . 0.0 109.828 -179.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 22.5 m -59.88 -23.33 63.37 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 123.536 0.735 . . . . 0.0 111.853 -174.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -57.56 153.91 39.31 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 124.407 3.405 . . . . 0.0 112.073 177.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 21.6 m . . . . . 0 C--O 1.251 1.177 0 CA-C-O 117.617 -1.182 . . . . 0.0 111.114 -178.041 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -146.2 168.21 21.58 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.183 0.593 . . . . 0.0 110.481 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -143.4 152.76 41.95 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.48 0.712 . . . . 0.0 109.577 -179.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -137.95 164.65 28.49 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 122.843 0.457 . . . . 0.0 110.875 -178.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -122.26 17.96 10.68 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.589 0.756 . . . . 0.0 111.073 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -82.45 -141.22 0.05 Allowed 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -55.41 -15.42 2.62 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.179 0.592 . . . . 0.0 111.714 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 34.3 tp60 -55.27 -41.26 71.99 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.137 0.575 . . . . 0.0 110.362 176.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -63.96 -37.89 89.08 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 118.246 0.475 . . . . 0.0 110.615 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -64.72 -55.38 20.29 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.536 0.607 . . . . 0.0 109.899 179.19 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 66.5 t -60.72 -53.08 53.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -177.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.53 -35.73 70.66 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.118 0.567 . . . . 0.0 111.627 -178.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 77.5 m -69.12 -44.95 71.36 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-N 118.352 0.524 . . . . 0.0 110.452 177.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 20.7 tp -66.46 -29.16 69.23 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.487 -179.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.4 -45.16 66.52 Favored 'General case' 0 CA--C 1.523 -0.079 0 C-N-CA 123.787 0.835 . . . . 0.0 109.85 177.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 72.8 m -61.44 -29.35 69.89 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 173.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.86 -32.47 61.9 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 120.601 0.238 . . . . 0.0 110.623 175.494 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -71.61 -31.13 66.57 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 123.348 0.659 . . . . 0.0 110.57 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -70.51 -19.82 62.89 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 122.636 0.374 . . . . 0.0 111.275 177.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 44.3 tp -85.81 144.7 27.58 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.092 0.557 . . . . 0.0 109.845 -179.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -104.99 -21.01 13.36 Favored 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -175.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.1 p -160.45 160.9 32.66 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 122.974 0.509 . . . . 0.0 110.452 179.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.67 139.55 6.29 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 111.083 -0.807 . . . . 0.0 111.083 -179.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.6 mm -109.27 146.35 14.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 C-N-CA 123.988 0.915 . . . . 0.0 108.713 179.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 42.9 t -138.98 121.67 16.37 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.72 -20.08 63.64 Favored Glycine 0 CA--C 1.523 0.562 0 CA-C-O 119.229 -0.762 . . . . 0.0 112.208 -176.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.445 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 47.7 t -65.42 -42.34 92.58 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 118.611 1.205 . . . . 0.0 109.853 177.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.4 mmp_? -60.42 -48.16 82.94 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 176.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.5 mt -63.15 -34.33 66.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.201 -177.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 23.0 mmtp -69.1 -39.67 78.85 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 118.83 -0.605 . . . . 0.0 110.777 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.445 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.3 OUTLIER -65.22 -42.58 93.29 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.359 0.982 . . . . 0.0 110.225 175.296 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.5 mt -62.45 -56.91 13.65 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 122.487 -0.133 . . . . 0.0 110.82 -178.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.555 HG21 ' HB2' ' A' ' 71' ' ' SER . 41.6 p -55.29 -42.97 74.34 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 121.986 -0.447 . . . . 0.0 111.593 176.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.9 m -55.37 -55.92 26.06 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 119.279 -0.391 . . . . 0.0 111.131 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -79.07 -18.54 53.24 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -173.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.26 -56.0 8.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 119.041 0.837 . . . . 0.0 109.15 167.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 50.0 mt -72.92 -14.58 61.5 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.913 0.885 . . . . 0.0 113.154 -174.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -55.37 -30.33 60.14 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -178.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -153.1 -20.78 0.15 Allowed 'General case' 0 C--N 1.341 0.214 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 -178.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.491 HG22 HG22 ' A' ' 93' ' ' THR . 35.0 mm 45.75 74.15 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-O 121.837 0.827 . . . . 0.0 111.173 -177.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -134.52 6.74 3.53 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.177 0.991 . . . . 0.0 109.835 178.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.491 HG22 ' HE2' ' A' ' 45' ' ' LYS . 1.4 pt -142.5 108.64 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 124.888 1.275 . . . . 0.0 108.359 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.57 ' CD ' ' H ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -102.13 -82.77 0.47 Allowed 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -178.54 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.57 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 99.2 p -55.86 -24.48 37.09 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 123.504 0.722 . . . . 0.0 112.569 -174.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.641 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -70.86 -56.42 6.33 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 177.812 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.432 ' H ' ' HG2' ' A' ' 45' ' ' LYS . 6.5 mt -57.52 -40.64 75.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 123.179 0.591 . . . . 0.0 110.556 175.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 14.8 mm -69.68 -51.71 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-O 119.275 -0.393 . . . . 0.0 111.481 -178.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.4 m -60.63 -27.13 67.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 118.821 0.737 . . . . 0.0 110.03 177.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 50.9 tp -70.39 -45.01 66.83 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 118.72 -0.657 . . . . 0.0 111.778 178.265 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 25.7 pt -74.91 -33.83 31.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 119.581 1.082 . . . . 0.0 111.437 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.41 HD13 HG21 ' A' ' 104' ' ' VAL . 96.2 mt -65.63 -52.19 53.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -65.18 -29.46 70.28 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.071 178.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -59.13 -42.54 90.87 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 173.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.6 m -58.33 -49.36 77.47 Favored 'General case' 0 C--N 1.338 0.093 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 174.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 52.5 tpt85 -56.15 -30.55 62.35 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.803 0.841 . . . . 0.0 112.486 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 80.3 mt -90.59 -14.59 32.15 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -179.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 50.7 m -97.05 159.01 32.38 Favored Pre-proline 0 CA--C 1.531 0.231 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -171.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -75.79 -139.54 0.02 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.707 1 C-N-CA 125.723 4.282 . . . . 0.0 109.063 172.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -56.12 -19.6 13.96 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.002 0.819 . . . . 0.0 112.125 178.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.8 m -59.46 -25.69 64.61 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.755 0.422 . . . . 0.0 109.961 173.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -55.28 -64.64 0.78 Allowed 'General case' 0 C--N 1.341 0.204 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 172.543 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.3 ttpt -50.44 -75.68 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.871 -179.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 33.0 tp -74.27 -43.14 58.14 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 119.102 -1.039 . . . . 0.0 111.639 -168.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.57 -48.32 44.28 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -174.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.9 m -70.66 -38.61 73.8 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 118.504 -1.278 . . . . 0.0 110.041 -178.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 66' ' ' LEU . 60.7 mt -58.26 -42.08 85.69 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 118.293 -1.363 . . . . 0.0 110.826 177.32 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -68.66 -40.03 80.38 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.324 0.966 . . . . 0.0 112.168 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 79.0 mt -66.89 -42.09 88.52 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-N 118.395 0.543 . . . . 0.0 111.15 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.2 mt -66.89 -29.94 47.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -76.75 -37.85 55.2 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-O 119.041 -0.504 . . . . 0.0 111.975 178.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.555 ' HB2' HG21 ' A' ' 33' ' ' THR . 61.2 p -70.78 -52.68 19.09 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 119.286 0.948 . . . . 0.0 110.324 178.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 53.1 mt -67.81 -36.21 75.05 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 178.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.9 -46.79 64.45 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 -178.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 28.2 mtt-85 -63.05 -43.51 98.44 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 117.623 0.711 . . . . 0.0 109.942 176.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.33 -40.54 93.82 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.769 -0.196 . . . . 0.0 110.694 -178.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -63.96 -45.62 88.3 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 175.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.8 tp -57.88 -41.62 82.91 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 -177.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -67.94 -41.36 82.66 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 117.725 0.238 . . . . 0.0 110.397 177.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -60.07 -39.72 87.02 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.877 -0.147 . . . . 0.0 111.074 -177.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 9.3 t -87.31 -20.34 26.94 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 117.995 0.362 . . . . 0.0 111.702 178.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 67.2 ttp85 -71.14 -27.72 63.77 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 118.371 0.532 . . . . 0.0 110.185 174.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.7 t -55.86 -22.59 26.05 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -151.92 125.74 9.05 Favored 'General case' 0 N--CA 1.456 -0.142 0 O-C-N 121.909 -0.495 . . . . 0.0 110.193 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 33.8 t -152.29 162.56 40.97 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.707 0.403 . . . . 0.0 110.695 -179.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -140.88 20.43 2.31 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.549 0.74 . . . . 0.0 110.275 178.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 23.4 m 55.95 13.04 1.01 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.397 1.079 . . . . 0.0 113.409 -177.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 69.1 m -147.21 151.66 37.08 Favored 'General case' 0 C--O 1.23 0.074 0 C-N-CA 123.939 0.896 . . . . 0.0 109.636 178.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.1 m -147.93 153.35 38.94 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 120.755 0.312 . . . . 0.0 110.939 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 50.2 t30 -152.83 142.5 21.92 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 176.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 83.3 tttt 43.64 62.39 9.24 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 123.703 0.801 . . . . 0.0 110.502 -177.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -67.35 164.67 29.71 Favored 'Trans proline' 0 N--CA 1.451 -0.991 0 C-N-CA 123.897 3.064 . . . . 0.0 111.766 -174.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -169.1 -171.66 35.05 Favored Glycine 0 CA--C 1.527 0.784 0 N-CA-C 110.309 -1.116 . . . . 0.0 110.309 -179.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.491 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER 50.95 -160.25 0.08 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.082 0.953 . . . . 0.0 113.444 177.58 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 28.6 p -49.3 -30.31 7.25 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -175.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.4 -46.69 79.03 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 118.787 0.722 . . . . 0.0 110.073 177.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 43.0 t60 -69.52 -27.53 65.26 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 121.038 0.447 . . . . 0.0 110.21 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.09 -42.69 79.97 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.185 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 96.3 mt -64.77 -41.78 93.14 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.163 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 173.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -59.82 -33.3 71.57 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 110.782 -0.081 . . . . 0.0 110.782 178.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 88.6 m -75.57 -42.72 51.41 Favored 'General case' 0 N--CA 1.457 -0.075 0 CA-C-O 119.526 -0.273 . . . . 0.0 111.026 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 49.6 mt -60.54 -29.02 68.87 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 173.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.4 -15.38 31.28 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-O 119.154 -0.803 . . . . 0.0 113.563 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -98.28 -6.28 31.36 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.961 1.38 . . . . 0.0 111.684 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.41 HG21 HD13 ' A' ' 51' ' ' ILE . 31.1 m -123.71 -22.68 2.66 Favored 'Isoleucine or valine' 0 C--O 1.23 0.027 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -178.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.42 HD12 ' HA ' ' A' ' 105' ' ' ILE . 11.0 tp -55.87 -26.49 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 C-N-CA 122.935 0.494 . . . . 0.0 111.44 -177.237 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -61.93 -59.08 5.65 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.144 0.578 . . . . 0.0 111.198 178.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -73.75 -29.87 62.47 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 122.168 0.187 . . . . 0.0 110.766 -179.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.0 tt -63.03 -56.64 15.21 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.41 ' O ' HG13 ' A' ' 113' ' ' ILE . 49.5 mt -61.2 -57.98 10.2 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 118.695 -0.669 . . . . 0.0 110.261 176.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 55.9 p -54.84 -44.26 73.76 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 119.605 -0.838 . . . . 0.0 112.053 -172.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -69.04 -42.46 76.31 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-N 119.13 0.877 . . . . 0.0 110.794 177.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.28 -50.89 70.1 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.85 0.46 . . . . 0.0 111.603 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.444 HG21 ' HB2' ' A' ' 151' ' ' ALA . 0.0 OUTLIER -69.94 -35.46 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 O-C-N 121.781 -0.575 . . . . 0.0 111.224 179.253 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.65 -24.6 64.56 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.05 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.62 -14.21 38.04 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.071 0.548 . . . . 0.0 110.827 178.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.436 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 29.5 p -79.46 157.4 27.51 Favored 'General case' 0 N--CA 1.457 -0.102 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 -171.274 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -90.16 173.42 8.18 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 172.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 85.2 mt-30 -55.56 -45.78 77.26 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.772 0.714 . . . . 0.0 111.679 -176.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -63.99 -39.03 93.21 Favored 'General case' 0 N--CA 1.454 -0.244 0 O-C-N 121.719 -0.613 . . . . 0.0 110.404 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.436 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 31.7 m170 -70.83 -45.43 64.56 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.125 -178.148 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -35.95 71.69 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-N 118.839 0.745 . . . . 0.0 109.984 174.542 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.31 -41.99 88.91 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.237 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 30.6 mtpp -61.57 -44.26 97.35 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.349 175.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 98.0 mt -65.28 -38.23 82.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 43.7 ttt85 -62.26 -39.34 92.57 Favored 'General case' 0 CA--C 1.521 -0.145 0 C-N-CA 122.693 0.397 . . . . 0.0 109.932 177.286 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 51.1 ttp -66.09 -44.03 85.56 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.547 -0.168 . . . . 0.0 110.547 178.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.3 mp -57.83 -46.34 84.86 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 177.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.9 mt -73.66 -32.7 64.13 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -177.052 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -70.27 -35.66 73.9 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 118.673 0.67 . . . . 0.0 110.029 179.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.6 mt -70.8 -40.68 76.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 36.5 t-105 -64.39 -34.65 78.66 Favored 'General case' 0 N--CA 1.456 -0.13 0 O-C-N 122.306 -0.246 . . . . 0.0 110.381 177.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -70.7 -41.07 72.44 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 122.948 0.499 . . . . 0.0 110.481 178.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 63.2 ttp180 -63.9 -41.18 97.77 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.307 0.243 . . . . 0.0 110.616 179.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 59.4 m -77.12 -14.78 59.75 Favored 'General case' 0 CA--C 1.527 0.093 0 C-N-CA 122.608 0.363 . . . . 0.0 111.763 178.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -82.77 -7.36 87.45 Favored Glycine 0 CA--C 1.526 0.765 0 CA-C-O 119.754 -0.47 . . . . 0.0 112.236 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 68.7 mt 53.93 -163.03 0.11 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.851 0.86 . . . . 0.0 111.199 -177.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.407 ' CG ' ' N ' ' A' ' 138' ' ' GLN . 35.4 t80 56.79 -166.51 0.13 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.598 0.759 . . . . 0.0 111.367 -178.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . 0.407 ' N ' ' CG ' ' A' ' 137' ' ' PHE . 54.3 mm-40 -63.68 159.1 19.82 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.071 0.548 . . . . 0.0 111.199 -179.677 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 47.3 tttp -68.29 169.79 9.91 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 122.879 0.471 . . . . 0.0 110.173 -179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 36.6 m 59.0 43.1 18.21 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 123.051 0.54 . . . . 0.0 110.405 -175.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -63.1 -9.3 10.06 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.619 1.167 . . . . 0.0 111.519 -179.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.2 tp -135.97 132.17 36.03 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 176.482 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 52.9 p-10 -101.22 -5.39 25.62 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -177.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.402 ' C ' ' H ' ' A' ' 146' ' ' ARG . . . -42.86 -38.67 2.25 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 125.39 1.476 . . . . 0.0 113.499 -176.094 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.482 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -72.13 27.87 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 C-N-CA 123.66 0.784 . . . . 0.0 112.13 175.929 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.402 ' H ' ' C ' ' A' ' 144' ' ' ALA . 18.4 mmt85 52.07 21.62 1.61 Allowed 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 124.198 0.999 . . . . 0.0 110.501 -169.477 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 6.0 t 52.35 24.83 3.1 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.964 1.305 . . . . 0.0 114.001 -177.171 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -140.69 -153.18 0.45 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -175.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 35.5 t -41.04 -30.1 0.13 Allowed 'General case' 0 C--N 1.34 0.182 0 C-N-CA 127.447 2.299 . . . . 0.0 115.629 -169.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -31.83 -72.83 0.04 OUTLIER 'General case' 0 C--N 1.34 0.178 0 C-N-CA 124.573 1.149 . . . . 0.0 111.255 -178.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . 0.444 ' HB2' HG21 ' A' ' 113' ' ' ILE . . . -112.32 -13.89 13.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 118.989 -0.529 . . . . 0.0 111.439 168.399 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 20.7 mmt -79.84 -9.4 59.66 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.206 0.912 . . . . 0.0 111.977 -177.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 31.3 t70 59.19 0.06 0.17 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 63.6 tp . . . . . 0 C--O 1.25 1.096 0 CA-C-O 117.628 -1.177 . . . . 0.0 109.587 177.276 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 85.6 t80 . . . . . 0 N--CA 1.472 0.649 0 N-CA-C 110.807 -0.071 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 61.9 m -147.44 146.93 26.51 Favored Pre-proline 0 C--N 1.341 0.237 0 C-N-CA 123.183 0.593 . . . . 0.0 109.538 178.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -76.79 163.83 30.89 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 123.654 2.903 . . . . 0.0 111.432 177.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 75.4 p 54.32 147.16 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 127.37 2.268 . . . . 0.0 115.695 177.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -85.14 -165.43 3.67 Favored 'Cis proline' 0 N--CA 1.458 -0.59 0 CA-C-N 121.16 1.45 . . . . 0.0 112.233 3.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 13.0 t -107.26 173.79 6.17 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.876 0.87 . . . . 0.0 111.713 -178.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 162' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -131.92 143.06 49.86 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 124.577 1.151 . . . . 0.0 109.265 176.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 26.7 t -121.25 137.07 26.32 Favored Pre-proline 0 N--CA 1.451 -0.386 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 176.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -66.47 -9.74 25.21 Favored 'Trans proline' 0 N--CA 1.447 -1.253 0 C-N-CA 122.912 2.408 . . . . 0.0 111.205 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 71.7 p -74.95 -19.79 59.96 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-O 118.801 -0.619 . . . . 0.0 111.76 -178.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -75.66 169.45 22.28 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 123.723 2.949 . . . . 0.0 110.213 174.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 70.4 m . . . . . 0 C--O 1.252 1.197 0 CA-C-O 117.079 -1.439 . . . . 0.0 110.88 178.612 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.7 mtm . . . . . 0 N--CA 1.476 0.868 0 N-CA-C 111.144 0.054 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 -145.95 150.56 36.29 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.721 0.408 . . . . 0.0 110.266 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -148.84 159.61 44.0 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -135.14 1.59 2.97 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 113.167 0.802 . . . . 0.0 113.167 -176.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.6 p-10 -127.53 21.53 6.55 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.87 0.468 . . . . 0.0 111.88 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -78.75 -153.15 0.07 Allowed 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.029 0.932 . . . . 0.0 110.536 177.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -54.16 -14.49 1.13 Allowed 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.477 0.711 . . . . 0.0 110.58 175.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -54.7 -36.29 64.52 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 123.041 0.537 . . . . 0.0 110.352 174.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -56.76 -48.56 77.57 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-N 119.138 0.881 . . . . 0.0 109.812 176.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -65.3 -50.32 66.15 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 120.408 0.147 . . . . 0.0 111.2 -177.023 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 62.1 t -64.56 -53.08 46.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 O-C-N 122.368 -0.208 . . . . 0.0 110.488 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.65 -31.54 70.76 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 119.588 -0.244 . . . . 0.0 111.441 -178.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 53.3 m -71.46 -40.97 69.96 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.487 177.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.9 tp -66.37 -33.38 75.59 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -67.4 -42.62 83.0 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.894 0.878 . . . . 0.0 110.079 175.271 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 66.3 m -63.8 -27.47 69.21 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 174.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.425 ' CE2' HD11 ' A' ' 68' ' ' ILE . 0.1 OUTLIER -68.99 -39.59 79.26 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 175.199 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -66.73 -30.25 70.43 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 122.614 0.366 . . . . 0.0 111.02 175.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -70.11 -27.55 64.67 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 122.576 0.351 . . . . 0.0 111.663 178.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 8.8 mp -85.53 141.41 29.9 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 175.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -143.38 14.21 1.8 Allowed 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 122.37 0.268 . . . . 0.0 111.67 -176.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 83.1 p -133.89 7.47 3.75 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -174.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 166.95 144.92 4.28 Favored Glycine 0 CA--C 1.524 0.623 0 CA-C-N 118.628 0.649 . . . . 0.0 111.775 179.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 17.1 mm -76.66 152.52 5.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 174.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.3 t -145.1 137.78 26.19 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 118.099 0.409 . . . . 0.0 111.067 -178.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -61.89 -37.97 95.24 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-O 119.267 -0.74 . . . . 0.0 112.793 -176.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.427 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 35.6 t -56.2 -44.06 79.08 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 118.438 1.119 . . . . 0.0 111.419 -173.417 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? -69.42 -44.85 70.55 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 -178.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 91.1 mt -58.52 -38.49 70.84 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.2 mmtp -73.39 -35.65 65.91 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-O 118.605 -0.712 . . . . 0.0 111.849 -178.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.427 ' HE2' ' O ' ' A' ' 27' ' ' SER . 0.1 OUTLIER -65.18 -38.47 90.61 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-N 119.516 1.053 . . . . 0.0 110.095 174.646 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.0 mt -64.06 -55.7 20.3 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 119.386 -0.34 . . . . 0.0 110.802 178.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.409 HG21 ' HB2' ' A' ' 71' ' ' SER . 41.3 p -58.01 -42.42 85.18 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 118.622 0.646 . . . . 0.0 111.066 177.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.3 m -55.65 -58.14 9.05 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 119.101 -0.476 . . . . 0.0 111.057 -179.071 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -69.12 -31.64 70.47 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 118.74 -1.184 . . . . 0.0 111.367 -175.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.54 -59.81 4.78 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.994 177.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.487 HD21 ' HB1' ' A' ' 75' ' ' ALA . 6.8 mp -68.93 -23.24 64.14 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 122.268 0.227 . . . . 0.0 111.525 -177.577 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -72.38 -18.77 61.71 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 122.205 -0.309 . . . . 0.0 111.26 176.023 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -148.6 52.53 0.99 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 117.758 0.254 . . . . 0.0 111.648 -175.142 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.508 HG22 HG22 ' A' ' 93' ' ' THR . 35.8 mm -62.84 80.96 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 121.494 0.664 . . . . 0.0 110.425 172.075 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -153.28 20.21 0.56 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.421 1.489 . . . . 0.0 108.541 175.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.579 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -148.94 34.89 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 C-N-CA 125.343 1.457 . . . . 0.0 109.114 -171.284 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.5 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -49.28 -55.28 13.22 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -176.408 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 86.6 p -75.97 -24.27 55.4 Favored 'General case' 0 CA--C 1.522 -0.106 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -173.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.644 ' CD ' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -86.0 -39.16 17.15 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 119.286 -0.388 . . . . 0.0 110.108 -179.686 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 24.3 mt -59.11 -51.65 70.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.096 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 170.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.436 ' CG1' ' HB1' ' A' ' 97' ' ' ALA . 11.5 mm -65.55 -47.26 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-O 119.281 -0.39 . . . . 0.0 111.187 -178.122 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 48.3 t -55.82 -38.29 69.82 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.232 176.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.6 tp -68.54 -43.6 76.34 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 118.954 -0.546 . . . . 0.0 112.458 -177.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 38.5 pt -73.09 -37.31 52.77 Favored 'Isoleucine or valine' 0 C--N 1.343 0.286 0 CA-C-N 119.495 1.043 . . . . 0.0 111.993 -179.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.0 mt -64.26 -50.42 76.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.469 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 38.9 t70 -63.72 -31.05 72.1 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.451 178.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -58.98 -45.19 91.18 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 173.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.9 t -67.94 -31.3 70.94 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 111.656 0.243 . . . . 0.0 111.656 177.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.469 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 53.0 tpt85 -71.12 -36.29 72.08 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.911 0.884 . . . . 0.0 112.716 -177.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 78.5 mt -93.77 -14.71 25.93 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 -176.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 92.1 m -104.73 155.85 36.85 Favored Pre-proline 0 C--N 1.331 -0.206 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -171.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -66.11 -176.69 0.66 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 1 C-N-CA 125.349 4.033 . . . . 0.0 114.004 -178.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.405 ' HB3' ' HE3' ' A' ' 115' ' ' LYS . 53.0 m-20 -56.44 -44.44 80.45 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 125.654 1.582 . . . . 0.0 114.367 -172.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.4 p -57.45 -30.27 64.88 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 178.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -86.94 -13.4 44.79 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-O 118.472 -0.775 . . . . 0.0 111.62 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -74.19 -37.5 63.91 Favored 'General case' 0 C--N 1.342 0.252 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 169.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.3 mt -65.07 -51.77 59.52 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.145 173.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.38 -39.28 90.21 Favored Glycine 0 C--N 1.337 0.635 0 N-CA-C 110.323 -1.111 . . . . 0.0 110.323 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.5 t -55.71 -59.21 5.18 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 176.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 32.5 mt -49.39 -43.47 44.33 Favored 'General case' 0 C--O 1.228 -0.054 0 CA-C-O 118.837 -0.601 . . . . 0.0 111.625 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -66.96 -34.11 77.06 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 119.24 -0.984 . . . . 0.0 111.471 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.425 HD11 ' CE2' ' A' ' 17' ' ' PHE . 69.3 mt -72.13 -48.63 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 O-C-N 122.003 -0.436 . . . . 0.0 111.19 178.069 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 1.8 mp -59.46 -37.18 68.56 Favored 'Isoleucine or valine' 0 C--N 1.339 0.119 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -71.33 -39.42 71.37 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 119.414 -0.327 . . . . 0.0 111.285 -177.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.447 ' HB3' ' CE2' ' B' ' 162' ' ' TYR . 89.9 p -69.34 -52.96 22.2 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.527 0.603 . . . . 0.0 111.012 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 35.1 mt -66.47 -36.31 77.0 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 CA-C-N 118.166 0.439 . . . . 0.0 110.205 179.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.91 -44.6 91.49 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.651 -0.579 . . . . 0.0 111.651 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.426 ' CD ' ' HD3' ' B' ' 167' ' ' PRO . 32.6 ttm105 -67.39 -40.12 85.63 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 117.107 0.453 . . . . 0.0 110.528 178.078 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.487 ' HB1' HD21 ' A' ' 37' ' ' LEU . . . -68.78 -41.29 78.99 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.43 -179.018 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -64.15 -49.2 73.04 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 175.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.45 -46.51 83.54 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -62.49 -44.68 95.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 122.439 -0.163 . . . . 0.0 110.797 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -64.89 -40.1 94.57 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -176.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.7 t -84.61 -20.15 31.86 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -177.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 25.9 mmm180 -87.42 -23.14 24.6 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-N 118.775 0.716 . . . . 0.0 111.651 174.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 28.2 t -74.97 -12.32 60.31 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.833 0.453 . . . . 0.0 111.763 177.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -131.68 168.46 17.71 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.479 0.712 . . . . 0.0 110.186 -177.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 34.3 t -78.11 148.42 34.2 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 178.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 51.5 p30 -149.52 167.16 27.04 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.304 0.641 . . . . 0.0 110.759 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.7 m -145.59 165.28 29.13 Favored 'General case' 0 C--O 1.231 0.119 0 C-N-CA 122.976 0.51 . . . . 0.0 110.914 -177.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 44.6 m -72.39 164.35 26.49 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 122.979 0.512 . . . . 0.0 110.887 178.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 93.1 p -145.96 170.36 16.78 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 122.964 0.505 . . . . 0.0 110.487 -178.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -121.17 -12.96 8.6 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 122.592 0.357 . . . . 0.0 111.945 -179.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.575 ' H ' ' CD ' ' A' ' 91' ' ' PRO . 23.7 tptm -151.66 -42.12 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.342 0 CA-C-O 118.595 -0.717 . . . . 0.0 112.095 177.207 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.575 ' CD ' ' H ' ' A' ' 90' ' ' LYS . 40.8 Cg_exo -60.11 159.67 25.28 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.597 2.198 . . . . 0.0 111.956 173.453 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -170.04 156.31 26.88 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 111.429 -0.668 . . . . 0.0 111.429 178.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.508 HG22 HG22 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -155.39 -153.37 0.44 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.786 0.834 . . . . 0.0 109.422 -179.65 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 28.4 p -47.81 -31.55 5.08 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -177.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.43 -44.23 91.84 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.272 -0.892 . . . . 0.0 110.244 176.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -72.26 -25.58 61.67 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 122.612 0.365 . . . . 0.0 110.225 177.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.436 ' HB1' ' CG1' ' A' ' 47' ' ' ILE . . . -65.24 -45.36 84.94 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.026 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.14 -43.13 98.71 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -60.57 -33.51 72.81 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.803 -0.181 . . . . 0.0 111.344 178.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.4 m -74.76 -40.75 61.02 Favored 'General case' 0 C--N 1.338 0.072 0 CA-C-O 119.686 -0.197 . . . . 0.0 110.974 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 48.7 mt -61.94 -29.45 70.24 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 173.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.76 -14.54 16.01 Favored Glycine 0 CA--C 1.53 1.027 0 CA-C-O 118.911 -0.939 . . . . 0.0 113.829 178.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -102.2 -6.6 23.0 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.085 1.442 . . . . 0.0 112.002 -179.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 35.4 m -121.29 -16.78 6.13 Favored 'Isoleucine or valine' 0 C--N 1.338 0.079 0 C-N-CA 122.917 0.487 . . . . 0.0 111.904 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.6 tp -52.79 -27.34 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 C-N-CA 123.039 0.536 . . . . 0.0 111.642 179.262 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -60.6 -58.45 8.44 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 122.598 0.359 . . . . 0.0 110.965 178.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -74.53 -29.36 61.35 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 122.403 0.281 . . . . 0.0 111.092 -177.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 49.2 tp -63.92 -54.87 27.82 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 179.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.451 ' O ' HG13 ' A' ' 113' ' ' ILE . 87.0 mt -63.0 -63.86 1.08 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.51 -0.757 . . . . 0.0 109.156 176.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.509 ' HB2' ' CZ ' ' A' ' 150' ' ' PHE . 87.5 p -40.49 -49.48 2.9 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -177.633 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -73.6 -38.74 65.02 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 119.821 1.191 . . . . 0.0 112.109 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.52 -48.14 82.8 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.802 0.728 . . . . 0.0 110.706 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 109' ' ' LEU . 0.2 OUTLIER -76.01 -34.62 27.39 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 117.963 0.347 . . . . 0.0 111.774 -179.69 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.72 -27.51 67.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 119.585 -0.846 . . . . 0.0 109.81 179.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.405 ' HE3' ' HB3' ' A' ' 59' ' ' ASP . 3.3 tmtt? -78.43 -26.94 46.44 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.308 0.643 . . . . 0.0 110.986 175.679 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.436 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 53.6 p -69.05 153.17 44.23 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -168.217 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -89.58 175.76 7.15 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 125.045 1.338 . . . . 0.0 108.439 172.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -55.84 -41.96 75.07 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 119.253 0.933 . . . . 0.0 111.838 -178.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -69.25 -38.89 78.66 Favored 'General case' 0 C--O 1.232 0.173 0 O-C-N 121.666 -0.646 . . . . 0.0 110.479 179.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.436 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 46.9 m170 -72.19 -39.19 68.79 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 119.397 -0.335 . . . . 0.0 111.188 -178.314 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.84 -36.41 83.4 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 176.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -62.09 -44.46 96.62 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.43 177.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -63.15 -43.89 97.06 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 117.545 0.157 . . . . 0.0 111.394 177.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 96.6 mt -68.03 -38.69 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-N 117.781 0.264 . . . . 0.0 110.546 -179.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -68.68 -33.97 74.88 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.3 0.24 . . . . 0.0 110.504 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 64.1 ttp -68.31 -43.87 76.68 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 176.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.41 ' C ' HD23 ' A' ' 127' ' ' LEU . 7.6 tt -57.8 -47.46 82.52 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 178.115 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.4 mt -71.9 -31.23 66.2 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 111.76 0.281 . . . . 0.0 111.76 -179.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -65.54 -39.83 92.19 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 118.29 0.496 . . . . 0.0 109.787 177.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 96.5 mt -70.54 -39.41 76.09 Favored 'Isoleucine or valine' 0 C--N 1.339 0.147 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 176.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 70.4 t-105 -65.87 -24.74 66.93 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.673 0.389 . . . . 0.0 111.147 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -87.77 -34.09 18.44 Favored 'General case' 0 N--CA 1.453 -0.3 0 O-C-N 122.124 -0.36 . . . . 0.0 111.07 174.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -72.14 -24.25 61.42 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 122.923 0.489 . . . . 0.0 111.439 -178.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 96.6 p -63.39 -14.65 52.5 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 117.914 0.324 . . . . 0.0 111.744 176.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 81.57 3.41 90.63 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-O 119.448 -0.64 . . . . 0.0 113.183 176.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 46.9 tp -147.46 143.89 28.22 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 118.313 1.056 . . . . 0.0 110.104 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -145.41 -179.07 6.41 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.193 0.597 . . . . 0.0 110.735 -177.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 7.3 pm0 -64.04 170.46 3.57 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 123.481 0.712 . . . . 0.0 112.447 -176.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 49.7 mmtm -66.73 165.2 15.48 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.3 0.64 . . . . 0.0 111.059 179.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 10.0 t 59.72 -177.7 0.09 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.669 0.788 . . . . 0.0 111.74 -175.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -71.8 162.13 29.91 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.136 0.493 . . . . 0.0 111.725 -177.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -106.54 25.93 10.56 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.816 0.846 . . . . 0.0 111.644 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . 0.454 ' HA ' ' HB3' ' A' ' 146' ' ' ARG . 25.9 t-20 -55.9 -16.39 4.6 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.734 0.814 . . . . 0.0 112.41 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -46.43 -36.69 6.79 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.98 1.712 . . . . 0.0 112.141 -172.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.581 HD13 ' H ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -121.09 -14.15 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-O 119.632 -0.223 . . . . 0.0 111.568 170.95 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.454 ' C ' ' H ' ' A' ' 148' ' ' LYS . 37.4 ttp180 -62.09 -14.58 37.97 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 117.925 0.33 . . . . 0.0 110.986 179.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 10.4 t -61.2 2.07 0.15 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 120.534 0.207 . . . . 0.0 111.528 169.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.454 ' H ' ' C ' ' A' ' 146' ' ' ARG . 40.0 ttmt 62.94 -50.35 0.19 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 128.536 2.734 . . . . 0.0 116.919 172.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 26.1 p -47.36 -34.89 7.47 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.466 1.03 . . . . 0.0 112.014 -172.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . 0.509 ' CZ ' ' HB2' ' A' ' 110' ' ' SER . 35.2 m-85 -55.17 -100.27 0.0 OUTLIER 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 125.679 1.592 . . . . 0.0 113.86 -177.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -69.38 -14.06 62.7 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -178.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 23.4 mtm -106.96 -12.5 15.43 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.298 1.221 . . . . 0.0 114.298 -172.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -125.54 -14.3 6.36 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 120.231 1.378 . . . . 0.0 112.174 172.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 30.1 tp . . . . . 0 C--O 1.25 1.099 0 C-N-CA 125.39 1.476 . . . . 0.0 112.25 -179.522 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 155' ' ' TYR . . . . . . . . . . . . . 53.4 p90 . . . . . 0 N--CA 1.473 0.714 0 N-CA-C 110.632 -0.136 . . . . 0.0 110.632 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 156' ' ' SER . . . . . . . . . . . . . 46.3 t -154.26 146.56 17.36 Favored Pre-proline 0 CA--C 1.53 0.205 0 C-N-CA 122.793 0.437 . . . . 0.0 110.131 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -72.4 1.24 6.37 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 123.492 2.795 . . . . 0.0 112.12 176.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 73.5 p -133.14 170.29 15.62 Favored 'General case' 0 C--O 1.232 0.144 0 C-N-CA 123.54 0.736 . . . . 0.0 109.978 179.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 159' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 160' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.36 -49.65 0.19 OUTLIER 'Cis proline' 0 N--CA 1.454 -0.824 0 CA-C-N 119.436 0.834 . . . . 0.0 111.357 -3.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 38.8 t -177.97 152.08 0.72 Allowed 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.046 0.938 . . . . 0.0 109.351 176.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 162' ' ' TYR . . . . . 0.447 ' CE2' ' HB3' ' A' ' 71' ' ' SER . 44.5 t80 -152.25 125.86 8.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.732 0.301 . . . . 0.0 110.933 169.516 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 9.3 t -131.93 148.77 71.18 Favored Pre-proline 0 N--CA 1.453 -0.32 0 C-N-CA 124.607 1.163 . . . . 0.0 109.558 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 164' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_exo -58.22 -1.46 0.65 Allowed 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 123.607 2.871 . . . . 0.0 112.954 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 165' ' ' THR . . . . . . . . . . . . . 28.0 m -76.58 -34.38 58.43 Favored 'General case' 0 N--CA 1.456 -0.159 0 O-C-N 122.226 -0.297 . . . . 0.0 111.139 -179.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 166' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . 0.426 ' HD3' ' CD ' ' A' ' 74' ' ' ARG . 41.9 Cg_endo -81.55 -7.17 12.68 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 123.605 2.87 . . . . 0.0 113.694 -173.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 C--O 1.252 1.235 0 CA-C-O 117.016 -1.469 . . . . 0.0 111.145 -174.932 . . . . . . . . 0 0 . 1 stop_ save_